data_4b2u_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 4b2u _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.463 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 61.7 m . . . . . 0 N--CA 1.453 -0.302 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 71.9 mt -63.11 130.56 27.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -68.01 154.74 40.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.769 0.795 . . . . 0.0 111.701 -173.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.502 HD21 ' ND1' ' A' ' 22' ' ' HIS . 0.4 OUTLIER -66.67 120.48 13.54 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.606 -173.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.453 ' HA2' ' NH1' ' A' ' 34' ' ' ARG . . . 116.57 -15.38 14.69 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.772 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.546 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 16.6 mm-40 -84.82 165.92 17.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.195 0.522 . . . . 0.0 111.61 -177.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.546 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -82.57 141.88 32.23 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.735 179.361 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.517 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 18.6 p -126.56 153.33 75.3 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.76 178.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -70.14 169.11 20.18 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.498 2.132 . . . . 0.0 110.853 172.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -50.02 119.89 10.9 Favored Pre-proline 0 C--N 1.328 -0.348 0 O-C-N 123.351 0.407 . . . . 0.0 110.797 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -56.41 -16.08 17.13 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 123.886 3.057 . . . . 0.0 113.938 -175.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 23.8 mmt180 -63.88 -21.53 66.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.084 0.469 . . . . 0.0 110.39 176.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -81.42 -10.3 59.54 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.653 177.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 120.33 135.88 5.04 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 111.514 -0.635 . . . . 0.0 111.514 -177.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -77.64 103.88 7.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.282 0.541 . . . . 0.0 110.327 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.463 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 5.3 m-90 -94.55 8.42 42.29 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-O 121.995 0.902 . . . . 0.0 109.093 172.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.556 ' C ' ' H ' ' A' ' 22' ' ' HIS . 56.1 m -84.75 -2.34 57.5 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 113.903 -1.499 . . . . 0.0 112.087 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.8 m -18.56 28.28 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 118.737 2.866 . . . . 0.0 118.737 -138.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.556 ' H ' ' C ' ' A' ' 20' ' ' CYS . 49.7 m80 -94.77 -82.39 0.37 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 153.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -155.26 131.34 10.15 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.192 165.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.444 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 43.3 t -87.01 100.21 12.45 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 170.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 4.9 p -121.93 138.96 29.43 Favored Pre-proline 0 C--N 1.312 -1.041 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.548 -166.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -66.51 120.02 7.1 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.385 2.056 . . . . 0.0 112.394 177.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -119.87 84.36 2.2 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.284 -0.871 . . . . 0.0 108.809 177.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 85.02 -110.93 3.45 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.207 -0.997 . . . . 0.0 111.927 -174.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.457 ' HZ1' ' HB3' ' A' ' 29' ' ' LYS . 0.9 OUTLIER -106.63 -7.94 17.16 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.374 -0.486 . . . . 0.0 111.969 -177.352 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -119.27 172.5 7.56 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.011 0.434 . . . . 0.0 110.6 -178.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 1.633 ' HD1' ' CD2' ' A' ' 31' ' ' PHE . 91.1 m-85 -109.59 140.53 43.29 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.476 -0.784 . . . . 0.0 108.962 173.179 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 1.641 ' HE1' ' CE2' ' A' ' 32' ' ' TYR . 74.5 m-85 -136.37 149.54 48.38 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.818 0.342 . . . . 0.0 110.621 -178.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 65.9 m -78.52 96.49 5.44 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 173.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.453 ' NH1' ' HA2' ' A' ' 8' ' ' GLY . 40.4 mmt180 -119.03 165.3 14.29 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.132 -175.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -103.09 86.96 2.79 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 170.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 . . . . . 0 C--O 1.246 0.885 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.766 -170.798 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 20.1 p . . . . . 0 N--CA 1.469 0.476 0 N-CA-C 110.916 -0.031 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.415 ' HB ' ' SG ' ' A' ' 33' ' ' CYS . 79.6 mt -77.09 133.48 30.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 178.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.459 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 2.4 pm0 -66.0 149.46 50.21 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 121.841 0.829 . . . . 0.0 110.61 -178.341 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.413 HD21 ' CG ' ' A' ' 22' ' ' HIS . 0.8 OUTLIER -68.78 121.35 16.34 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.726 -1.124 . . . . 0.0 110.682 -171.468 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.421 ' HA2' ' NH1' ' A' ' 34' ' ' ARG . . . 118.61 -21.33 9.83 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.834 -179.212 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.459 ' CG ' ' HG2' ' A' ' 6' ' ' GLU . 14.1 mm-40 -83.09 170.9 14.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.091 0.472 . . . . 0.0 111.64 -175.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.464 ' N ' ' HD3' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -81.94 143.48 31.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.205 179.316 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.424 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 14.2 p -122.76 149.58 56.48 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.347 177.136 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.36 159.88 51.44 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.308 2.005 . . . . 0.0 110.347 172.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 50.5 t-20 -50.61 117.2 7.9 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.463 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 11.6 Cg_endo -55.61 -27.69 61.67 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 123.372 2.715 . . . . 0.0 114.023 -171.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.74 -12.78 60.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.209 0.528 . . . . 0.0 110.494 178.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -105.49 13.82 29.55 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.152 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.17 107.3 2.05 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.248 -179.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -96.72 116.99 30.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.779 0.323 . . . . 0.0 110.859 -178.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.509 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 35.6 m95 -116.92 20.95 13.62 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 176.346 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.606 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -80.02 -6.93 58.47 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -171.348 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.7 p -18.06 30.94 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 118.088 2.625 . . . . 0.0 118.088 -141.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.606 ' H ' ' C ' ' A' ' 20' ' ' CYS . 76.9 m80 -113.07 -83.98 0.59 Allowed 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 162.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -154.04 125.24 7.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.03 167.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.492 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 45.4 t -88.02 88.58 7.69 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 172.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 5.8 p -107.98 135.4 19.86 Favored Pre-proline 0 N--CA 1.44 -0.971 0 CA-C-N 115.074 -0.967 . . . . 0.0 109.895 -168.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -67.24 119.13 6.13 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.237 1.958 . . . . 0.0 112.209 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -105.27 76.74 1.25 Allowed 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.92 -110.33 3.3 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.099 -1.048 . . . . 0.0 110.647 -169.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -94.95 -34.37 12.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.939 0.399 . . . . 0.0 111.06 179.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -92.56 171.1 9.24 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.977 0.417 . . . . 0.0 111.087 -172.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 1.613 ' HD2' ' CD1' ' A' ' 31' ' ' PHE . 94.0 m-85 -114.64 140.67 48.63 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.115 177.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -137.68 147.81 45.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.201 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.415 ' SG ' ' HB ' ' A' ' 5' ' ' ILE . 95.2 m -78.2 101.29 7.01 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 175.558 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.421 ' NH1' ' HA2' ' A' ' 8' ' ' GLY . 25.9 mmt180 -113.56 160.55 18.41 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.339 179.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -103.13 88.1 3.06 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 . . . . . 0 C--O 1.246 0.879 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.273 -173.775 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 82.3 m . . . . . 0 N--CA 1.45 -0.429 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.437 HG13 ' HB2' ' A' ' 19' ' ' TRP . 91.4 mt -67.29 130.15 32.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.937 -177.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.436 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.5 pm0 -66.19 149.97 49.5 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.234 -0.893 . . . . 0.0 111.423 -176.055 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.18 121.23 14.28 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.549 -1.205 . . . . 0.0 111.039 -172.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 113.73 -11.72 23.08 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.003 -0.617 . . . . 0.0 112.551 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -87.14 168.33 13.35 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.364 0.602 . . . . 0.0 111.939 -179.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.478 ' HD2' ' O ' ' A' ' 31' ' ' PHE . 9.0 mmm180 -81.07 139.51 35.65 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.377 177.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.545 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 17.9 p -121.48 142.28 35.21 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.942 178.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -62.04 144.49 96.21 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 122.13 1.886 . . . . 0.0 110.117 169.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.562 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 3.2 m-20 -49.37 123.8 13.87 Favored Pre-proline 0 C--N 1.328 -0.338 0 O-C-N 123.787 0.679 . . . . 0.0 110.622 -178.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.579 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 9.2 Cg_endo -52.51 -21.6 14.54 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 123.543 2.829 . . . . 0.0 113.53 -174.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.549 ' HD3' ' N ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -59.56 -22.06 61.19 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 175.903 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.562 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 10.2 pt-20 -118.36 19.34 13.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.921 0.391 . . . . 0.0 111.14 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 96.96 110.32 2.72 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.992 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -113.65 133.7 55.16 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 176.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.437 ' HB2' HG13 ' A' ' 5' ' ' ILE . 1.1 m95 -101.13 22.45 12.31 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.618 ' C ' ' H ' ' A' ' 22' ' ' HIS . 1.6 m -57.57 -6.25 0.46 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 -175.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 16.2 m -17.34 31.54 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 117.753 2.501 . . . . 0.0 117.753 -140.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.618 ' H ' ' C ' ' A' ' 20' ' ' CYS . 71.0 m80 -112.35 -84.4 0.58 Allowed 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 160.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -154.15 127.03 8.23 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.396 169.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.579 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 42.9 t -88.23 89.92 8.18 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 172.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.7 p -109.29 138.99 20.63 Favored Pre-proline 0 N--CA 1.439 -0.98 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.96 -169.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -65.89 119.07 6.04 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.137 1.892 . . . . 0.0 111.857 178.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.414 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 7.3 mm-40 -113.26 77.28 1.04 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.023 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.92 -110.42 3.31 Favored Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 119.972 -1.108 . . . . 0.0 111.566 -176.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.474 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 10.3 ptpp? -99.5 -5.67 28.88 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -175.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.474 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 96.2 mtt180 -136.38 178.3 7.17 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.617 0.246 . . . . 0.0 110.553 -177.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.478 ' O ' ' HD2' ' A' ' 10' ' ' ARG . 69.4 m-85 -112.46 142.99 44.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.694 178.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.414 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 55.4 m-85 -138.5 151.41 47.35 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.096 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 70.8 m -78.67 103.71 8.79 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 174.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -117.02 161.33 19.57 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.217 -178.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -100.68 88.18 3.54 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.31 0.576 . . . . 0.0 109.639 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.536 -0.745 . . . . 0.0 109.77 179.486 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 14.2 p . . . . . 0 N--CA 1.451 -0.404 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 77.1 mt -79.95 134.03 28.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -78.69 160.76 27.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.514 0.673 . . . . 0.0 111.339 -177.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.466 HD21 ' ND1' ' A' ' 22' ' ' HIS . 0.5 OUTLIER -63.66 127.22 30.38 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.793 -174.457 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.71 -9.48 44.36 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 115.715 -0.675 . . . . 0.0 113.077 177.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -91.6 175.34 6.94 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.013 0.435 . . . . 0.0 111.447 -177.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.5 mmt85 -80.18 150.52 30.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.44 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.512 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 26.4 p -136.58 148.66 64.62 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.865 175.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.29 149.37 45.29 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.238 1.959 . . . . 0.0 110.581 171.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -48.98 120.39 9.42 Favored Pre-proline 0 C--N 1.33 -0.244 0 O-C-N 123.809 0.693 . . . . 0.0 110.637 -178.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.566 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 14.3 Cg_endo -56.08 -16.52 16.97 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.617 2.878 . . . . 0.0 113.435 -175.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -61.61 -31.7 71.78 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.729 0.299 . . . . 0.0 110.738 176.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -100.24 12.9 35.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.853 0.359 . . . . 0.0 110.63 178.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 88.56 108.9 1.08 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.301 -177.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.577 ' OD1' ' HB2' ' A' ' 20' ' ' CYS . 3.0 p30 -102.14 148.78 24.99 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.047 0.451 . . . . 0.0 110.427 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.505 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 26.8 m95 -106.5 31.0 5.53 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.431 0.634 . . . . 0.0 109.318 176.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.577 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 0.0 OUTLIER -68.1 -6.55 23.52 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 -174.896 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.0 p -20.35 29.22 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 118.584 2.809 . . . . 0.0 118.584 -138.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.575 ' H ' ' C ' ' A' ' 20' ' ' CYS . 3.4 m80 -106.0 -83.63 0.52 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 157.026 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.478 ' HA ' ' HE3' ' A' ' 23' ' ' LYS . 1.6 tpmt? -154.83 123.79 6.24 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.973 171.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.566 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 47.8 t -87.29 93.88 9.51 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 173.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.8 p -110.74 133.56 21.17 Favored Pre-proline 0 N--CA 1.439 -1.024 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.348 -171.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -67.36 121.66 8.81 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.496 2.131 . . . . 0.0 112.412 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -111.59 78.87 1.15 Allowed 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 173.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.5 -116.45 4.23 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -175.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -94.25 -8.09 40.15 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.5 0.667 . . . . 0.0 110.092 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 68.3 mtm180 -110.05 171.51 7.41 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.859 -174.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.443 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 94.0 m-85 -129.01 139.1 52.22 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.529 175.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -139.39 152.39 47.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.901 0.382 . . . . 0.0 110.656 -179.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 88.8 m -80.3 103.08 9.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.757 174.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -119.29 161.61 20.14 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.474 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -95.58 88.85 5.17 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.41 0.624 . . . . 0.0 109.824 178.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 . . . . . 0 C--O 1.247 0.969 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.541 -179.408 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 84.6 m . . . . . 0 N--CA 1.452 -0.367 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 83.7 mt -80.35 122.32 35.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 174.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -61.88 145.31 53.14 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.772 0.796 . . . . 0.0 111.271 -174.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.64 124.84 23.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.55 -1.205 . . . . 0.0 110.829 -171.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 115.26 -21.21 13.32 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.771 -177.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -79.48 173.8 12.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.194 0.521 . . . . 0.0 111.789 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.474 ' H ' ' HD3' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -80.67 155.78 26.64 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.82 172.964 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.1 p -136.45 146.07 54.29 Favored Pre-proline 0 C--N 1.319 -0.736 0 C-N-CA 121.156 -0.217 . . . . 0.0 110.545 176.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -65.8 161.29 39.83 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.404 2.069 . . . . 0.0 110.85 172.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -49.92 118.61 8.99 Favored Pre-proline 0 C--N 1.33 -0.278 0 O-C-N 123.584 0.552 . . . . 0.0 110.919 -179.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.472 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 11.6 Cg_endo -57.46 -23.87 58.15 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.897 2.398 . . . . 0.0 112.568 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -68.18 -24.53 64.97 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.305 175.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -98.76 0.29 44.15 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.886 0.374 . . . . 0.0 110.513 -177.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.16 95.62 2.4 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.38 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.459 ' OD2' ' HB2' ' A' ' 20' ' ' CYS . 4.2 p-10 -99.86 148.68 24.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.079 0.466 . . . . 0.0 110.521 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -107.4 31.17 5.61 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.568 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -71.83 -8.78 56.38 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -171.092 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 24.6 p -19.86 29.38 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 118.576 2.806 . . . . 0.0 118.576 -140.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.568 ' H ' ' C ' ' A' ' 20' ' ' CYS . 17.3 m80 -103.02 -88.91 0.39 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 157.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.9 ttmm -155.83 124.62 6.02 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 120.756 0.312 . . . . 0.0 110.488 169.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.472 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 53.5 t -90.72 104.29 16.9 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 176.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.1 m -111.63 150.32 42.04 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.6 -173.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -76.52 118.96 5.04 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 122.629 2.219 . . . . 0.0 111.997 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -113.78 75.76 0.94 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.011 178.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.1 -111.73 3.32 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.488 -0.863 . . . . 0.0 111.948 -178.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.412 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 18.6 ptpt -85.62 -23.66 27.44 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -176.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.412 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 65.0 mtt180 -127.72 168.86 14.51 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.916 0.389 . . . . 0.0 111.139 -174.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 1.643 ' HD1' ' CD2' ' A' ' 31' ' ' PHE . 93.4 m-85 -105.71 144.15 32.85 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.93 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 1.653 ' HE1' ' CE2' ' A' ' 32' ' ' TYR . 44.2 m-85 -135.48 149.92 49.66 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.148 0.499 . . . . 0.0 110.749 -178.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.84 105.43 15.61 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.46 -176.294 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -122.04 163.29 19.65 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.767 -175.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -110.39 89.6 3.08 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.312 0.577 . . . . 0.0 111.041 -177.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.372 -0.823 . . . . 0.0 109.58 175.813 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 15.1 p . . . . . 0 CA--C 1.538 0.488 0 CA-C-O 120.535 0.207 . . . . 0.0 111.294 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 95.9 mt -75.51 137.65 22.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 122.067 -0.396 . . . . 0.0 110.844 -175.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -65.07 147.43 53.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.712 0.768 . . . . 0.0 111.78 -176.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.43 119.71 15.97 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.801 -1.091 . . . . 0.0 109.72 -177.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.54 -16.64 28.89 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.718 -0.673 . . . . 0.0 112.309 -174.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.489 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 10.4 mm-40 -80.83 168.76 18.41 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.045 0.45 . . . . 0.0 111.341 -178.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.489 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -83.86 137.02 33.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.594 177.409 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.6 p -126.61 156.28 73.52 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 116.853 -0.158 . . . . 0.0 111.376 -175.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -72.73 156.21 53.41 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.706 2.271 . . . . 0.0 111.363 173.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.469 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 52.1 t-20 -50.83 118.2 9.68 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.003 -177.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.48 ' HA ' ' HB3' ' A' ' 18' ' ' ASP . 19.1 Cg_endo -59.47 -17.25 39.92 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.129 2.553 . . . . 0.0 113.147 -177.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -66.16 -25.34 66.91 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.698 0.285 . . . . 0.0 110.84 177.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 12.2 pt-20 -105.43 18.77 21.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.048 0.451 . . . . 0.0 110.441 177.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 91.13 104.0 1.32 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.091 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.48 ' HB3' ' HA ' ' A' ' 14' ' ' PRO . 19.0 p-10 -94.05 124.28 37.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.079 0.466 . . . . 0.0 110.813 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.463 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 12.6 m95 -84.06 38.8 0.67 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.91 0.862 . . . . 0.0 108.818 177.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.611 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -85.14 -5.84 59.32 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.242 -1.345 . . . . 0.0 113.124 -170.339 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.2 p -16.4 30.0 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 118.265 2.691 . . . . 0.0 118.265 -140.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.611 ' H ' ' C ' ' A' ' 20' ' ' CYS . 31.3 m80 -107.07 -94.42 0.38 Allowed 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 153.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.564 ' HE2' ' HA ' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -156.37 118.92 4.06 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 120.89 0.376 . . . . 0.0 111.295 168.689 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.534 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 42.8 t -80.0 124.04 28.35 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 173.465 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.1 m -130.36 159.19 71.81 Favored Pre-proline 0 C--N 1.317 -0.815 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.226 -176.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -80.7 120.08 3.82 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.812 2.341 . . . . 0.0 112.303 -177.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.458 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 10.8 mm-40 -113.03 75.5 0.92 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.246 -0.888 . . . . 0.0 108.99 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.8 -111.04 3.61 Favored Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 120.239 -0.981 . . . . 0.0 111.929 -176.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.6 pttm -79.72 -29.65 40.72 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -175.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -125.54 175.7 7.36 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.956 0.408 . . . . 0.0 111.356 -174.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 1.62 ' HD1' ' CD2' ' A' ' 31' ' ' PHE . 97.2 m-85 -110.79 141.27 44.34 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.379 -179.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 1.657 ' HD2' ' CD1' ' A' ' 32' ' ' TYR . 27.8 m-85 -131.31 149.4 52.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.441 -178.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -84.1 110.25 18.34 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.794 -177.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.5 mmt180 -120.75 160.77 22.67 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.717 -176.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -98.14 88.15 4.13 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.677 0.751 . . . . 0.0 110.595 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 . . . . . 0 C--O 1.246 0.878 0 CA-C-O 118.495 -0.764 . . . . 0.0 110.376 178.34 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 82.1 mt -73.46 134.4 29.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.159 0.504 . . . . 0.0 111.31 -173.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.426 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 3.8 mp0 -59.45 151.24 24.43 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.028 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.467 HD21 ' CG ' ' A' ' 22' ' ' HIS . 1.4 tm? -75.2 121.49 22.21 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.444 -178.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 107.72 -5.51 34.94 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.161 -176.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.426 ' HG3' ' HB2' ' A' ' 6' ' ' GLU . 8.7 mm-40 -91.19 170.95 9.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.707 0.289 . . . . 0.0 110.237 178.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.13 150.52 25.48 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 25.4 p -129.64 145.81 58.54 Favored Pre-proline 0 C--N 1.318 -0.781 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.308 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -68.04 154.07 73.49 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.039 1.826 . . . . 0.0 110.325 173.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -49.17 121.76 11.24 Favored Pre-proline 0 C--N 1.33 -0.257 0 O-C-N 123.748 0.655 . . . . 0.0 109.92 -177.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.464 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 10.3 Cg_endo -51.84 -26.48 24.34 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.73 2.953 . . . . 0.0 114.14 -172.479 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -77.38 -12.41 59.95 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.727 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -101.54 13.64 34.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.885 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.75 80.7 1.14 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.621 178.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -88.65 147.2 24.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.002 0.43 . . . . 0.0 110.586 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.7 m0 -106.25 29.79 6.49 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 174.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.565 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.5 OUTLIER -63.97 -8.01 10.17 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 -171.241 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 11.5 p -20.8 30.17 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 118.462 2.764 . . . . 0.0 118.462 -141.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.565 ' H ' ' C ' ' A' ' 20' ' ' CYS . 78.3 m80 -111.07 -83.48 0.57 Allowed 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 164.135 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.405 ' HG2' ' HB ' ' A' ' 25' ' ' VAL . 24.9 ttmm -154.92 118.84 4.61 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.974 168.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.464 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 20.1 t -82.55 89.64 6.7 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 173.285 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.405 ' HB ' ' HG2' ' A' ' 23' ' ' LYS . 7.1 p -109.48 135.81 20.29 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.093 -170.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -64.15 119.53 6.6 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.06 1.84 . . . . 0.0 111.918 178.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -111.69 75.79 0.94 Allowed 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 178.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 82.93 -109.92 3.17 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 119.542 -1.313 . . . . 0.0 111.369 -173.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.52 ' HB2' ' HZ3' ' A' ' 29' ' ' LYS . 4.6 ttmp? -91.77 -35.51 14.08 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.843 0.354 . . . . 0.0 111.569 -177.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -103.62 178.26 4.61 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.074 0.464 . . . . 0.0 111.199 -173.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -116.34 140.08 49.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.745 176.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -139.44 150.53 45.34 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.765 0.317 . . . . 0.0 110.541 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.434 ' O ' HD23 ' A' ' 7' ' ' LEU . 67.4 m -77.58 103.25 7.41 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.047 176.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -116.5 157.94 24.41 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.231 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -104.95 88.76 2.96 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 177.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.705 -0.664 . . . . 0.0 109.881 -179.968 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 77.6 m . . . . . 0 N--CA 1.447 -0.617 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 83.2 mt -68.99 136.69 25.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 176.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -62.12 148.27 44.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.663 0.744 . . . . 0.0 110.995 -178.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.464 HD21 ' CG ' ' A' ' 22' ' ' HIS . 1.0 OUTLIER -74.28 117.62 16.31 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.937 -1.028 . . . . 0.0 110.008 -175.041 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 114.24 -13.77 21.25 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.131 -175.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -82.3 170.71 15.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.008 0.432 . . . . 0.0 110.799 -179.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.454 ' N ' ' HD3' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -87.23 141.31 28.75 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.588 178.118 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.447 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 26.1 p -127.42 148.46 66.51 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.85 161.72 44.14 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.282 1.988 . . . . 0.0 111.021 175.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -50.05 118.35 8.83 Favored Pre-proline 0 C--N 1.329 -0.311 0 O-C-N 123.462 0.476 . . . . 0.0 109.886 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -54.03 -19.29 15.41 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 123.433 2.756 . . . . 0.0 113.501 -174.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.4 mmm180 -68.16 -18.46 64.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.897 177.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -92.85 -4.7 52.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.507 178.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 125.56 98.04 1.13 Allowed Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.589 -175.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -78.24 114.07 16.79 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.819 0.342 . . . . 0.0 110.859 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 3.5 m0 -110.44 13.68 22.72 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.265 176.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.65 ' C ' ' H ' ' A' ' 22' ' ' HIS . 51.2 t -74.03 -9.21 58.4 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -176.503 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.7 p -17.69 31.62 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 117.643 2.46 . . . . 0.0 117.643 -138.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.65 ' H ' ' C ' ' A' ' 20' ' ' CYS . 73.3 m80 -99.38 -87.37 0.36 Allowed 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 159.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -155.1 117.84 4.31 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.297 164.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 45.4 t -80.37 91.03 5.63 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 172.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.4 p -110.15 138.99 20.98 Favored Pre-proline 0 C--N 1.313 -0.99 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.244 -167.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -59.73 119.7 7.07 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.212 1.941 . . . . 0.0 111.536 177.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -120.81 77.61 1.31 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.38 -0.827 . . . . 0.0 108.945 -177.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.26 -111.09 3.42 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.307 -0.949 . . . . 0.0 111.528 -174.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -94.64 -24.6 17.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.872 0.368 . . . . 0.0 111.331 -177.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -119.47 176.29 5.42 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.482 -174.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 1.662 ' HD2' ' CD1' ' A' ' 31' ' ' PHE . 97.3 m-85 -103.14 140.72 36.96 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.897 176.067 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 1.664 ' HE2' ' CE1' ' A' ' 32' ' ' TYR . 25.7 m-85 -132.05 150.41 52.16 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.284 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.461 ' O ' HD23 ' A' ' 7' ' ' LEU . 6.2 t -84.14 97.31 9.28 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -114.43 160.51 19.08 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.382 -174.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -103.9 90.07 3.5 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.005 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 . . . . . 0 C--O 1.246 0.911 0 CA-C-O 118.421 -0.8 . . . . 0.0 109.691 178.451 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.525 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 47.8 m . . . . . 0 N--CA 1.45 -0.441 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.459 ' HB ' ' SG ' ' A' ' 33' ' ' CYS . 77.7 mt -59.43 130.95 23.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.031 0.443 . . . . 0.0 109.928 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -69.46 150.95 46.66 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.93 0.871 . . . . 0.0 111.358 -177.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.405 HD21 ' ND1' ' A' ' 22' ' ' HIS . 0.5 OUTLIER -68.46 115.62 8.09 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.338 -1.301 . . . . 0.0 110.58 -171.44 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 116.91 -13.45 14.45 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.358 -176.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -84.17 170.78 13.43 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.247 0.546 . . . . 0.0 111.694 179.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.472 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 9.5 mpt_? -79.92 155.33 27.78 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.303 -177.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.447 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 30.2 t -135.13 140.22 34.12 Favored Pre-proline 0 C--N 1.316 -0.852 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.555 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.34 162.74 41.41 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.769 2.313 . . . . 0.0 110.551 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.1 t-20 -53.79 112.79 4.11 Favored Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.67 -15.73 21.93 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.442 2.762 . . . . 0.0 113.943 -171.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.9 ptm180 -63.99 -25.46 68.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.011 0.434 . . . . 0.0 110.414 175.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -88.05 -2.97 58.93 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.47 178.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 131.14 156.22 8.44 Favored Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 -177.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -123.35 109.94 14.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.358 0.579 . . . . 0.0 111.102 -178.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.525 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 45.3 t-105 -107.16 21.9 16.82 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.092 0.948 . . . . 0.0 108.563 173.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.553 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -83.73 -5.27 59.15 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.571 -1.195 . . . . 0.0 112.161 -175.187 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 22.4 m -20.84 30.62 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 118.672 2.841 . . . . 0.0 118.672 -142.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.553 ' H ' ' C ' ' A' ' 20' ' ' CYS . 57.1 m80 -107.65 -83.48 0.54 Allowed 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 159.134 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.4 tttm -154.28 122.33 5.99 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.805 167.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 47.2 t -80.95 91.9 6.09 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 175.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 5.7 p -114.2 137.56 22.55 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.028 -169.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -66.64 120.07 7.15 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.508 2.139 . . . . 0.0 112.523 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -111.02 76.88 1.0 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.07 -0.968 . . . . 0.0 108.774 178.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.77 -111.08 3.45 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.263 -0.97 . . . . 0.0 111.833 -172.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.4 ptpp? -97.32 -23.81 15.95 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 117.055 0.428 . . . . 0.0 111.98 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -111.49 168.71 9.33 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.009 0.433 . . . . 0.0 110.978 -176.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.442 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 98.4 m-85 -104.05 143.94 32.23 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.711 176.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 59.6 m-85 -139.55 154.36 47.63 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.459 ' SG ' ' HB ' ' A' ' 5' ' ' ILE . 95.5 m -82.58 105.13 13.37 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.779 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -116.18 157.93 24.06 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.882 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -94.63 87.73 5.18 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 122.022 0.915 . . . . 0.0 110.017 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 . . . . . 0 C--O 1.249 1.033 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.923 -178.974 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 13.6 p . . . . . 0 N--CA 1.451 -0.399 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 77.9 mt -73.09 130.94 35.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.903 0.382 . . . . 0.0 110.114 -179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.44 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 3.4 pm0 -72.17 159.92 33.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.672 0.748 . . . . 0.0 111.176 -176.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.443 HD21 ' CG ' ' A' ' 22' ' ' HIS . 0.4 OUTLIER -70.3 120.6 16.21 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.017 -171.589 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 112.46 -9.42 26.33 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.616 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.464 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 16.0 mm-40 -89.98 167.23 12.96 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.022 0.439 . . . . 0.0 111.226 -179.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.464 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -78.2 142.4 37.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.966 -179.628 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 24.2 p -128.12 148.77 68.93 Favored Pre-proline 0 C--N 1.318 -0.799 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.44 177.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -72.12 150.74 54.46 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.335 2.023 . . . . 0.0 110.621 172.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.419 ' OD1' ' HG2' ' A' ' 15' ' ' ARG . 45.2 t-20 -49.67 122.77 13.78 Favored Pre-proline 0 C--N 1.333 -0.119 0 O-C-N 123.659 0.6 . . . . 0.0 110.238 -177.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.459 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 10.1 Cg_endo -51.28 -28.31 26.11 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 124.007 3.138 . . . . 0.0 114.065 -173.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.419 ' HG2' ' OD1' ' A' ' 13' ' ' ASN . 14.4 ptm180 -69.85 -18.49 63.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.907 0.384 . . . . 0.0 110.845 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -93.62 -8.54 40.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.374 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.31 86.31 1.91 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.158 -177.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.45 ' OD2' ' HB2' ' A' ' 20' ' ' CYS . 8.5 p-10 -90.09 146.85 24.01 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.976 0.417 . . . . 0.0 111.043 -178.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.482 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 36.7 m95 -107.44 35.67 2.99 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 176.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.623 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -70.97 -6.77 41.3 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 114.668 1.358 . . . . 0.0 114.668 -171.194 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.9 p -17.9 30.1 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 117.952 2.575 . . . . 0.0 117.952 -139.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.623 ' H ' ' C ' ' A' ' 20' ' ' CYS . 77.6 m80 -109.36 -91.65 0.45 Allowed 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 159.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.9 tttm -154.2 129.11 9.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 167.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.459 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 42.4 t -89.08 103.13 15.77 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 178.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 28.5 m -115.44 147.68 39.25 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.004 -175.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -75.15 119.41 5.59 Favored 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.44 2.093 . . . . 0.0 111.935 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -110.74 74.96 0.9 Allowed 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 178.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.14 -110.49 3.05 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.036 -1.078 . . . . 0.0 112.177 -177.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -87.98 -16.0 34.94 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -175.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -125.31 179.37 5.12 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.086 0.47 . . . . 0.0 111.352 -176.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.442 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 90.8 m-85 -117.58 143.76 45.8 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.169 171.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -138.81 148.82 44.23 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.962 0.41 . . . . 0.0 110.666 -179.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 98.4 m -75.86 103.71 6.06 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.598 174.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -113.07 159.22 19.41 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.486 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -94.37 88.74 5.63 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 176.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 . . . . . 0 C--N 1.315 -0.893 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.428 -177.92 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.599 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 62.7 m . . . . . 0 N--CA 1.45 -0.428 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.41 ' HB ' ' HA ' ' A' ' 20' ' ' CYS . 88.3 mt -71.29 136.14 26.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.01 0.433 . . . . 0.0 110.156 177.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -62.53 151.4 37.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.203 -178.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.469 HD21 ' CG ' ' A' ' 22' ' ' HIS . 0.9 OUTLIER -76.61 121.96 23.95 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.656 -177.632 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.33 -6.78 42.68 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.908 -175.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -83.77 173.99 10.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.001 0.429 . . . . 0.0 110.875 177.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.517 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 7.3 mpt_? -96.58 142.88 28.11 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.441 177.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.3 p -124.61 152.04 68.36 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-O 120.635 0.255 . . . . 0.0 110.989 -177.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.7 151.77 69.46 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.369 2.046 . . . . 0.0 110.755 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.569 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 46.9 t-20 -50.18 116.23 6.3 Favored Pre-proline 0 C--N 1.33 -0.282 0 O-C-N 123.704 0.627 . . . . 0.0 110.33 -178.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.552 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 9.9 Cg_endo -52.97 -22.48 18.57 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.505 2.804 . . . . 0.0 114.033 -171.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.47 ' HG3' ' OD1' ' A' ' 13' ' ' ASN . 0.0 OUTLIER -66.77 -14.65 62.86 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 178.864 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.569 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 11.4 pt-20 -107.57 10.3 29.23 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.765 0.317 . . . . 0.0 110.93 177.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 98.0 103.56 2.3 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.448 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.411 ' HB3' ' HA ' ' A' ' 14' ' ' PRO . 3.0 p-10 -101.94 147.5 26.47 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.276 0.56 . . . . 0.0 110.501 179.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.599 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 1.2 m-90 -108.33 31.12 5.81 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 174.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.615 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -74.96 -9.51 58.6 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -169.386 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.9 m -18.75 30.86 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 118.013 2.597 . . . . 0.0 118.013 -141.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.615 ' H ' ' C ' ' A' ' 20' ' ' CYS . 70.5 m80 -104.78 -88.84 0.42 Allowed 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 162.077 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -155.07 120.7 5.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 166.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.552 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 46.3 t -83.57 94.25 8.03 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 174.218 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.0 p -115.84 137.18 23.11 Favored Pre-proline 0 N--CA 1.439 -1.003 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.256 -168.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.08 127.4 23.08 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.721 2.281 . . . . 0.0 112.863 -178.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.482 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 7.1 mm-40 -124.58 91.34 3.42 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.779 176.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.8 -111.82 3.49 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.371 -0.919 . . . . 0.0 111.595 -177.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.535 ' HB2' ' HZ3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -107.67 3.52 24.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.85 0.357 . . . . 0.0 110.982 -179.528 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 50.7 mtt180 -126.16 -179.22 4.62 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.166 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 1.617 ' HE2' ' CE1' ' A' ' 31' ' ' PHE . 96.5 m-85 -120.73 139.94 52.35 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.786 176.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.482 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 17.7 m-85 -131.9 154.51 49.15 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.372 0.606 . . . . 0.0 110.851 -177.05 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.445 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -89.82 99.67 12.63 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.172 179.478 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -110.32 161.31 15.75 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.777 -177.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -102.38 88.34 3.25 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.281 0.562 . . . . 0.0 109.672 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.421 ' HA ' ' OE1' ' A' ' 36' ' ' GLN . 14.6 mm-40 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.442 -0.789 . . . . 0.0 109.844 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 71.9 m . . . . . 0 N--CA 1.452 -0.341 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 75.5 mt -64.51 123.51 17.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -68.09 156.15 38.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.966 0.889 . . . . 0.0 111.975 -172.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.4 HD23 ' O ' ' A' ' 33' ' ' CYS . 0.4 OUTLIER -63.47 123.94 20.06 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.134 -1.394 . . . . 0.0 110.952 -174.141 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.65 -14.66 29.65 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.484 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -85.29 168.72 14.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.11 0.481 . . . . 0.0 111.197 -179.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.403 ' HD3' ' N ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -89.81 138.22 31.67 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.715 179.565 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.465 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 22.4 p -120.03 146.91 43.3 Favored Pre-proline 0 C--N 1.318 -0.788 0 C-N-CA 121.014 -0.275 . . . . 0.0 110.977 -179.018 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -63.68 150.37 88.61 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.287 1.991 . . . . 0.0 109.941 168.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.589 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 45.8 t-20 -49.4 122.6 12.75 Favored Pre-proline 0 C--N 1.329 -0.306 0 O-C-N 123.592 0.558 . . . . 0.0 110.098 -179.369 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.644 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 12.0 Cg_endo -55.02 -17.58 14.77 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 123.3 2.667 . . . . 0.0 113.48 -173.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -70.44 -22.0 62.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.97 177.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 12.7 pt-20 -106.75 13.48 27.92 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.045 0.45 . . . . 0.0 110.411 178.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 129.15 126.25 2.83 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.297 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -111.52 107.36 16.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.879 0.371 . . . . 0.0 110.27 -178.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.7 m95 -111.02 11.34 22.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.181 0.515 . . . . 0.0 110.075 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.589 ' C ' ' H ' ' A' ' 22' ' ' HIS . 1.0 OUTLIER -71.49 -4.95 29.52 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -172.636 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 10.7 m -18.24 29.79 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 118.387 2.736 . . . . 0.0 118.387 -139.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.589 ' H ' ' C ' ' A' ' 20' ' ' CYS . 37.0 m80 -106.44 -83.61 0.52 Allowed 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 158.017 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -154.89 123.98 6.29 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.293 167.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.644 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 49.1 t -86.38 91.65 8.58 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 173.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.6 p -114.85 139.74 24.57 Favored Pre-proline 0 C--N 1.313 -1.005 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.926 -169.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -57.62 126.07 20.7 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 122.659 2.239 . . . . 0.0 112.508 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -122.99 76.44 1.37 Allowed 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.08 -111.71 3.49 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.584 -0.817 . . . . 0.0 111.337 -173.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.6 tttp -92.23 -36.27 13.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.216 0.532 . . . . 0.0 110.779 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 87.6 mtt180 -100.89 178.86 4.56 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.328 -174.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -113.39 143.83 43.8 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.754 178.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -135.48 148.13 49.11 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.465 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.4 ' O ' HD23 ' A' ' 7' ' ' LEU . 88.1 m -78.51 101.87 7.58 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 174.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -112.96 160.59 17.93 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.743 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -100.9 88.04 3.45 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 176.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.37 -0.824 . . . . 0.0 109.546 -178.472 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.448 -0.531 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 93.5 mt -52.98 131.95 15.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 121.287 0.565 . . . . 0.0 111.973 -171.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.2 mp0 -61.29 157.22 16.91 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.324 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.524 HD21 ' CG ' ' A' ' 22' ' ' HIS . 1.1 tm? -79.88 126.59 31.19 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.069 -175.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.95 -7.93 53.42 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.96 -176.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -86.64 174.04 9.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.169 0.509 . . . . 0.0 111.25 -178.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -85.77 143.47 28.29 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.452 176.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.0 p -133.63 152.7 79.45 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.698 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -77.98 154.07 29.32 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.66 2.24 . . . . 0.0 111.3 173.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -50.31 117.47 7.96 Favored Pre-proline 0 C--O 1.234 0.274 0 O-C-N 123.487 0.492 . . . . 0.0 110.118 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.43 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 18.3 Cg_endo -58.51 -13.68 18.04 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 123.347 2.698 . . . . 0.0 113.491 -172.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -66.79 -21.99 66.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.961 178.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -118.17 21.25 12.85 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.862 0.363 . . . . 0.0 111.486 -177.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 130.8 98.0 0.78 Allowed Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.542 178.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -92.18 106.91 18.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.971 0.415 . . . . 0.0 110.578 177.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 39.4 m95 -113.47 28.12 9.03 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.806 0.812 . . . . 0.0 109.174 178.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.629 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -85.15 -5.87 59.32 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.471 -170.73 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.6 p -14.25 29.76 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 117.796 2.517 . . . . 0.0 117.796 -139.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.629 ' H ' ' C ' ' A' ' 20' ' ' CYS . 72.9 m80 -111.22 -92.82 0.45 Allowed 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 164.032 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.2 tttm -155.22 118.41 4.4 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 165.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.43 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 42.2 t -82.2 102.4 11.1 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 174.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 9.9 p -121.6 136.09 25.7 Favored Pre-proline 0 N--CA 1.438 -1.065 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.52 -169.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -64.0 119.75 6.89 Favored 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 122.472 2.115 . . . . 0.0 112.25 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -113.74 76.91 1.01 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.293 -0.867 . . . . 0.0 108.73 178.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.6 -111.6 3.51 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.314 -0.946 . . . . 0.0 111.991 -174.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.489 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 18.3 ptpt -102.05 -8.3 21.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.887 0.343 . . . . 0.0 111.912 -175.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.489 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 95.4 mtt180 -127.97 171.64 11.64 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.843 0.354 . . . . 0.0 110.272 -178.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -110.1 139.99 44.64 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.388 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -134.73 151.8 51.27 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.736 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.426 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -86.0 103.93 15.15 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.116 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -115.17 158.82 21.71 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.151 -175.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -100.28 91.46 4.74 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.753 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.565 -0.731 . . . . 0.0 109.565 179.221 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 65.0 m . . . . . 0 N--CA 1.449 -0.511 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.44 HG23 ' HB2' ' A' ' 9' ' ' GLU . 75.7 mt -65.69 135.26 28.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.154 -176.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.7 mp0 -56.44 145.36 27.85 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 121.524 0.678 . . . . 0.0 111.307 -178.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.456 HD21 ' ND1' ' A' ' 22' ' ' HIS . 1.5 tm? -68.82 121.29 16.24 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.653 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 109.21 -8.34 33.05 Favored Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.139 -176.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.44 ' HB2' HG23 ' A' ' 5' ' ' ILE . 61.8 mm-40 -86.99 175.76 7.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.019 0.438 . . . . 0.0 110.969 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -91.53 144.85 25.13 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.132 179.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 9.4 p -129.46 147.17 64.05 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.65 179.03 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -68.78 160.53 49.22 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.202 1.935 . . . . 0.0 110.199 171.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.3 t-20 -49.74 117.78 7.69 Favored Pre-proline 0 C--O 1.234 0.285 0 O-C-N 123.36 0.412 . . . . 0.0 110.442 -176.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.494 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 13.5 Cg_endo -57.67 -18.69 34.39 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.523 2.815 . . . . 0.0 113.918 -173.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 -66.96 -24.04 66.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.87 0.367 . . . . 0.0 110.144 177.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -89.59 -3.7 58.18 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.087 177.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 137.23 134.71 3.29 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.477 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -110.73 106.51 15.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.375 0.587 . . . . 0.0 109.905 -179.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -103.29 9.34 38.1 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.486 0.66 . . . . 0.0 109.794 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.673 ' SG ' ' HB2' ' A' ' 24' ' ' CYS . 8.4 m -73.74 -2.8 24.88 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 124.184 0.993 . . . . 0.0 113.372 -175.015 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.8 m -17.0 29.7 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 118.309 2.707 . . . . 0.0 118.309 -138.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.582 ' H ' ' C ' ' A' ' 20' ' ' CYS . 32.1 m80 -104.51 -86.66 0.45 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 156.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.6 tttm -155.73 120.02 4.59 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 120.414 0.15 . . . . 0.0 110.657 169.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.673 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 41.9 t -85.07 110.17 18.75 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 175.618 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.1 m -124.52 158.91 60.13 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.338 -173.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -81.47 119.71 3.44 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 122.552 2.168 . . . . 0.0 112.034 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -110.57 75.31 0.92 Allowed 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 177.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 75.75 -111.65 3.38 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.921 -175.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.462 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 22.5 pttm -84.21 -28.68 27.13 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -176.226 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.462 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 62.4 mtt-85 -118.38 171.35 8.21 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.996 0.427 . . . . 0.0 110.995 -175.437 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.51 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 97.1 m-85 -107.32 145.1 33.23 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.899 177.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 1.638 ' HE2' ' CE1' ' A' ' 32' ' ' TYR . 37.5 m-85 -136.77 149.01 47.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.452 -179.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 85.0 m -79.3 102.78 8.81 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 175.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -115.09 161.48 18.32 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 -179.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -103.93 88.26 2.99 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.2 mm-40 . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.349 -179.619 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 19' ' ' TRP . 36.3 m . . . . . 0 C--O 1.232 0.157 0 CA-C-O 121.613 0.721 . . . . 0.0 110.524 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.17 138.25 23.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.182 -174.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.0 mp0 -55.58 141.31 37.84 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.074 -177.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.82 120.0 15.77 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.377 -177.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 111.46 -14.14 27.75 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.093 -175.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -84.53 165.16 18.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.989 0.423 . . . . 0.0 111.228 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.99 145.9 33.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.475 175.262 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.6 p -125.42 137.95 30.85 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.712 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -57.57 157.53 22.65 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.654 2.236 . . . . 0.0 111.072 172.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -49.86 114.08 3.92 Favored Pre-proline 0 C--O 1.231 0.123 0 O-C-N 123.526 0.516 . . . . 0.0 110.456 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -57.89 -19.41 39.35 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 123.208 2.605 . . . . 0.0 113.616 -172.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -68.28 -19.7 64.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.748 0.309 . . . . 0.0 110.733 177.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -89.3 -8.82 52.55 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.964 0.411 . . . . 0.0 110.342 178.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 136.26 112.07 1.15 Allowed Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 111.603 -0.599 . . . . 0.0 111.603 -176.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -86.64 113.11 22.25 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.964 0.411 . . . . 0.0 110.541 -178.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.545 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 3.0 m0 -111.86 26.4 10.66 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 174.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.595 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -84.84 -6.02 59.34 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.88 -171.284 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.4 m -18.57 29.52 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 118.207 2.669 . . . . 0.0 118.207 -138.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.595 ' H ' ' C ' ' A' ' 20' ' ' CYS . 42.7 m80 -107.41 -90.83 0.43 Allowed 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 158.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -156.03 126.66 6.79 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 168.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.485 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 50.2 t -90.44 100.2 13.08 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 176.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.6 m -109.79 146.34 33.89 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-O 121.094 0.473 . . . . 0.0 111.656 -174.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.13 121.68 5.43 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.73 2.286 . . . . 0.0 112.188 178.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -118.86 90.3 3.31 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 176.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.42 -110.87 3.4 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.313 -0.946 . . . . 0.0 111.422 -174.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.5 tttp -104.65 -16.93 14.85 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.011 0.434 . . . . 0.0 110.869 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -111.38 167.08 10.58 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.929 -173.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.485 ' HB3' ' SG ' ' A' ' 24' ' ' CYS . 96.3 m-85 -110.49 140.75 44.45 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.014 177.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -135.55 149.14 49.36 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.015 0.436 . . . . 0.0 110.633 -179.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -85.84 107.44 17.67 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.533 -176.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -122.02 158.56 28.89 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.379 -174.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -97.7 88.65 4.39 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.911 0.862 . . . . 0.0 109.914 177.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 . . . . . 0 C--O 1.246 0.915 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.453 -178.586 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.572 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 62.5 m . . . . . 0 N--CA 1.449 -0.485 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 89.1 mt -64.73 130.27 29.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 118.152 0.433 . . . . 0.0 110.107 178.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -59.47 147.64 35.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.233 -177.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.27 115.79 14.17 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.944 -175.248 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.5 -18.55 11.88 Favored Glycine 0 N--CA 1.445 -0.717 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.998 -174.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.411 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 8.2 mm-40 -75.91 166.63 23.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.036 0.446 . . . . 0.0 111.04 -179.121 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.411 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -84.77 138.24 32.72 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 176.304 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 23.1 p -117.81 148.55 43.45 Favored Pre-proline 0 C--N 1.316 -0.88 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.197 -178.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.23 154.46 69.8 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.684 2.256 . . . . 0.0 110.93 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . 0.59 ' OD1' ' HG2' ' A' ' 15' ' ' ARG . 47.5 t-20 -51.99 116.92 8.99 Favored Pre-proline 0 C--O 1.233 0.196 0 O-C-N 123.699 0.624 . . . . 0.0 110.543 -177.013 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.475 ' HA ' ' HB3' ' A' ' 18' ' ' ASP . 14.5 Cg_endo -56.62 -20.57 34.91 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.442 2.761 . . . . 0.0 114.129 -172.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.59 ' HG2' ' OD1' ' A' ' 13' ' ' ASN . 10.1 ptm180 -64.45 -23.99 67.47 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 121.045 -0.262 . . . . 0.0 111.046 177.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -92.11 0.48 57.46 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.908 0.385 . . . . 0.0 110.641 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 99.89 94.55 2.11 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.812 -0.709 . . . . 0.0 111.877 -177.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.475 ' HB3' ' HA ' ' A' ' 14' ' ' PRO . 9.2 p-10 -86.83 147.59 25.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.101 0.477 . . . . 0.0 110.679 -179.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.572 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 26.0 m95 -111.74 36.26 3.35 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 176.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.61 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -79.4 -6.97 58.0 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.329 -1.305 . . . . 0.0 113.179 -171.659 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.9 m -17.77 31.24 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 118.077 2.621 . . . . 0.0 118.077 -141.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.61 ' H ' ' C ' ' A' ' 20' ' ' CYS . 69.0 m80 -109.35 -87.98 0.5 Allowed 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 161.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -154.6 124.22 6.56 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.158 167.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.447 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 44.9 t -84.97 90.78 7.9 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 172.313 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.7 p -106.7 132.09 21.18 Favored Pre-proline 0 N--CA 1.44 -0.946 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.782 -168.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -67.36 119.82 6.85 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.441 2.094 . . . . 0.0 112.726 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -113.38 85.23 2.15 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.897 -1.047 . . . . 0.0 108.941 177.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 79.23 -111.15 3.19 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 119.945 -1.121 . . . . 0.0 111.326 -175.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -94.44 -30.19 14.58 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.093 0.473 . . . . 0.0 110.88 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -98.85 174.17 6.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.224 -173.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 1.654 ' HE2' ' CE1' ' A' ' 31' ' ' PHE . 82.2 m-85 -117.06 137.78 52.03 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.414 174.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 1.635 ' HE1' ' CE2' ' A' ' 32' ' ' TYR . 68.3 m-85 -130.89 150.44 52.05 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.009 0.433 . . . . 0.0 110.173 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -85.52 100.63 12.04 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.394 -178.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.0 mmm180 -119.91 163.66 17.22 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.193 -175.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -107.5 89.68 3.07 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.827 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 . . . . . 0 C--O 1.246 0.878 0 CA-C-O 118.516 -0.754 . . . . 0.0 110.119 -179.438 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 76.0 m . . . . . 0 N--CA 1.45 -0.44 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 89.2 mt -70.65 134.24 30.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 176.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -58.48 145.97 37.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.534 0.683 . . . . 0.0 110.796 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.48 121.86 22.14 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.563 -176.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.25 -6.5 34.36 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.354 -174.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -86.17 168.74 13.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.101 0.477 . . . . 0.0 111.629 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.43 ' HD2' ' N ' ' A' ' 11' ' ' CYS . 2.3 tmm_? -88.52 127.85 35.54 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.161 177.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.43 ' N ' ' HD2' ' A' ' 10' ' ' ARG . 25.7 p -113.37 151.03 44.04 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-O 120.636 0.255 . . . . 0.0 111.315 -174.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.34 146.99 64.53 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.591 2.194 . . . . 0.0 110.87 173.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.6 t-20 -50.39 120.07 11.88 Favored Pre-proline 0 C--O 1.231 0.129 0 O-C-N 123.708 0.63 . . . . 0.0 110.112 -177.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.528 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 14.5 Cg_endo -56.44 -21.0 35.4 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 123.308 2.672 . . . . 0.0 113.589 -174.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.18 -18.0 63.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.846 0.355 . . . . 0.0 110.303 177.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -101.08 -4.68 26.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.566 178.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.63 107.72 3.23 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.159 -177.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -109.87 146.77 34.54 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.04 0.448 . . . . 0.0 110.39 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 2.1 m-90 -108.73 33.82 4.01 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 177.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.618 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -78.41 -9.29 59.23 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -169.379 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.7 p -19.29 29.93 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 118.231 2.678 . . . . 0.0 118.231 -140.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.618 ' H ' ' C ' ' A' ' 20' ' ' CYS . 66.7 m80 -103.03 -87.6 0.42 Allowed 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 161.395 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.402 ' HE3' ' N ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -155.39 117.7 4.18 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 167.96 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.528 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 45.5 t -82.76 93.37 7.41 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 169.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.1 p -112.62 137.9 21.86 Favored Pre-proline 0 C--N 1.313 -1.013 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.336 -166.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -66.7 119.27 6.28 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.254 1.969 . . . . 0.0 111.91 178.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -116.72 76.91 1.06 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.36 -0.837 . . . . 0.0 108.863 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.56 -111.7 3.46 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.105 -1.045 . . . . 0.0 111.598 -175.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.7 pttm -99.59 -12.0 20.49 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -176.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -120.84 175.16 6.18 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.01 0.434 . . . . 0.0 111.123 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -113.33 137.19 51.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.51 173.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 1.627 ' HE2' ' CE1' ' A' ' 32' ' ' TYR . 82.1 m-85 -133.67 152.32 51.86 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.057 0.456 . . . . 0.0 109.871 179.25 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -83.28 101.66 11.43 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.301 -178.466 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -114.87 160.46 19.47 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.316 -177.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -109.67 88.68 2.8 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.07 0.462 . . . . 0.0 110.266 178.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.399 -0.81 . . . . 0.0 109.293 176.473 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.652 ' HA ' ' O ' ' A' ' 19' ' ' TRP . 33.3 m . . . . . 0 CA--C 1.533 0.306 0 CA-C-O 121.793 0.806 . . . . 0.0 111.55 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 86.6 mt -72.56 137.97 22.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.347 -176.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -55.28 138.48 45.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.231 177.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -70.06 121.96 18.47 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.16 -173.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 111.25 -16.19 27.37 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.134 -176.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -78.71 168.71 19.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.903 0.382 . . . . 0.0 110.898 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.73 151.71 39.16 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 176.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.551 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 11.7 t -140.04 139.99 22.79 Favored Pre-proline 0 C--N 1.314 -0.942 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.24 -174.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -71.93 158.79 51.97 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.532 2.155 . . . . 0.0 110.86 176.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -53.22 115.73 8.13 Favored Pre-proline 0 C--N 1.331 -0.225 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.44 -24.95 46.11 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 123.454 2.769 . . . . 0.0 113.621 -172.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 17.4 ptt180 -71.22 -17.83 62.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.837 0.351 . . . . 0.0 110.405 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -98.9 -0.59 41.99 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.575 179.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 135.16 93.93 0.44 Allowed Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.959 -0.638 . . . . 0.0 111.971 -177.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -81.54 124.79 29.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.603 0.239 . . . . 0.0 110.649 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.652 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 20.5 m95 -118.89 12.23 12.81 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-O 120.988 0.423 . . . . 0.0 109.938 174.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.615 ' C ' ' H ' ' A' ' 22' ' ' HIS . 38.8 t -73.65 -6.49 47.05 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -170.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.7 m -15.88 31.85 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 117.566 2.432 . . . . 0.0 117.566 -138.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.615 ' H ' ' C ' ' A' ' 20' ' ' CYS . 72.8 m80 -108.37 -88.07 0.48 Allowed 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 163.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.7 tttm -156.49 119.65 4.19 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 165.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.2 t -86.03 107.95 18.02 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.1 m -120.79 149.65 51.09 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-O 121.001 0.429 . . . . 0.0 111.553 -173.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -70.74 122.88 9.27 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.601 2.201 . . . . 0.0 112.397 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.432 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 6.9 mm-40 -119.26 75.71 1.07 Allowed 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.182 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.76 -111.16 3.28 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.348 -0.93 . . . . 0.0 112.189 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -83.05 -29.93 28.44 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -177.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -126.46 171.65 10.86 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.045 0.45 . . . . 0.0 111.016 -174.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 1.666 ' HD1' ' CD2' ' A' ' 31' ' ' PHE . 87.4 m-85 -98.02 148.87 23.06 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.369 176.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.432 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 11.7 m-85 -133.18 156.28 47.77 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 -179.085 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 4.6 t -88.34 103.38 15.76 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -179.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -116.55 163.39 16.15 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.751 -176.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -104.76 88.31 2.88 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.231 0.538 . . . . 0.0 111.551 -178.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 . . . . . 0 C--O 1.252 1.193 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.558 172.979 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.601 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 71.4 m . . . . . 0 N--CA 1.451 -0.409 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 81.2 mt -58.52 135.01 23.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 CA-C-O 121.209 0.528 . . . . 0.0 111.099 -178.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.417 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 11.4 mp0 -60.43 152.89 24.42 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.89 -177.105 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.484 HD21 ' CG ' ' A' ' 22' ' ' HIS . 1.2 tm? -74.32 117.66 16.38 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.939 -177.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.9 -14.5 29.04 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.806 -0.633 . . . . 0.0 112.013 -176.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.462 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 12.7 mm-40 -78.72 167.32 21.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.041 0.448 . . . . 0.0 110.619 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.462 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -82.21 145.16 30.2 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.372 177.222 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 15.1 p -125.34 147.29 57.14 Favored Pre-proline 0 C--N 1.313 -0.992 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.244 177.249 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . 0.529 ' HG3' ' CZ3' ' A' ' 19' ' ' TRP . 56.0 Cg_endo -68.98 159.42 54.03 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.398 2.065 . . . . 0.0 110.29 174.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -52.54 115.62 7.39 Favored Pre-proline 0 C--N 1.328 -0.353 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -54.67 -22.33 28.36 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.303 2.668 . . . . 0.0 113.79 -171.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -70.13 -20.27 63.18 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.982 179.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -97.57 -1.76 43.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.601 0.239 . . . . 0.0 111.059 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 135.93 118.72 1.82 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.797 -178.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -102.0 107.27 18.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.984 0.421 . . . . 0.0 111.141 -177.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.601 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 1.7 m0 -106.95 21.39 17.63 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 173.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.557 ' C ' ' H ' ' A' ' 22' ' ' HIS . 3.8 t -81.41 -8.54 59.75 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.412 -1.267 . . . . 0.0 111.803 -170.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 20.3 m -21.93 31.13 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 118.591 2.811 . . . . 0.0 118.591 -142.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.557 ' H ' ' C ' ' A' ' 20' ' ' CYS . 77.4 m80 -104.43 -88.29 0.43 Allowed 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 161.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -156.32 118.79 4.06 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 163.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.401 ' HB2' ' CB ' ' A' ' 20' ' ' CYS . 48.9 t -83.92 97.56 9.3 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.619 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 18.2 m -109.07 145.6 32.09 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.1 -176.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -71.46 119.8 6.51 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.465 2.11 . . . . 0.0 111.492 176.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -110.79 76.81 1.0 Allowed 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 176.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.12 -111.68 3.43 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.475 -0.869 . . . . 0.0 111.088 -173.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -99.82 -13.62 19.14 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.182 0.515 . . . . 0.0 110.648 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -106.56 176.1 5.28 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.942 -177.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 1.646 ' HD2' ' CD1' ' A' ' 31' ' ' PHE . 87.7 m-85 -126.96 141.66 51.74 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 176.362 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 1.656 ' HD2' ' CD1' ' A' ' 32' ' ' TYR . 77.7 m-85 -137.71 148.4 45.63 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.002 0.43 . . . . 0.0 111.189 -178.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.481 ' O ' HD23 ' A' ' 7' ' ' LEU . 55.6 m -79.37 101.4 8.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.684 174.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -107.89 154.67 21.25 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.215 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -89.87 88.84 7.49 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.512 177.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 . . . . . 0 C--O 1.245 0.855 0 CA-C-O 118.192 -0.909 . . . . 0.0 110.029 -178.331 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 19' ' ' TRP . 63.2 m . . . . . 0 N--CA 1.448 -0.54 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.436 HG13 ' HB2' ' A' ' 19' ' ' TRP . 79.8 mt -81.34 133.61 28.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 -178.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.408 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 1.5 pm0 -70.16 157.26 37.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.797 0.808 . . . . 0.0 111.648 -174.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.528 HD21 ' ND1' ' A' ' 22' ' ' HIS . 0.4 OUTLIER -67.06 123.71 20.99 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.913 -172.94 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.68 -9.51 34.88 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.524 179.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.425 ' HB2' HG23 ' A' ' 5' ' ' ILE . 32.2 mm-40 -84.32 170.84 13.23 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.986 0.422 . . . . 0.0 111.12 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.57 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 5.3 mpt_? -89.92 137.9 31.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.55 -179.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.558 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 17.2 p -124.72 149.21 61.67 Favored Pre-proline 0 C--N 1.318 -0.794 0 CA-C-O 120.564 0.221 . . . . 0.0 110.865 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -71.05 151.58 61.85 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.132 1.888 . . . . 0.0 110.127 170.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -49.54 124.27 14.97 Favored Pre-proline 0 C--N 1.332 -0.192 0 O-C-N 123.63 0.581 . . . . 0.0 109.638 -179.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . 0.471 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 9.2 Cg_endo -51.71 -22.3 13.01 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 123.739 2.959 . . . . 0.0 113.757 -174.469 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -68.55 -20.03 64.52 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.8 0.333 . . . . 0.0 110.551 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -92.24 -7.78 47.2 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.629 175.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 104.64 96.49 2.42 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.264 -178.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -94.22 147.71 22.91 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.818 0.342 . . . . 0.0 110.175 179.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.474 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 20.6 m95 -111.48 21.35 16.28 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 175.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.593 ' C ' ' H ' ' A' ' 22' ' ' HIS . 4.7 m -56.75 -5.81 0.26 Allowed 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 115.592 1.701 . . . . 0.0 115.592 -174.46 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.1 m -17.21 30.33 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 118.181 2.66 . . . . 0.0 118.181 -140.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' HIS . . . . . 0.593 ' H ' ' C ' ' A' ' 20' ' ' CYS . 24.6 m80 -109.55 -85.37 0.54 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 158.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.6 tttm -156.64 131.14 8.73 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 121.353 -0.139 . . . . 0.0 110.7 167.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.524 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 50.4 t -90.44 105.69 17.98 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 176.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 31.6 m -116.5 147.38 39.55 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.462 -173.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -73.78 119.65 6.0 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.527 2.151 . . . . 0.0 112.415 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -115.19 75.76 0.96 Allowed 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.209 177.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.22 -111.28 3.81 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.235 -178.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.404 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 8.4 ptpp? -71.17 -32.73 69.27 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -175.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.404 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 81.2 mtt180 -127.27 -179.57 4.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.924 0.392 . . . . 0.0 110.998 -172.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 1.589 ' HE1' ' CE2' ' A' ' 31' ' ' PHE . 62.4 m-85 -111.93 147.24 36.28 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 175.117 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.413 ' CZ ' ' HG3' ' A' ' 10' ' ' ARG . 30.5 m-85 -136.42 144.03 44.26 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.799 0.333 . . . . 0.0 110.797 -178.158 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.436 ' SG ' ' HB3' ' A' ' 11' ' ' CYS . 73.0 m -76.5 103.9 6.73 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.521 176.362 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -119.02 163.63 16.68 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.488 -178.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -104.8 88.95 3.03 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.23 0.538 . . . . 0.0 110.507 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.237 -0.887 . . . . 0.0 109.787 178.238 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.674 0 N-CA-C 111.832 -0.507 . . . . 0.0 111.832 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.4 t -102.81 57.58 0.77 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.123 0.487 . . . . 0.0 110.618 -178.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 54.3 t80 73.03 -46.25 0.64 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.141 -178.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.463 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 61.7 m -135.13 179.57 6.24 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 71.9 mt -63.11 130.56 27.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -68.01 154.74 40.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.769 0.795 . . . . 0.0 111.701 -173.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.502 HD21 ' ND1' ' A' ' 22' ' ' HIS . 0.4 OUTLIER -66.67 120.48 13.54 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.606 -173.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.453 ' HA2' ' NH1' ' A' ' 34' ' ' ARG . . . 116.57 -15.38 14.69 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.772 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.546 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 16.6 mm-40 -84.82 165.92 17.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.195 0.522 . . . . 0.0 111.61 -177.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.546 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -82.57 141.88 32.23 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.735 179.361 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.517 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 18.6 p -126.56 153.33 75.3 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.76 178.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -70.14 169.11 20.18 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.498 2.132 . . . . 0.0 110.853 172.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -50.02 119.89 10.9 Favored Pre-proline 0 C--N 1.328 -0.348 0 O-C-N 123.351 0.407 . . . . 0.0 110.797 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -56.41 -16.08 17.13 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 123.886 3.057 . . . . 0.0 113.938 -175.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 23.8 mmt180 -63.88 -21.53 66.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.084 0.469 . . . . 0.0 110.39 176.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -81.42 -10.3 59.54 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.653 177.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 120.33 135.88 5.04 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 111.514 -0.635 . . . . 0.0 111.514 -177.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -77.64 103.88 7.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.282 0.541 . . . . 0.0 110.327 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.463 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 5.3 m-90 -94.55 8.42 42.29 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-O 121.995 0.902 . . . . 0.0 109.093 172.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.556 ' C ' ' H ' ' A' ' 22' ' ' HIS . 56.1 m -84.75 -2.34 57.5 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 113.903 -1.499 . . . . 0.0 112.087 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.8 m -18.56 28.28 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 118.737 2.866 . . . . 0.0 118.737 -138.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.556 ' H ' ' C ' ' A' ' 20' ' ' CYS . 49.7 m80 -94.77 -82.39 0.37 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 153.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -155.26 131.34 10.15 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.192 165.371 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.444 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 43.3 t -87.01 100.21 12.45 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 170.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 4.9 p -121.93 138.96 29.43 Favored Pre-proline 0 C--N 1.312 -1.041 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.548 -166.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -66.51 120.02 7.1 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.385 2.056 . . . . 0.0 112.394 177.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -119.87 84.36 2.2 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.284 -0.871 . . . . 0.0 108.809 177.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 85.02 -110.93 3.45 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.207 -0.997 . . . . 0.0 111.927 -174.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.457 ' HZ1' ' HB3' ' A' ' 29' ' ' LYS . 0.9 OUTLIER -106.63 -7.94 17.16 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.374 -0.486 . . . . 0.0 111.969 -177.352 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -119.27 172.5 7.56 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.011 0.434 . . . . 0.0 110.6 -178.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 1.633 ' HD1' ' CD2' ' A' ' 31' ' ' PHE . 91.1 m-85 -109.59 140.53 43.29 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.476 -0.784 . . . . 0.0 108.962 173.179 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 1.641 ' HE1' ' CE2' ' A' ' 32' ' ' TYR . 74.5 m-85 -136.37 149.54 48.38 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.818 0.342 . . . . 0.0 110.621 -178.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 65.9 m -78.52 96.49 5.44 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 173.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.453 ' NH1' ' HA2' ' A' ' 8' ' ' GLY . 40.4 mmt180 -119.03 165.3 14.29 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.132 -175.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -103.09 86.96 2.79 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 170.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 . . . . . 0 C--O 1.246 0.885 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.766 -170.798 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.723 0 N-CA-C 112.351 -0.299 . . . . 0.0 112.351 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.2 t -153.26 -178.59 7.06 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -178.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -66.81 128.18 35.3 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.509 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 20.1 p 48.77 -158.25 0.06 Allowed 'General case' 0 N--CA 1.469 0.476 0 O-C-N 124.261 0.975 . . . . 0.0 110.916 -174.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.415 ' HB ' ' SG ' ' A' ' 33' ' ' CYS . 79.6 mt -77.09 133.48 30.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 178.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.459 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 2.4 pm0 -66.0 149.46 50.21 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 121.841 0.829 . . . . 0.0 110.61 -178.341 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.413 HD21 ' CG ' ' A' ' 22' ' ' HIS . 0.8 OUTLIER -68.78 121.35 16.34 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.726 -1.124 . . . . 0.0 110.682 -171.468 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.421 ' HA2' ' NH1' ' A' ' 34' ' ' ARG . . . 118.61 -21.33 9.83 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.834 -179.212 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.459 ' CG ' ' HG2' ' A' ' 6' ' ' GLU . 14.1 mm-40 -83.09 170.9 14.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.091 0.472 . . . . 0.0 111.64 -175.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.464 ' N ' ' HD3' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -81.94 143.48 31.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.205 179.316 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.424 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 14.2 p -122.76 149.58 56.48 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.347 177.136 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.36 159.88 51.44 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.308 2.005 . . . . 0.0 110.347 172.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 50.5 t-20 -50.61 117.2 7.9 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.463 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 11.6 Cg_endo -55.61 -27.69 61.67 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 123.372 2.715 . . . . 0.0 114.023 -171.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.74 -12.78 60.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.209 0.528 . . . . 0.0 110.494 178.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -105.49 13.82 29.55 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.152 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.17 107.3 2.05 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.248 -179.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -96.72 116.99 30.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.779 0.323 . . . . 0.0 110.859 -178.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.509 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 35.6 m95 -116.92 20.95 13.62 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 176.346 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.606 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -80.02 -6.93 58.47 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -171.348 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.7 p -18.06 30.94 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 118.088 2.625 . . . . 0.0 118.088 -141.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.606 ' H ' ' C ' ' A' ' 20' ' ' CYS . 76.9 m80 -113.07 -83.98 0.59 Allowed 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 162.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -154.04 125.24 7.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.03 167.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.492 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 45.4 t -88.02 88.58 7.69 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 172.402 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 5.8 p -107.98 135.4 19.86 Favored Pre-proline 0 N--CA 1.44 -0.971 0 CA-C-N 115.074 -0.967 . . . . 0.0 109.895 -168.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -67.24 119.13 6.13 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.237 1.958 . . . . 0.0 112.209 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -105.27 76.74 1.25 Allowed 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.92 -110.33 3.3 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.099 -1.048 . . . . 0.0 110.647 -169.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -94.95 -34.37 12.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.939 0.399 . . . . 0.0 111.06 179.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -92.56 171.1 9.24 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.977 0.417 . . . . 0.0 111.087 -172.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 1.613 ' HD2' ' CD1' ' A' ' 31' ' ' PHE . 94.0 m-85 -114.64 140.67 48.63 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.115 177.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -137.68 147.81 45.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.201 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.415 ' SG ' ' HB ' ' A' ' 5' ' ' ILE . 95.2 m -78.2 101.29 7.01 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 175.558 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.421 ' NH1' ' HA2' ' A' ' 8' ' ' GLY . 25.9 mmt180 -113.56 160.55 18.41 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.339 179.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -103.13 88.1 3.06 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 . . . . . 0 C--O 1.246 0.879 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.273 -173.775 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.732 0 N-CA-C 111.797 -0.521 . . . . 0.0 111.797 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.653 ' HB ' ' O ' ' A' ' 4' ' ' CYS . 2.0 p -117.0 100.66 7.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.689 0.281 . . . . 0.0 111.688 -177.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.634 ' HD1' ' CD2' ' A' ' 3' ' ' TYR . 92.8 t80 -58.52 -38.0 76.79 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.954 0.407 . . . . 0.0 109.906 172.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.653 ' O ' ' HB ' ' A' ' 2' ' ' THR . 82.3 m -98.01 143.2 28.82 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 171.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.437 HG13 ' HB2' ' A' ' 19' ' ' TRP . 91.4 mt -67.29 130.15 32.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.937 -177.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.436 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.5 pm0 -66.19 149.97 49.5 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.234 -0.893 . . . . 0.0 111.423 -176.055 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.18 121.23 14.28 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.549 -1.205 . . . . 0.0 111.039 -172.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 113.73 -11.72 23.08 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.003 -0.617 . . . . 0.0 112.551 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -87.14 168.33 13.35 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.364 0.602 . . . . 0.0 111.939 -179.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.478 ' HD2' ' O ' ' A' ' 31' ' ' PHE . 9.0 mmm180 -81.07 139.51 35.65 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.377 177.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.545 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 17.9 p -121.48 142.28 35.21 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.942 178.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -62.04 144.49 96.21 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 122.13 1.886 . . . . 0.0 110.117 169.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.562 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 3.2 m-20 -49.37 123.8 13.87 Favored Pre-proline 0 C--N 1.328 -0.338 0 O-C-N 123.787 0.679 . . . . 0.0 110.622 -178.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.579 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 9.2 Cg_endo -52.51 -21.6 14.54 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 123.543 2.829 . . . . 0.0 113.53 -174.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.549 ' HD3' ' N ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -59.56 -22.06 61.19 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 175.903 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.562 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 10.2 pt-20 -118.36 19.34 13.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.921 0.391 . . . . 0.0 111.14 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 96.96 110.32 2.72 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.992 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -113.65 133.7 55.16 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 176.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.437 ' HB2' HG13 ' A' ' 5' ' ' ILE . 1.1 m95 -101.13 22.45 12.31 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.618 ' C ' ' H ' ' A' ' 22' ' ' HIS . 1.6 m -57.57 -6.25 0.46 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 -175.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 16.2 m -17.34 31.54 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 117.753 2.501 . . . . 0.0 117.753 -140.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.618 ' H ' ' C ' ' A' ' 20' ' ' CYS . 71.0 m80 -112.35 -84.4 0.58 Allowed 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 160.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -154.15 127.03 8.23 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.396 169.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.579 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 42.9 t -88.23 89.92 8.18 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 172.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.7 p -109.29 138.99 20.63 Favored Pre-proline 0 N--CA 1.439 -0.98 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.96 -169.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -65.89 119.07 6.04 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.137 1.892 . . . . 0.0 111.857 178.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.414 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 7.3 mm-40 -113.26 77.28 1.04 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.023 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.92 -110.42 3.31 Favored Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 119.972 -1.108 . . . . 0.0 111.566 -176.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.474 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 10.3 ptpp? -99.5 -5.67 28.88 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -175.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.474 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 96.2 mtt180 -136.38 178.3 7.17 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.617 0.246 . . . . 0.0 110.553 -177.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.478 ' O ' ' HD2' ' A' ' 10' ' ' ARG . 69.4 m-85 -112.46 142.99 44.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.694 178.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.414 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 55.4 m-85 -138.5 151.41 47.35 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.096 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 70.8 m -78.67 103.71 8.79 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 174.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -117.02 161.33 19.57 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.217 -178.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -100.68 88.18 3.54 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.31 0.576 . . . . 0.0 109.639 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.536 -0.745 . . . . 0.0 109.77 179.486 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.77 0 N-CA-C 112.157 -0.377 . . . . 0.0 112.157 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.435 ' C ' ' H ' ' A' ' 4' ' ' CYS . 11.6 t -175.52 174.15 2.33 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.181 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -79.36 33.85 0.25 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.441 0.639 . . . . 0.0 111.696 -177.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 14.2 p -174.57 -162.77 0.13 Allowed 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 177.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 77.1 mt -79.95 134.03 28.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -78.69 160.76 27.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.514 0.673 . . . . 0.0 111.339 -177.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.466 HD21 ' ND1' ' A' ' 22' ' ' HIS . 0.5 OUTLIER -63.66 127.22 30.38 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.793 -174.457 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.71 -9.48 44.36 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 115.715 -0.675 . . . . 0.0 113.077 177.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -91.6 175.34 6.94 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.013 0.435 . . . . 0.0 111.447 -177.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.5 mmt85 -80.18 150.52 30.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.44 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.512 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 26.4 p -136.58 148.66 64.62 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.865 175.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.29 149.37 45.29 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.238 1.959 . . . . 0.0 110.581 171.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -48.98 120.39 9.42 Favored Pre-proline 0 C--N 1.33 -0.244 0 O-C-N 123.809 0.693 . . . . 0.0 110.637 -178.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.566 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 14.3 Cg_endo -56.08 -16.52 16.97 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.617 2.878 . . . . 0.0 113.435 -175.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -61.61 -31.7 71.78 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.729 0.299 . . . . 0.0 110.738 176.095 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -100.24 12.9 35.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.853 0.359 . . . . 0.0 110.63 178.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 88.56 108.9 1.08 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.301 -177.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.577 ' OD1' ' HB2' ' A' ' 20' ' ' CYS . 3.0 p30 -102.14 148.78 24.99 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.047 0.451 . . . . 0.0 110.427 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.505 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 26.8 m95 -106.5 31.0 5.53 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.431 0.634 . . . . 0.0 109.318 176.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.577 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 0.0 OUTLIER -68.1 -6.55 23.52 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 -174.896 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.0 p -20.35 29.22 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 118.584 2.809 . . . . 0.0 118.584 -138.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.575 ' H ' ' C ' ' A' ' 20' ' ' CYS . 3.4 m80 -106.0 -83.63 0.52 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 157.026 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.478 ' HA ' ' HE3' ' A' ' 23' ' ' LYS . 1.6 tpmt? -154.83 123.79 6.24 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.973 171.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.566 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 47.8 t -87.29 93.88 9.51 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 173.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.8 p -110.74 133.56 21.17 Favored Pre-proline 0 N--CA 1.439 -1.024 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.348 -171.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -67.36 121.66 8.81 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.496 2.131 . . . . 0.0 112.412 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -111.59 78.87 1.15 Allowed 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 173.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.5 -116.45 4.23 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -175.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -94.25 -8.09 40.15 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.5 0.667 . . . . 0.0 110.092 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 68.3 mtm180 -110.05 171.51 7.41 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.859 -174.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.443 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 94.0 m-85 -129.01 139.1 52.22 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.529 175.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -139.39 152.39 47.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.901 0.382 . . . . 0.0 110.656 -179.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 88.8 m -80.3 103.08 9.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.757 174.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -119.29 161.61 20.14 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.474 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -95.58 88.85 5.17 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.41 0.624 . . . . 0.0 109.824 178.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 . . . . . 0 C--O 1.247 0.969 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.541 -179.408 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.81 0 N-CA-C 112.587 -0.205 . . . . 0.0 112.587 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.578 HG21 ' O ' ' A' ' 4' ' ' CYS . 5.2 t -172.05 174.15 4.16 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 177.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -54.29 -50.15 67.98 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.782 0.325 . . . . 0.0 111.302 -177.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.578 ' O ' HG21 ' A' ' 2' ' ' THR . 84.6 m -101.34 -179.1 3.93 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 83.7 mt -80.35 122.32 35.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 174.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -61.88 145.31 53.14 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.772 0.796 . . . . 0.0 111.271 -174.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.64 124.84 23.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.55 -1.205 . . . . 0.0 110.829 -171.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 115.26 -21.21 13.32 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.771 -177.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -79.48 173.8 12.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.194 0.521 . . . . 0.0 111.789 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.474 ' H ' ' HD3' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -80.67 155.78 26.64 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.82 172.964 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.1 p -136.45 146.07 54.29 Favored Pre-proline 0 C--N 1.319 -0.736 0 C-N-CA 121.156 -0.217 . . . . 0.0 110.545 176.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -65.8 161.29 39.83 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.404 2.069 . . . . 0.0 110.85 172.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -49.92 118.61 8.99 Favored Pre-proline 0 C--N 1.33 -0.278 0 O-C-N 123.584 0.552 . . . . 0.0 110.919 -179.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.472 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 11.6 Cg_endo -57.46 -23.87 58.15 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.897 2.398 . . . . 0.0 112.568 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -68.18 -24.53 64.97 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.305 175.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -98.76 0.29 44.15 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.886 0.374 . . . . 0.0 110.513 -177.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.16 95.62 2.4 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.38 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.459 ' OD2' ' HB2' ' A' ' 20' ' ' CYS . 4.2 p-10 -99.86 148.68 24.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.079 0.466 . . . . 0.0 110.521 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -107.4 31.17 5.61 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.568 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -71.83 -8.78 56.38 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -171.092 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 24.6 p -19.86 29.38 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 118.576 2.806 . . . . 0.0 118.576 -140.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.568 ' H ' ' C ' ' A' ' 20' ' ' CYS . 17.3 m80 -103.02 -88.91 0.39 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 157.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.9 ttmm -155.83 124.62 6.02 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 120.756 0.312 . . . . 0.0 110.488 169.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.472 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 53.5 t -90.72 104.29 16.9 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 176.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.1 m -111.63 150.32 42.04 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.6 -173.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -76.52 118.96 5.04 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 122.629 2.219 . . . . 0.0 111.997 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -113.78 75.76 0.94 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.011 178.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.1 -111.73 3.32 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.488 -0.863 . . . . 0.0 111.948 -178.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.412 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 18.6 ptpt -85.62 -23.66 27.44 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -176.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.412 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 65.0 mtt180 -127.72 168.86 14.51 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.916 0.389 . . . . 0.0 111.139 -174.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 1.643 ' HD1' ' CD2' ' A' ' 31' ' ' PHE . 93.4 m-85 -105.71 144.15 32.85 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.93 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 1.653 ' HE1' ' CE2' ' A' ' 32' ' ' TYR . 44.2 m-85 -135.48 149.92 49.66 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.148 0.499 . . . . 0.0 110.749 -178.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.84 105.43 15.61 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.46 -176.294 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.7 mmt180 -122.04 163.29 19.65 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.767 -175.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -110.39 89.6 3.08 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.312 0.577 . . . . 0.0 111.041 -177.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.372 -0.823 . . . . 0.0 109.58 175.813 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.825 0 N-CA-C 112.166 -0.373 . . . . 0.0 112.166 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 12.6 t -171.14 166.97 7.22 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -84.28 108.77 17.33 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -178.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.463 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 15.1 p 55.06 -170.28 0.07 Allowed 'General case' 0 CA--C 1.538 0.488 0 O-C-N 124.518 1.137 . . . . 0.0 111.294 -176.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 95.9 mt -75.51 137.65 22.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 122.067 -0.396 . . . . 0.0 110.844 -175.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -65.07 147.43 53.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.712 0.768 . . . . 0.0 111.78 -176.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.43 119.71 15.97 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.801 -1.091 . . . . 0.0 109.72 -177.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.54 -16.64 28.89 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.718 -0.673 . . . . 0.0 112.309 -174.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.489 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 10.4 mm-40 -80.83 168.76 18.41 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.045 0.45 . . . . 0.0 111.341 -178.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.489 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -83.86 137.02 33.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.594 177.409 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.6 p -126.61 156.28 73.52 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 116.853 -0.158 . . . . 0.0 111.376 -175.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -72.73 156.21 53.41 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.706 2.271 . . . . 0.0 111.363 173.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.469 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 52.1 t-20 -50.83 118.2 9.68 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.003 -177.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.48 ' HA ' ' HB3' ' A' ' 18' ' ' ASP . 19.1 Cg_endo -59.47 -17.25 39.92 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.129 2.553 . . . . 0.0 113.147 -177.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -66.16 -25.34 66.91 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.698 0.285 . . . . 0.0 110.84 177.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 12.2 pt-20 -105.43 18.77 21.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.048 0.451 . . . . 0.0 110.441 177.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 91.13 104.0 1.32 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.091 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.48 ' HB3' ' HA ' ' A' ' 14' ' ' PRO . 19.0 p-10 -94.05 124.28 37.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.079 0.466 . . . . 0.0 110.813 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.463 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 12.6 m95 -84.06 38.8 0.67 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.91 0.862 . . . . 0.0 108.818 177.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.611 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -85.14 -5.84 59.32 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.242 -1.345 . . . . 0.0 113.124 -170.339 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.2 p -16.4 30.0 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 118.265 2.691 . . . . 0.0 118.265 -140.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.611 ' H ' ' C ' ' A' ' 20' ' ' CYS . 31.3 m80 -107.07 -94.42 0.38 Allowed 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 153.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.564 ' HE2' ' HA ' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -156.37 118.92 4.06 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 120.89 0.376 . . . . 0.0 111.295 168.689 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.534 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 42.8 t -80.0 124.04 28.35 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 173.465 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.1 m -130.36 159.19 71.81 Favored Pre-proline 0 C--N 1.317 -0.815 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.226 -176.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -80.7 120.08 3.82 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.812 2.341 . . . . 0.0 112.303 -177.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.458 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 10.8 mm-40 -113.03 75.5 0.92 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.246 -0.888 . . . . 0.0 108.99 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.8 -111.04 3.61 Favored Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 120.239 -0.981 . . . . 0.0 111.929 -176.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.6 pttm -79.72 -29.65 40.72 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -175.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -125.54 175.7 7.36 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.956 0.408 . . . . 0.0 111.356 -174.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 1.62 ' HD1' ' CD2' ' A' ' 31' ' ' PHE . 97.2 m-85 -110.79 141.27 44.34 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.379 -179.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 1.657 ' HD2' ' CD1' ' A' ' 32' ' ' TYR . 27.8 m-85 -131.31 149.4 52.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.441 -178.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -84.1 110.25 18.34 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.794 -177.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.5 mmt180 -120.75 160.77 22.67 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.717 -176.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -98.14 88.15 4.13 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.677 0.751 . . . . 0.0 110.595 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 . . . . . 0 C--O 1.246 0.878 0 CA-C-O 118.495 -0.764 . . . . 0.0 110.376 178.34 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.492 0 N-CA-C 111.848 -0.501 . . . . 0.0 111.848 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.1 t -106.67 39.07 1.91 Allowed 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.129 0.49 . . . . 0.0 110.567 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.646 ' HD2' ' CD1' ' A' ' 3' ' ' TYR . 69.6 m-85 65.18 97.45 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.204 -172.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 73.62 -177.42 0.17 Allowed 'General case' 0 CA--C 1.532 0.272 0 O-C-N 124.385 1.053 . . . . 0.0 109.191 -167.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 82.1 mt -73.46 134.4 29.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.159 0.504 . . . . 0.0 111.31 -173.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.426 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 3.8 mp0 -59.45 151.24 24.43 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.028 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.467 HD21 ' CG ' ' A' ' 22' ' ' HIS . 1.4 tm? -75.2 121.49 22.21 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.444 -178.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 107.72 -5.51 34.94 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.161 -176.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.426 ' HG3' ' HB2' ' A' ' 6' ' ' GLU . 8.7 mm-40 -91.19 170.95 9.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.707 0.289 . . . . 0.0 110.237 178.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.13 150.52 25.48 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 25.4 p -129.64 145.81 58.54 Favored Pre-proline 0 C--N 1.318 -0.781 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.308 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -68.04 154.07 73.49 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.039 1.826 . . . . 0.0 110.325 173.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -49.17 121.76 11.24 Favored Pre-proline 0 C--N 1.33 -0.257 0 O-C-N 123.748 0.655 . . . . 0.0 109.92 -177.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.464 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 10.3 Cg_endo -51.84 -26.48 24.34 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.73 2.953 . . . . 0.0 114.14 -172.479 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -77.38 -12.41 59.95 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.727 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -101.54 13.64 34.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.885 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.75 80.7 1.14 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.621 178.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -88.65 147.2 24.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.002 0.43 . . . . 0.0 110.586 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.7 m0 -106.25 29.79 6.49 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 174.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.565 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.5 OUTLIER -63.97 -8.01 10.17 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 -171.241 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 11.5 p -20.8 30.17 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 118.462 2.764 . . . . 0.0 118.462 -141.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.565 ' H ' ' C ' ' A' ' 20' ' ' CYS . 78.3 m80 -111.07 -83.48 0.57 Allowed 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 164.135 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.405 ' HG2' ' HB ' ' A' ' 25' ' ' VAL . 24.9 ttmm -154.92 118.84 4.61 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.974 168.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.464 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 20.1 t -82.55 89.64 6.7 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 173.285 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.405 ' HB ' ' HG2' ' A' ' 23' ' ' LYS . 7.1 p -109.48 135.81 20.29 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.093 -170.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -64.15 119.53 6.6 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.06 1.84 . . . . 0.0 111.918 178.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -111.69 75.79 0.94 Allowed 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 178.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 82.93 -109.92 3.17 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 119.542 -1.313 . . . . 0.0 111.369 -173.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.52 ' HB2' ' HZ3' ' A' ' 29' ' ' LYS . 4.6 ttmp? -91.77 -35.51 14.08 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.843 0.354 . . . . 0.0 111.569 -177.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -103.62 178.26 4.61 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.074 0.464 . . . . 0.0 111.199 -173.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -116.34 140.08 49.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.745 176.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -139.44 150.53 45.34 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.765 0.317 . . . . 0.0 110.541 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.434 ' O ' HD23 ' A' ' 7' ' ' LEU . 67.4 m -77.58 103.25 7.41 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.047 176.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -116.5 157.94 24.41 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.231 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -104.95 88.76 2.96 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 177.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.705 -0.664 . . . . 0.0 109.881 -179.968 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.75 0 N-CA-C 112.118 -0.393 . . . . 0.0 112.118 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.404 ' C ' ' H ' ' A' ' 4' ' ' CYS . 9.9 t -67.53 154.48 41.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.706 0.289 . . . . 0.0 110.508 179.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -82.27 43.46 0.8 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.788 0.804 . . . . 0.0 110.09 176.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.404 ' H ' ' C ' ' A' ' 2' ' ' THR . 77.6 m -152.52 -177.1 6.01 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.267 -1.333 . . . . 0.0 107.913 -178.502 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 83.2 mt -68.99 136.69 25.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 176.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -62.12 148.27 44.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.663 0.744 . . . . 0.0 110.995 -178.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.464 HD21 ' CG ' ' A' ' 22' ' ' HIS . 1.0 OUTLIER -74.28 117.62 16.31 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.937 -1.028 . . . . 0.0 110.008 -175.041 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 114.24 -13.77 21.25 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.131 -175.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -82.3 170.71 15.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.008 0.432 . . . . 0.0 110.799 -179.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.454 ' N ' ' HD3' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -87.23 141.31 28.75 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.588 178.118 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.447 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 26.1 p -127.42 148.46 66.51 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.85 161.72 44.14 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.282 1.988 . . . . 0.0 111.021 175.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -50.05 118.35 8.83 Favored Pre-proline 0 C--N 1.329 -0.311 0 O-C-N 123.462 0.476 . . . . 0.0 109.886 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -54.03 -19.29 15.41 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 123.433 2.756 . . . . 0.0 113.501 -174.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.4 mmm180 -68.16 -18.46 64.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.897 177.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -92.85 -4.7 52.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.507 178.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 125.56 98.04 1.13 Allowed Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.589 -175.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -78.24 114.07 16.79 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.819 0.342 . . . . 0.0 110.859 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 3.5 m0 -110.44 13.68 22.72 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.265 176.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.65 ' C ' ' H ' ' A' ' 22' ' ' HIS . 51.2 t -74.03 -9.21 58.4 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -176.503 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.7 p -17.69 31.62 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 117.643 2.46 . . . . 0.0 117.643 -138.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.65 ' H ' ' C ' ' A' ' 20' ' ' CYS . 73.3 m80 -99.38 -87.37 0.36 Allowed 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 159.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -155.1 117.84 4.31 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.297 164.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 45.4 t -80.37 91.03 5.63 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 172.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.4 p -110.15 138.99 20.98 Favored Pre-proline 0 C--N 1.313 -0.99 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.244 -167.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -59.73 119.7 7.07 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.212 1.941 . . . . 0.0 111.536 177.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -120.81 77.61 1.31 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.38 -0.827 . . . . 0.0 108.945 -177.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.26 -111.09 3.42 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.307 -0.949 . . . . 0.0 111.528 -174.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -94.64 -24.6 17.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.872 0.368 . . . . 0.0 111.331 -177.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -119.47 176.29 5.42 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.482 -174.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 1.662 ' HD2' ' CD1' ' A' ' 31' ' ' PHE . 97.3 m-85 -103.14 140.72 36.96 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.897 176.067 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 1.664 ' HE2' ' CE1' ' A' ' 32' ' ' TYR . 25.7 m-85 -132.05 150.41 52.16 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.284 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.461 ' O ' HD23 ' A' ' 7' ' ' LEU . 6.2 t -84.14 97.31 9.28 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -114.43 160.51 19.08 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.382 -174.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -103.9 90.07 3.5 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.005 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 . . . . . 0 C--O 1.246 0.911 0 CA-C-O 118.421 -0.8 . . . . 0.0 109.691 178.451 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.841 0 N-CA-C 112.191 -0.364 . . . . 0.0 112.191 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.435 ' CG2' ' HA ' ' A' ' 6' ' ' GLU . 12.4 t -161.56 36.71 0.13 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.538 0.685 . . . . 0.0 109.613 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 70.32 -58.43 0.55 Allowed 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.354 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.525 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 47.8 m -96.08 -163.05 1.01 Allowed 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 176.026 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.459 ' HB ' ' SG ' ' A' ' 33' ' ' CYS . 77.7 mt -59.43 130.95 23.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.031 0.443 . . . . 0.0 109.928 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.435 ' HA ' ' CG2' ' A' ' 2' ' ' THR . 1.8 pm0 -69.46 150.95 46.66 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.93 0.871 . . . . 0.0 111.358 -177.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.405 HD21 ' ND1' ' A' ' 22' ' ' HIS . 0.5 OUTLIER -68.46 115.62 8.09 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.338 -1.301 . . . . 0.0 110.58 -171.44 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 116.91 -13.45 14.45 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.358 -176.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -84.17 170.78 13.43 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.247 0.546 . . . . 0.0 111.694 179.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.472 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 9.5 mpt_? -79.92 155.33 27.78 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.303 -177.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.447 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 30.2 t -135.13 140.22 34.12 Favored Pre-proline 0 C--N 1.316 -0.852 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.555 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.34 162.74 41.41 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.769 2.313 . . . . 0.0 110.551 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.1 t-20 -53.79 112.79 4.11 Favored Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.67 -15.73 21.93 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.442 2.762 . . . . 0.0 113.943 -171.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.9 ptm180 -63.99 -25.46 68.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.011 0.434 . . . . 0.0 110.414 175.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -88.05 -2.97 58.93 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.47 178.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 131.14 156.22 8.44 Favored Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 -177.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -123.35 109.94 14.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.358 0.579 . . . . 0.0 111.102 -178.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.525 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 45.3 t-105 -107.16 21.9 16.82 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.092 0.948 . . . . 0.0 108.563 173.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.553 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -83.73 -5.27 59.15 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.571 -1.195 . . . . 0.0 112.161 -175.187 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 22.4 m -20.84 30.62 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 118.672 2.841 . . . . 0.0 118.672 -142.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.553 ' H ' ' C ' ' A' ' 20' ' ' CYS . 57.1 m80 -107.65 -83.48 0.54 Allowed 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 159.134 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.4 tttm -154.28 122.33 5.99 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.805 167.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 47.2 t -80.95 91.9 6.09 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 175.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 5.7 p -114.2 137.56 22.55 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.028 -169.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -66.64 120.07 7.15 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.508 2.139 . . . . 0.0 112.523 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -111.02 76.88 1.0 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.07 -0.968 . . . . 0.0 108.774 178.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.77 -111.08 3.45 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.263 -0.97 . . . . 0.0 111.833 -172.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.4 ptpp? -97.32 -23.81 15.95 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 117.055 0.428 . . . . 0.0 111.98 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -111.49 168.71 9.33 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.009 0.433 . . . . 0.0 110.978 -176.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.442 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 98.4 m-85 -104.05 143.94 32.23 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.711 176.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 59.6 m-85 -139.55 154.36 47.63 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.459 ' SG ' ' HB ' ' A' ' 5' ' ' ILE . 95.5 m -82.58 105.13 13.37 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.779 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -116.18 157.93 24.06 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.882 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -94.63 87.73 5.18 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 122.022 0.915 . . . . 0.0 110.017 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 . . . . . 0 C--O 1.249 1.033 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.923 -178.974 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.766 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 11.5 t -107.92 151.8 25.3 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -85.88 54.02 2.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.51 0.671 . . . . 0.0 110.531 -176.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 13.6 p -175.19 -175.93 0.88 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.061 176.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 77.9 mt -73.09 130.94 35.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.903 0.382 . . . . 0.0 110.114 -179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.44 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 3.4 pm0 -72.17 159.92 33.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.672 0.748 . . . . 0.0 111.176 -176.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.443 HD21 ' CG ' ' A' ' 22' ' ' HIS . 0.4 OUTLIER -70.3 120.6 16.21 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.017 -171.589 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 112.46 -9.42 26.33 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.616 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.464 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 16.0 mm-40 -89.98 167.23 12.96 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.022 0.439 . . . . 0.0 111.226 -179.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.464 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -78.2 142.4 37.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.966 -179.628 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 24.2 p -128.12 148.77 68.93 Favored Pre-proline 0 C--N 1.318 -0.799 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.44 177.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -72.12 150.74 54.46 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.335 2.023 . . . . 0.0 110.621 172.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.419 ' OD1' ' HG2' ' A' ' 15' ' ' ARG . 45.2 t-20 -49.67 122.77 13.78 Favored Pre-proline 0 C--N 1.333 -0.119 0 O-C-N 123.659 0.6 . . . . 0.0 110.238 -177.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.459 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 10.1 Cg_endo -51.28 -28.31 26.11 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 124.007 3.138 . . . . 0.0 114.065 -173.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.419 ' HG2' ' OD1' ' A' ' 13' ' ' ASN . 14.4 ptm180 -69.85 -18.49 63.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.907 0.384 . . . . 0.0 110.845 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -93.62 -8.54 40.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.374 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.31 86.31 1.91 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.158 -177.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.45 ' OD2' ' HB2' ' A' ' 20' ' ' CYS . 8.5 p-10 -90.09 146.85 24.01 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.976 0.417 . . . . 0.0 111.043 -178.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.482 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 36.7 m95 -107.44 35.67 2.99 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 176.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.623 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -70.97 -6.77 41.3 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 114.668 1.358 . . . . 0.0 114.668 -171.194 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.9 p -17.9 30.1 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 117.952 2.575 . . . . 0.0 117.952 -139.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.623 ' H ' ' C ' ' A' ' 20' ' ' CYS . 77.6 m80 -109.36 -91.65 0.45 Allowed 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 159.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.9 tttm -154.2 129.11 9.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 167.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.459 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 42.4 t -89.08 103.13 15.77 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 178.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 28.5 m -115.44 147.68 39.25 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.004 -175.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -75.15 119.41 5.59 Favored 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.44 2.093 . . . . 0.0 111.935 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -110.74 74.96 0.9 Allowed 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 178.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.14 -110.49 3.05 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.036 -1.078 . . . . 0.0 112.177 -177.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -87.98 -16.0 34.94 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -175.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -125.31 179.37 5.12 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.086 0.47 . . . . 0.0 111.352 -176.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.442 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 90.8 m-85 -117.58 143.76 45.8 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.169 171.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -138.81 148.82 44.23 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.962 0.41 . . . . 0.0 110.666 -179.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 98.4 m -75.86 103.71 6.06 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.598 174.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -113.07 159.22 19.41 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.486 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -94.37 88.74 5.63 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 176.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 . . . . . 0 C--N 1.315 -0.893 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.428 -177.92 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.8 0 N-CA-C 111.983 -0.447 . . . . 0.0 111.983 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.8 t -116.66 158.11 24.31 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.629 ' HD2' ' CD1' ' A' ' 3' ' ' TYR . 22.9 p90 -75.48 -4.41 39.57 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.412 0.625 . . . . 0.0 110.662 177.375 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.599 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 62.7 m -106.87 -162.43 0.85 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.301 176.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.41 ' HB ' ' HA ' ' A' ' 20' ' ' CYS . 88.3 mt -71.29 136.14 26.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.01 0.433 . . . . 0.0 110.156 177.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -62.53 151.4 37.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.203 -178.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.469 HD21 ' CG ' ' A' ' 22' ' ' HIS . 0.9 OUTLIER -76.61 121.96 23.95 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.656 -177.632 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.33 -6.78 42.68 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.908 -175.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -83.77 173.99 10.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.001 0.429 . . . . 0.0 110.875 177.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.517 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 7.3 mpt_? -96.58 142.88 28.11 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.441 177.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.3 p -124.61 152.04 68.36 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-O 120.635 0.255 . . . . 0.0 110.989 -177.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.7 151.77 69.46 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.369 2.046 . . . . 0.0 110.755 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.569 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 46.9 t-20 -50.18 116.23 6.3 Favored Pre-proline 0 C--N 1.33 -0.282 0 O-C-N 123.704 0.627 . . . . 0.0 110.33 -178.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.552 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 9.9 Cg_endo -52.97 -22.48 18.57 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.505 2.804 . . . . 0.0 114.033 -171.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.47 ' HG3' ' OD1' ' A' ' 13' ' ' ASN . 0.0 OUTLIER -66.77 -14.65 62.86 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 178.864 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.569 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 11.4 pt-20 -107.57 10.3 29.23 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.765 0.317 . . . . 0.0 110.93 177.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 98.0 103.56 2.3 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.448 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.411 ' HB3' ' HA ' ' A' ' 14' ' ' PRO . 3.0 p-10 -101.94 147.5 26.47 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.276 0.56 . . . . 0.0 110.501 179.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.599 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 1.2 m-90 -108.33 31.12 5.81 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 174.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.615 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -74.96 -9.51 58.6 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -169.386 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.9 m -18.75 30.86 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 118.013 2.597 . . . . 0.0 118.013 -141.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.615 ' H ' ' C ' ' A' ' 20' ' ' CYS . 70.5 m80 -104.78 -88.84 0.42 Allowed 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 162.077 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -155.07 120.7 5.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 166.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.552 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 46.3 t -83.57 94.25 8.03 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 174.218 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.0 p -115.84 137.18 23.11 Favored Pre-proline 0 N--CA 1.439 -1.003 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.256 -168.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.08 127.4 23.08 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.721 2.281 . . . . 0.0 112.863 -178.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.482 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 7.1 mm-40 -124.58 91.34 3.42 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.779 176.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.8 -111.82 3.49 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.371 -0.919 . . . . 0.0 111.595 -177.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.535 ' HB2' ' HZ3' ' A' ' 29' ' ' LYS . 0.0 OUTLIER -107.67 3.52 24.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.85 0.357 . . . . 0.0 110.982 -179.528 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 50.7 mtt180 -126.16 -179.22 4.62 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.166 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 1.617 ' HE2' ' CE1' ' A' ' 31' ' ' PHE . 96.5 m-85 -120.73 139.94 52.35 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.786 176.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.482 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 17.7 m-85 -131.9 154.51 49.15 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.372 0.606 . . . . 0.0 110.851 -177.05 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.445 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -89.82 99.67 12.63 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.172 179.478 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -110.32 161.31 15.75 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.777 -177.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -102.38 88.34 3.25 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.281 0.562 . . . . 0.0 109.672 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.421 ' HA ' ' OE1' ' A' ' 36' ' ' GLN . 14.6 mm-40 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.442 -0.789 . . . . 0.0 109.844 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.891 0 N-CA-C 111.867 -0.493 . . . . 0.0 111.867 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.413 ' O ' ' HB3' ' A' ' 3' ' ' TYR . 3.7 t -175.65 76.42 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.016 0.436 . . . . 0.0 110.417 -177.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.413 ' HB3' ' O ' ' A' ' 2' ' ' THR . 50.6 t80 70.98 -49.01 0.68 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.252 0.621 . . . . 0.0 111.188 -177.118 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 71.9 m -134.86 151.17 50.69 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 173.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 75.5 mt -64.51 123.51 17.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -68.09 156.15 38.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.966 0.889 . . . . 0.0 111.975 -172.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.4 HD23 ' O ' ' A' ' 33' ' ' CYS . 0.4 OUTLIER -63.47 123.94 20.06 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.134 -1.394 . . . . 0.0 110.952 -174.141 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.65 -14.66 29.65 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.484 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -85.29 168.72 14.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.11 0.481 . . . . 0.0 111.197 -179.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.403 ' HD3' ' N ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -89.81 138.22 31.67 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.715 179.565 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.465 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 22.4 p -120.03 146.91 43.3 Favored Pre-proline 0 C--N 1.318 -0.788 0 C-N-CA 121.014 -0.275 . . . . 0.0 110.977 -179.018 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -63.68 150.37 88.61 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.287 1.991 . . . . 0.0 109.941 168.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.589 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 45.8 t-20 -49.4 122.6 12.75 Favored Pre-proline 0 C--N 1.329 -0.306 0 O-C-N 123.592 0.558 . . . . 0.0 110.098 -179.369 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.644 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 12.0 Cg_endo -55.02 -17.58 14.77 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 123.3 2.667 . . . . 0.0 113.48 -173.533 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -70.44 -22.0 62.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.97 177.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 12.7 pt-20 -106.75 13.48 27.92 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.045 0.45 . . . . 0.0 110.411 178.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 129.15 126.25 2.83 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.297 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -111.52 107.36 16.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.879 0.371 . . . . 0.0 110.27 -178.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.7 m95 -111.02 11.34 22.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.181 0.515 . . . . 0.0 110.075 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.589 ' C ' ' H ' ' A' ' 22' ' ' HIS . 1.0 OUTLIER -71.49 -4.95 29.52 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -172.636 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 10.7 m -18.24 29.79 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 118.387 2.736 . . . . 0.0 118.387 -139.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.589 ' H ' ' C ' ' A' ' 20' ' ' CYS . 37.0 m80 -106.44 -83.61 0.52 Allowed 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 158.017 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -154.89 123.98 6.29 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.293 167.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.644 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 49.1 t -86.38 91.65 8.58 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 173.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.6 p -114.85 139.74 24.57 Favored Pre-proline 0 C--N 1.313 -1.005 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.926 -169.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -57.62 126.07 20.7 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 122.659 2.239 . . . . 0.0 112.508 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -122.99 76.44 1.37 Allowed 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.08 -111.71 3.49 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.584 -0.817 . . . . 0.0 111.337 -173.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.6 tttp -92.23 -36.27 13.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.216 0.532 . . . . 0.0 110.779 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 87.6 mtt180 -100.89 178.86 4.56 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.328 -174.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 90.2 m-85 -113.39 143.83 43.8 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.754 178.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -135.48 148.13 49.11 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.465 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.4 ' O ' HD23 ' A' ' 7' ' ' LEU . 88.1 m -78.51 101.87 7.58 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 174.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -112.96 160.59 17.93 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.743 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -100.9 88.04 3.45 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 176.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.37 -0.824 . . . . 0.0 109.546 -178.472 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.769 0 N-CA-C 112.147 -0.381 . . . . 0.0 112.147 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 54.6 m -86.36 101.29 12.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.424 0.154 . . . . 0.0 111.255 -178.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.67 ' HD2' ' CD1' ' A' ' 3' ' ' TYR . 36.1 m-85 -66.53 -40.61 89.23 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.43 0.633 . . . . 0.0 109.746 171.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -153.8 158.64 41.19 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.096 -0.956 . . . . 0.0 108.657 178.008 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 93.5 mt -52.98 131.95 15.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 121.287 0.565 . . . . 0.0 111.973 -171.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.2 mp0 -61.29 157.22 16.91 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.324 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.524 HD21 ' CG ' ' A' ' 22' ' ' HIS . 1.1 tm? -79.88 126.59 31.19 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.069 -175.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.95 -7.93 53.42 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.96 -176.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -86.64 174.04 9.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.169 0.509 . . . . 0.0 111.25 -178.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -85.77 143.47 28.29 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.452 176.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 27.0 p -133.63 152.7 79.45 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.698 -179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -77.98 154.07 29.32 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.66 2.24 . . . . 0.0 111.3 173.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -50.31 117.47 7.96 Favored Pre-proline 0 C--O 1.234 0.274 0 O-C-N 123.487 0.492 . . . . 0.0 110.118 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.43 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 18.3 Cg_endo -58.51 -13.68 18.04 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 123.347 2.698 . . . . 0.0 113.491 -172.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -66.79 -21.99 66.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.961 178.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -118.17 21.25 12.85 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.862 0.363 . . . . 0.0 111.486 -177.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 130.8 98.0 0.78 Allowed Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.542 178.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -92.18 106.91 18.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.971 0.415 . . . . 0.0 110.578 177.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 39.4 m95 -113.47 28.12 9.03 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.806 0.812 . . . . 0.0 109.174 178.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.629 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -85.15 -5.87 59.32 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.471 -170.73 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.6 p -14.25 29.76 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 117.796 2.517 . . . . 0.0 117.796 -139.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.629 ' H ' ' C ' ' A' ' 20' ' ' CYS . 72.9 m80 -111.22 -92.82 0.45 Allowed 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 164.032 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.2 tttm -155.22 118.41 4.4 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 165.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.43 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 42.2 t -82.2 102.4 11.1 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 174.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 9.9 p -121.6 136.09 25.7 Favored Pre-proline 0 N--CA 1.438 -1.065 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.52 -169.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -64.0 119.75 6.89 Favored 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 122.472 2.115 . . . . 0.0 112.25 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -113.74 76.91 1.01 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.293 -0.867 . . . . 0.0 108.73 178.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.6 -111.6 3.51 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.314 -0.946 . . . . 0.0 111.991 -174.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.489 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 18.3 ptpt -102.05 -8.3 21.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.887 0.343 . . . . 0.0 111.912 -175.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.489 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 95.4 mtt180 -127.97 171.64 11.64 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.843 0.354 . . . . 0.0 110.272 -178.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -110.1 139.99 44.64 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.388 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -134.73 151.8 51.27 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.736 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.426 ' O ' HD23 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -86.0 103.93 15.15 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.116 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -115.17 158.82 21.71 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.151 -175.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -100.28 91.46 4.74 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.753 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.565 -0.731 . . . . 0.0 109.565 179.221 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.785 0 N-CA-C 112.196 -0.362 . . . . 0.0 112.196 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.1 m 66.27 66.51 0.47 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.578 0.704 . . . . 0.0 110.452 -177.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 29.2 p90 -69.85 -28.95 66.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.999 173.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 65.0 m -127.3 142.33 51.49 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 171.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.44 HG23 ' HB2' ' A' ' 9' ' ' GLU . 75.7 mt -65.69 135.26 28.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.154 -176.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.7 mp0 -56.44 145.36 27.85 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 121.524 0.678 . . . . 0.0 111.307 -178.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.456 HD21 ' ND1' ' A' ' 22' ' ' HIS . 1.5 tm? -68.82 121.29 16.24 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.653 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 109.21 -8.34 33.05 Favored Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.139 -176.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.44 ' HB2' HG23 ' A' ' 5' ' ' ILE . 61.8 mm-40 -86.99 175.76 7.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.019 0.438 . . . . 0.0 110.969 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -91.53 144.85 25.13 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.132 179.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 9.4 p -129.46 147.17 64.05 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.65 179.03 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -68.78 160.53 49.22 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.202 1.935 . . . . 0.0 110.199 171.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.3 t-20 -49.74 117.78 7.69 Favored Pre-proline 0 C--O 1.234 0.285 0 O-C-N 123.36 0.412 . . . . 0.0 110.442 -176.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.494 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 13.5 Cg_endo -57.67 -18.69 34.39 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.523 2.815 . . . . 0.0 113.918 -173.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 -66.96 -24.04 66.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.87 0.367 . . . . 0.0 110.144 177.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -89.59 -3.7 58.18 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.087 177.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 137.23 134.71 3.29 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.477 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -110.73 106.51 15.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.375 0.587 . . . . 0.0 109.905 -179.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -103.29 9.34 38.1 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.486 0.66 . . . . 0.0 109.794 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.673 ' SG ' ' HB2' ' A' ' 24' ' ' CYS . 8.4 m -73.74 -2.8 24.88 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 124.184 0.993 . . . . 0.0 113.372 -175.015 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.8 m -17.0 29.7 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 118.309 2.707 . . . . 0.0 118.309 -138.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.582 ' H ' ' C ' ' A' ' 20' ' ' CYS . 32.1 m80 -104.51 -86.66 0.45 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 156.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.6 tttm -155.73 120.02 4.59 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 120.414 0.15 . . . . 0.0 110.657 169.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.673 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 41.9 t -85.07 110.17 18.75 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 175.618 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.1 m -124.52 158.91 60.13 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.338 -173.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -81.47 119.71 3.44 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 122.552 2.168 . . . . 0.0 112.034 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -110.57 75.31 0.92 Allowed 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 177.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 75.75 -111.65 3.38 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.921 -175.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.462 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 22.5 pttm -84.21 -28.68 27.13 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -176.226 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.462 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 62.4 mtt-85 -118.38 171.35 8.21 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.996 0.427 . . . . 0.0 110.995 -175.437 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.51 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 97.1 m-85 -107.32 145.1 33.23 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.899 177.499 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 1.638 ' HE2' ' CE1' ' A' ' 32' ' ' TYR . 37.5 m-85 -136.77 149.01 47.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.452 -179.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 85.0 m -79.3 102.78 8.81 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 175.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -115.09 161.48 18.32 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 -179.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -103.93 88.26 2.99 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.2 mm-40 . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.349 -179.619 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.78 0 N-CA-C 111.758 -0.537 . . . . 0.0 111.758 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.1 t -161.01 130.61 4.85 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -179.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.664 ' HD2' ' CD1' ' A' ' 3' ' ' TYR . 50.4 p90 -98.21 132.13 43.98 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 19' ' ' TRP . 36.3 m 67.05 116.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.524 -172.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.17 138.25 23.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.182 -174.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.0 mp0 -55.58 141.31 37.84 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.074 -177.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.82 120.0 15.77 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.377 -177.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 111.46 -14.14 27.75 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.093 -175.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -84.53 165.16 18.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.989 0.423 . . . . 0.0 111.228 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.99 145.9 33.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.475 175.262 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.6 p -125.42 137.95 30.85 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.712 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -57.57 157.53 22.65 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.654 2.236 . . . . 0.0 111.072 172.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -49.86 114.08 3.92 Favored Pre-proline 0 C--O 1.231 0.123 0 O-C-N 123.526 0.516 . . . . 0.0 110.456 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -57.89 -19.41 39.35 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 123.208 2.605 . . . . 0.0 113.616 -172.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -68.28 -19.7 64.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.748 0.309 . . . . 0.0 110.733 177.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -89.3 -8.82 52.55 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.964 0.411 . . . . 0.0 110.342 178.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 136.26 112.07 1.15 Allowed Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 111.603 -0.599 . . . . 0.0 111.603 -176.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -86.64 113.11 22.25 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.964 0.411 . . . . 0.0 110.541 -178.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.545 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 3.0 m0 -111.86 26.4 10.66 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 174.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.595 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -84.84 -6.02 59.34 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.88 -171.284 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.4 m -18.57 29.52 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 118.207 2.669 . . . . 0.0 118.207 -138.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.595 ' H ' ' C ' ' A' ' 20' ' ' CYS . 42.7 m80 -107.41 -90.83 0.43 Allowed 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 158.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -156.03 126.66 6.79 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 168.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.485 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 50.2 t -90.44 100.2 13.08 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 176.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.6 m -109.79 146.34 33.89 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-O 121.094 0.473 . . . . 0.0 111.656 -174.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.13 121.68 5.43 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.73 2.286 . . . . 0.0 112.188 178.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -118.86 90.3 3.31 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 176.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.42 -110.87 3.4 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.313 -0.946 . . . . 0.0 111.422 -174.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.5 tttp -104.65 -16.93 14.85 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.011 0.434 . . . . 0.0 110.869 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -111.38 167.08 10.58 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.929 -173.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.485 ' HB3' ' SG ' ' A' ' 24' ' ' CYS . 96.3 m-85 -110.49 140.75 44.45 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.014 177.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -135.55 149.14 49.36 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.015 0.436 . . . . 0.0 110.633 -179.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -85.84 107.44 17.67 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.533 -176.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -122.02 158.56 28.89 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.379 -174.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -97.7 88.65 4.39 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.911 0.862 . . . . 0.0 109.914 177.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 . . . . . 0 C--O 1.246 0.915 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.453 -178.586 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.638 0 N-CA-C 112.183 -0.367 . . . . 0.0 112.183 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.6 t -175.86 152.98 1.3 Allowed 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 178.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.639 ' HD2' ' CD1' ' A' ' 3' ' ' TYR . 12.2 p90 -85.41 20.44 2.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.699 0.762 . . . . 0.0 110.525 175.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.572 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 62.5 m -132.73 -161.7 1.16 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 178.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 89.1 mt -64.73 130.27 29.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 118.152 0.433 . . . . 0.0 110.107 178.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -59.47 147.64 35.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.233 -177.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.27 115.79 14.17 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.944 -175.248 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.5 -18.55 11.88 Favored Glycine 0 N--CA 1.445 -0.717 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.998 -174.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.411 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 8.2 mm-40 -75.91 166.63 23.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.036 0.446 . . . . 0.0 111.04 -179.121 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.411 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -84.77 138.24 32.72 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 176.304 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 23.1 p -117.81 148.55 43.45 Favored Pre-proline 0 C--N 1.316 -0.88 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.197 -178.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.23 154.46 69.8 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.684 2.256 . . . . 0.0 110.93 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.59 ' OD1' ' HG2' ' A' ' 15' ' ' ARG . 47.5 t-20 -51.99 116.92 8.99 Favored Pre-proline 0 C--O 1.233 0.196 0 O-C-N 123.699 0.624 . . . . 0.0 110.543 -177.013 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.475 ' HA ' ' HB3' ' A' ' 18' ' ' ASP . 14.5 Cg_endo -56.62 -20.57 34.91 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.442 2.761 . . . . 0.0 114.129 -172.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.59 ' HG2' ' OD1' ' A' ' 13' ' ' ASN . 10.1 ptm180 -64.45 -23.99 67.47 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 121.045 -0.262 . . . . 0.0 111.046 177.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -92.11 0.48 57.46 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.908 0.385 . . . . 0.0 110.641 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 99.89 94.55 2.11 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.812 -0.709 . . . . 0.0 111.877 -177.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.475 ' HB3' ' HA ' ' A' ' 14' ' ' PRO . 9.2 p-10 -86.83 147.59 25.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.101 0.477 . . . . 0.0 110.679 -179.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.572 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 26.0 m95 -111.74 36.26 3.35 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 176.004 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.61 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -79.4 -6.97 58.0 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.329 -1.305 . . . . 0.0 113.179 -171.659 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.9 m -17.77 31.24 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 118.077 2.621 . . . . 0.0 118.077 -141.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.61 ' H ' ' C ' ' A' ' 20' ' ' CYS . 69.0 m80 -109.35 -87.98 0.5 Allowed 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 161.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -154.6 124.22 6.56 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.158 167.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.447 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 44.9 t -84.97 90.78 7.9 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 172.313 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.7 p -106.7 132.09 21.18 Favored Pre-proline 0 N--CA 1.44 -0.946 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.782 -168.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -67.36 119.82 6.85 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.441 2.094 . . . . 0.0 112.726 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -113.38 85.23 2.15 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.897 -1.047 . . . . 0.0 108.941 177.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 79.23 -111.15 3.19 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 119.945 -1.121 . . . . 0.0 111.326 -175.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -94.44 -30.19 14.58 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.093 0.473 . . . . 0.0 110.88 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -98.85 174.17 6.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.224 -173.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 1.654 ' HE2' ' CE1' ' A' ' 31' ' ' PHE . 82.2 m-85 -117.06 137.78 52.03 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.414 174.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 1.635 ' HE1' ' CE2' ' A' ' 32' ' ' TYR . 68.3 m-85 -130.89 150.44 52.05 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.009 0.433 . . . . 0.0 110.173 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -85.52 100.63 12.04 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.394 -178.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.0 mmm180 -119.91 163.66 17.22 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.193 -175.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -107.5 89.68 3.07 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.827 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 . . . . . 0 C--O 1.246 0.878 0 CA-C-O 118.516 -0.754 . . . . 0.0 110.119 -179.438 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.791 0 N-CA-C 112.013 -0.435 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.424 HG21 ' H ' ' A' ' 4' ' ' CYS . 9.9 t -101.32 179.05 4.47 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.196 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.632 ' HD1' ' CD2' ' A' ' 3' ' ' TYR . 27.4 p90 -74.77 10.56 1.35 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.335 0.588 . . . . 0.0 111.727 -178.149 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.424 ' H ' HG21 ' A' ' 2' ' ' THR . 76.0 m -145.88 -173.69 4.22 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 176.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 89.2 mt -70.65 134.24 30.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 176.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -58.48 145.97 37.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.534 0.683 . . . . 0.0 110.796 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.48 121.86 22.14 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.563 -176.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.25 -6.5 34.36 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.354 -174.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -86.17 168.74 13.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.101 0.477 . . . . 0.0 111.629 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.43 ' HD2' ' N ' ' A' ' 11' ' ' CYS . 2.3 tmm_? -88.52 127.85 35.54 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.161 177.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.43 ' N ' ' HD2' ' A' ' 10' ' ' ARG . 25.7 p -113.37 151.03 44.04 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-O 120.636 0.255 . . . . 0.0 111.315 -174.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.34 146.99 64.53 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.591 2.194 . . . . 0.0 110.87 173.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.6 t-20 -50.39 120.07 11.88 Favored Pre-proline 0 C--O 1.231 0.129 0 O-C-N 123.708 0.63 . . . . 0.0 110.112 -177.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.528 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 14.5 Cg_endo -56.44 -21.0 35.4 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 123.308 2.672 . . . . 0.0 113.589 -174.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.18 -18.0 63.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.846 0.355 . . . . 0.0 110.303 177.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -101.08 -4.68 26.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.566 178.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.63 107.72 3.23 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.159 -177.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -109.87 146.77 34.54 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.04 0.448 . . . . 0.0 110.39 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 2.1 m-90 -108.73 33.82 4.01 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 177.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.618 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -78.41 -9.29 59.23 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -169.379 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.7 p -19.29 29.93 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 118.231 2.678 . . . . 0.0 118.231 -140.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.618 ' H ' ' C ' ' A' ' 20' ' ' CYS . 66.7 m80 -103.03 -87.6 0.42 Allowed 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 161.395 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.402 ' HE3' ' N ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -155.39 117.7 4.18 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 167.96 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.528 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 45.5 t -82.76 93.37 7.41 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 169.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.1 p -112.62 137.9 21.86 Favored Pre-proline 0 C--N 1.313 -1.013 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.336 -166.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -66.7 119.27 6.28 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.254 1.969 . . . . 0.0 111.91 178.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -116.72 76.91 1.06 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.36 -0.837 . . . . 0.0 108.863 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.56 -111.7 3.46 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.105 -1.045 . . . . 0.0 111.598 -175.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.7 pttm -99.59 -12.0 20.49 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -176.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -120.84 175.16 6.18 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.01 0.434 . . . . 0.0 111.123 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -113.33 137.19 51.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.51 173.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 1.627 ' HE2' ' CE1' ' A' ' 32' ' ' TYR . 82.1 m-85 -133.67 152.32 51.86 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.057 0.456 . . . . 0.0 109.871 179.25 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -83.28 101.66 11.43 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.301 -178.466 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -114.87 160.46 19.47 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.316 -177.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -109.67 88.68 2.8 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.07 0.462 . . . . 0.0 110.266 178.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.399 -0.81 . . . . 0.0 109.293 176.473 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.647 0 N-CA-C 111.765 -0.534 . . . . 0.0 111.765 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.9 t -169.26 151.52 4.64 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.658 ' HE1' ' CE2' ' A' ' 3' ' ' TYR . 45.5 t80 -85.85 73.37 10.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.167 0.508 . . . . 0.0 109.923 -179.431 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.652 ' HA ' ' O ' ' A' ' 19' ' ' TRP . 33.3 m 68.66 132.85 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.779 -1.101 . . . . 0.0 111.55 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 86.6 mt -72.56 137.97 22.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.347 -176.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -55.28 138.48 45.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.231 177.088 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -70.06 121.96 18.47 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.16 -173.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 111.25 -16.19 27.37 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.134 -176.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -78.71 168.71 19.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.903 0.382 . . . . 0.0 110.898 -179.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.73 151.71 39.16 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 176.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.551 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 11.7 t -140.04 139.99 22.79 Favored Pre-proline 0 C--N 1.314 -0.942 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.24 -174.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -71.93 158.79 51.97 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.532 2.155 . . . . 0.0 110.86 176.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -53.22 115.73 8.13 Favored Pre-proline 0 C--N 1.331 -0.225 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.44 -24.95 46.11 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 123.454 2.769 . . . . 0.0 113.621 -172.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 17.4 ptt180 -71.22 -17.83 62.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.837 0.351 . . . . 0.0 110.405 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -98.9 -0.59 41.99 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.575 179.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 135.16 93.93 0.44 Allowed Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.959 -0.638 . . . . 0.0 111.971 -177.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -81.54 124.79 29.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.603 0.239 . . . . 0.0 110.649 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.652 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 20.5 m95 -118.89 12.23 12.81 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-O 120.988 0.423 . . . . 0.0 109.938 174.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.615 ' C ' ' H ' ' A' ' 22' ' ' HIS . 38.8 t -73.65 -6.49 47.05 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -170.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.7 m -15.88 31.85 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 117.566 2.432 . . . . 0.0 117.566 -138.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.615 ' H ' ' C ' ' A' ' 20' ' ' CYS . 72.8 m80 -108.37 -88.07 0.48 Allowed 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 163.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.7 tttm -156.49 119.65 4.19 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 165.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.2 t -86.03 107.95 18.02 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.1 m -120.79 149.65 51.09 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-O 121.001 0.429 . . . . 0.0 111.553 -173.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -70.74 122.88 9.27 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.601 2.201 . . . . 0.0 112.397 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.432 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 6.9 mm-40 -119.26 75.71 1.07 Allowed 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.182 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.76 -111.16 3.28 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.348 -0.93 . . . . 0.0 112.189 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -83.05 -29.93 28.44 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -177.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -126.46 171.65 10.86 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.045 0.45 . . . . 0.0 111.016 -174.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 1.666 ' HD1' ' CD2' ' A' ' 31' ' ' PHE . 87.4 m-85 -98.02 148.87 23.06 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.369 176.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.432 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 11.7 m-85 -133.18 156.28 47.77 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 -179.085 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 4.6 t -88.34 103.38 15.76 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -179.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -116.55 163.39 16.15 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.751 -176.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -104.76 88.31 2.88 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.231 0.538 . . . . 0.0 111.551 -178.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 . . . . . 0 C--O 1.252 1.193 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.558 172.979 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.563 0 N-CA-C 112.055 -0.418 . . . . 0.0 112.055 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.4 t -136.07 60.54 1.67 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.449 0.642 . . . . 0.0 109.98 178.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 1.661 ' HD1' ' CD2' ' A' ' 3' ' ' TYR . 86.9 m-85 72.07 -48.36 0.68 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.896 -175.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.601 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 71.4 m -142.57 -156.87 0.72 Allowed 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 175.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 81.2 mt -58.52 135.01 23.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 CA-C-O 121.209 0.528 . . . . 0.0 111.099 -178.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.417 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 11.4 mp0 -60.43 152.89 24.42 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.89 -177.105 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.484 HD21 ' CG ' ' A' ' 22' ' ' HIS . 1.2 tm? -74.32 117.66 16.38 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.939 -177.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.9 -14.5 29.04 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.806 -0.633 . . . . 0.0 112.013 -176.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.462 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 12.7 mm-40 -78.72 167.32 21.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.041 0.448 . . . . 0.0 110.619 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.462 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -82.21 145.16 30.2 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.372 177.222 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 15.1 p -125.34 147.29 57.14 Favored Pre-proline 0 C--N 1.313 -0.992 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.244 177.249 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . 0.529 ' HG3' ' CZ3' ' A' ' 19' ' ' TRP . 56.0 Cg_endo -68.98 159.42 54.03 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.398 2.065 . . . . 0.0 110.29 174.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -52.54 115.62 7.39 Favored Pre-proline 0 C--N 1.328 -0.353 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -54.67 -22.33 28.36 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.303 2.668 . . . . 0.0 113.79 -171.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -70.13 -20.27 63.18 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.982 179.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -97.57 -1.76 43.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.601 0.239 . . . . 0.0 111.059 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 135.93 118.72 1.82 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.797 -178.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -102.0 107.27 18.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.984 0.421 . . . . 0.0 111.141 -177.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.601 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 1.7 m0 -106.95 21.39 17.63 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 173.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.557 ' C ' ' H ' ' A' ' 22' ' ' HIS . 3.8 t -81.41 -8.54 59.75 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.412 -1.267 . . . . 0.0 111.803 -170.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 20.3 m -21.93 31.13 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 118.591 2.811 . . . . 0.0 118.591 -142.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.557 ' H ' ' C ' ' A' ' 20' ' ' CYS . 77.4 m80 -104.43 -88.29 0.43 Allowed 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 161.624 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -156.32 118.79 4.06 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 163.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.401 ' HB2' ' CB ' ' A' ' 20' ' ' CYS . 48.9 t -83.92 97.56 9.3 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.619 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 18.2 m -109.07 145.6 32.09 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.1 -176.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -71.46 119.8 6.51 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.465 2.11 . . . . 0.0 111.492 176.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -110.79 76.81 1.0 Allowed 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 176.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.12 -111.68 3.43 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.475 -0.869 . . . . 0.0 111.088 -173.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -99.82 -13.62 19.14 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.182 0.515 . . . . 0.0 110.648 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -106.56 176.1 5.28 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.942 -177.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 1.646 ' HD2' ' CD1' ' A' ' 31' ' ' PHE . 87.7 m-85 -126.96 141.66 51.74 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 176.362 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 1.656 ' HD2' ' CD1' ' A' ' 32' ' ' TYR . 77.7 m-85 -137.71 148.4 45.63 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.002 0.43 . . . . 0.0 111.189 -178.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.481 ' O ' HD23 ' A' ' 7' ' ' LEU . 55.6 m -79.37 101.4 8.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.684 174.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -107.89 154.67 21.25 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.215 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -89.87 88.84 7.49 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.512 177.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 . . . . . 0 C--O 1.245 0.855 0 CA-C-O 118.192 -0.909 . . . . 0.0 110.029 -178.331 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.576 0 N-CA-C 112.222 -0.351 . . . . 0.0 112.222 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.1 t -153.83 40.04 0.49 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.846 0.832 . . . . 0.0 109.265 178.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 81.3 t80 72.6 -52.19 0.7 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 114.48 -1.236 . . . . 0.0 110.755 -174.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 19' ' ' TRP . 63.2 m -96.68 144.57 26.58 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 177.483 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.436 HG13 ' HB2' ' A' ' 19' ' ' TRP . 79.8 mt -81.34 133.61 28.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 -178.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.408 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 1.5 pm0 -70.16 157.26 37.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.797 0.808 . . . . 0.0 111.648 -174.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.528 HD21 ' ND1' ' A' ' 22' ' ' HIS . 0.4 OUTLIER -67.06 123.71 20.99 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.913 -172.94 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.68 -9.51 34.88 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.524 179.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.425 ' HB2' HG23 ' A' ' 5' ' ' ILE . 32.2 mm-40 -84.32 170.84 13.23 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.986 0.422 . . . . 0.0 111.12 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.57 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 5.3 mpt_? -89.92 137.9 31.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.55 -179.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.558 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 17.2 p -124.72 149.21 61.67 Favored Pre-proline 0 C--N 1.318 -0.794 0 CA-C-O 120.564 0.221 . . . . 0.0 110.865 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -71.05 151.58 61.85 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.132 1.888 . . . . 0.0 110.127 170.357 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -49.54 124.27 14.97 Favored Pre-proline 0 C--N 1.332 -0.192 0 O-C-N 123.63 0.581 . . . . 0.0 109.638 -179.02 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.471 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 9.2 Cg_endo -51.71 -22.3 13.01 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 123.739 2.959 . . . . 0.0 113.757 -174.469 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -68.55 -20.03 64.52 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.8 0.333 . . . . 0.0 110.551 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -92.24 -7.78 47.2 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.629 175.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 104.64 96.49 2.42 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.264 -178.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -94.22 147.71 22.91 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.818 0.342 . . . . 0.0 110.175 179.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.474 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 20.6 m95 -111.48 21.35 16.28 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 175.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.593 ' C ' ' H ' ' A' ' 22' ' ' HIS . 4.7 m -56.75 -5.81 0.26 Allowed 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 115.592 1.701 . . . . 0.0 115.592 -174.46 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.1 m -17.21 30.33 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 118.181 2.66 . . . . 0.0 118.181 -140.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . 0.593 ' H ' ' C ' ' A' ' 20' ' ' CYS . 24.6 m80 -109.55 -85.37 0.54 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 158.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.6 tttm -156.64 131.14 8.73 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 121.353 -0.139 . . . . 0.0 110.7 167.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.524 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 50.4 t -90.44 105.69 17.98 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 176.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 31.6 m -116.5 147.38 39.55 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.462 -173.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -73.78 119.65 6.0 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.527 2.151 . . . . 0.0 112.415 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -115.19 75.76 0.96 Allowed 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.209 177.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.22 -111.28 3.81 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.235 -178.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.404 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 8.4 ptpp? -71.17 -32.73 69.27 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -175.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.404 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 81.2 mtt180 -127.27 -179.57 4.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.924 0.392 . . . . 0.0 110.998 -172.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 1.589 ' HE1' ' CE2' ' A' ' 31' ' ' PHE . 62.4 m-85 -111.93 147.24 36.28 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 175.117 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.413 ' CZ ' ' HG3' ' A' ' 10' ' ' ARG . 30.5 m-85 -136.42 144.03 44.26 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.799 0.333 . . . . 0.0 110.797 -178.158 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.436 ' SG ' ' HB3' ' A' ' 11' ' ' CYS . 73.0 m -76.5 103.9 6.73 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.521 176.362 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -119.02 163.63 16.68 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.488 -178.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -104.8 88.95 3.03 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.23 0.538 . . . . 0.0 110.507 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.237 -0.887 . . . . 0.0 109.787 178.238 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.476 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 61.7 m . . . . . 0 N--CA 1.453 -0.302 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 71.9 mt -63.11 130.56 27.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.415 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 1.3 pm0 -68.01 154.74 40.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.769 0.795 . . . . 0.0 111.701 -173.199 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.522 HD23 ' ND1' ' A' ' 22' ' ' HIS . 0.4 OUTLIER -66.67 120.48 13.54 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.606 -173.941 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.465 ' HA2' ' NH1' ' A' ' 34' ' ' ARG . . . 116.57 -15.38 14.69 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.772 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.557 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 16.6 mm-40 -84.82 165.92 17.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.195 0.522 . . . . 0.0 111.61 -177.657 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.557 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -82.57 141.88 32.23 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.735 179.361 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.52 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 18.6 p -126.56 153.33 75.3 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.76 178.56 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -70.14 169.11 20.18 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.498 2.132 . . . . 0.0 110.853 172.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.431 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 46.8 t-20 -50.02 119.89 10.9 Favored Pre-proline 0 C--N 1.328 -0.348 0 O-C-N 123.351 0.407 . . . . 0.0 110.797 -178.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.431 ' HD2' ' HA ' ' A' ' 13' ' ' ASN . 11.7 Cg_endo -56.41 -16.08 17.13 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 123.886 3.057 . . . . 0.0 113.938 -175.501 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.412 ' HG2' ' OD1' ' A' ' 13' ' ' ASN . 23.8 mmt180 -63.88 -21.53 66.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.084 0.469 . . . . 0.0 110.39 176.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -81.42 -10.3 59.54 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.653 177.173 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 120.33 135.88 5.04 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 111.514 -0.635 . . . . 0.0 111.514 -177.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -77.64 103.88 7.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.282 0.541 . . . . 0.0 110.327 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.476 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 5.3 m-90 -94.55 8.42 42.29 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-O 121.995 0.902 . . . . 0.0 109.093 172.49 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.522 ' C ' ' H ' ' A' ' 22' ' ' HIS . 56.1 m -84.75 -2.34 57.5 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 113.903 -1.499 . . . . 0.0 112.087 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.8 m -18.56 28.28 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 118.737 2.866 . . . . 0.0 118.737 -138.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.522 ' H ' ' C ' ' A' ' 20' ' ' CYS . 49.7 m80 -94.77 -82.39 0.37 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 153.525 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -155.26 131.34 10.15 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.192 165.371 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.439 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 43.3 t -87.01 100.21 12.45 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 170.011 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 4.9 p -121.93 138.96 29.43 Favored Pre-proline 0 C--N 1.312 -1.041 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.548 -166.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -66.51 120.02 7.1 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.385 2.056 . . . . 0.0 112.394 177.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -119.87 84.36 2.2 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.284 -0.871 . . . . 0.0 108.809 177.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 85.02 -110.93 3.45 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.207 -0.997 . . . . 0.0 111.927 -174.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.407 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 0.9 OUTLIER -106.63 -7.94 17.16 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.374 -0.486 . . . . 0.0 111.969 -177.352 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.407 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 93.1 mtt180 -119.27 172.5 7.56 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.011 0.434 . . . . 0.0 110.6 -178.365 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.408 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 91.1 m-85 -109.59 140.53 43.29 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.476 -0.784 . . . . 0.0 108.962 173.179 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -136.37 149.54 48.38 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.818 0.342 . . . . 0.0 110.621 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 65.9 m -78.52 96.49 5.44 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 173.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.465 ' NH1' ' HA2' ' A' ' 8' ' ' GLY . 40.4 mmt180 -119.03 165.3 14.29 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.132 -175.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -103.09 86.96 2.79 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 170.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 . . . . . 0 C--O 1.246 0.885 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.766 -170.798 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.52 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 20.1 p . . . . . 0 N--CA 1.469 0.476 0 N-CA-C 110.916 -0.031 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.409 ' HB ' ' SG ' ' A' ' 33' ' ' CYS . 79.6 mt -77.09 133.48 30.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 178.183 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.483 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 2.4 pm0 -66.0 149.46 50.21 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 121.841 0.829 . . . . 0.0 110.61 -178.341 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.478 HD23 ' CG ' ' A' ' 22' ' ' HIS . 0.8 OUTLIER -68.78 121.35 16.34 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.726 -1.124 . . . . 0.0 110.682 -171.468 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.427 ' HA2' ' NH1' ' A' ' 34' ' ' ARG . . . 118.61 -21.33 9.83 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.834 -179.212 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.483 ' CG ' ' HG2' ' A' ' 6' ' ' GLU . 14.1 mm-40 -83.09 170.9 14.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.091 0.472 . . . . 0.0 111.64 -175.39 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.447 ' N ' ' HD3' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -81.94 143.48 31.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.205 179.316 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.446 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 14.2 p -122.76 149.58 56.48 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.347 177.136 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.36 159.88 51.44 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.308 2.005 . . . . 0.0 110.347 172.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 50.5 t-20 -50.61 117.2 7.9 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.46 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 11.6 Cg_endo -55.61 -27.69 61.67 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 123.372 2.715 . . . . 0.0 114.023 -171.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.74 -12.78 60.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.209 0.528 . . . . 0.0 110.494 178.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -105.49 13.82 29.55 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.152 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.17 107.3 2.05 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.248 -179.038 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -96.72 116.99 30.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.779 0.323 . . . . 0.0 110.859 -178.634 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.52 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 35.6 m95 -116.92 20.95 13.62 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 176.346 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.577 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -80.02 -6.93 58.47 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -171.348 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.7 p -18.06 30.94 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 118.088 2.625 . . . . 0.0 118.088 -141.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.577 ' H ' ' C ' ' A' ' 20' ' ' CYS . 76.9 m80 -113.07 -83.98 0.59 Allowed 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 162.496 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -154.04 125.24 7.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.03 167.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.504 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 45.4 t -88.02 88.58 7.69 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 172.402 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 5.8 p -107.98 135.4 19.86 Favored Pre-proline 0 N--CA 1.44 -0.971 0 CA-C-N 115.074 -0.967 . . . . 0.0 109.895 -168.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -67.24 119.13 6.13 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.237 1.958 . . . . 0.0 112.209 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -105.27 76.74 1.25 Allowed 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.92 -110.33 3.3 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.099 -1.048 . . . . 0.0 110.647 -169.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -94.95 -34.37 12.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.939 0.399 . . . . 0.0 111.06 179.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -92.56 171.1 9.24 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.977 0.417 . . . . 0.0 111.087 -172.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.504 ' HB3' ' SG ' ' A' ' 24' ' ' CYS . 94.0 m-85 -114.64 140.67 48.63 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.115 177.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -137.68 147.81 45.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.201 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.409 ' SG ' ' HB ' ' A' ' 5' ' ' ILE . 95.2 m -78.2 101.29 7.01 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 175.558 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.427 ' NH1' ' HA2' ' A' ' 8' ' ' GLY . 25.9 mmt180 -113.56 160.55 18.41 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.339 179.667 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -103.13 88.1 3.06 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 . . . . . 0 C--O 1.246 0.879 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.273 -173.775 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 82.3 m . . . . . 0 N--CA 1.45 -0.429 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.448 HG13 ' HB2' ' A' ' 19' ' ' TRP . 91.4 mt -67.29 130.15 32.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.937 -177.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.517 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.5 pm0 -66.19 149.97 49.5 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.234 -0.893 . . . . 0.0 111.423 -176.055 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.4 OUTLIER -65.18 121.23 14.28 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.549 -1.205 . . . . 0.0 111.039 -172.758 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 113.73 -11.72 23.08 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.003 -0.617 . . . . 0.0 112.551 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -87.14 168.33 13.35 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.364 0.602 . . . . 0.0 111.939 -179.188 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.488 ' HD2' ' O ' ' A' ' 31' ' ' PHE . 9.0 mmm180 -81.07 139.51 35.65 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.377 177.069 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.545 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 17.9 p -121.48 142.28 35.21 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.942 178.355 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -62.04 144.49 96.21 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 122.13 1.886 . . . . 0.0 110.117 169.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.588 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 3.2 m-20 -49.37 123.8 13.87 Favored Pre-proline 0 C--N 1.328 -0.338 0 O-C-N 123.787 0.679 . . . . 0.0 110.622 -178.07 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.588 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 9.2 Cg_endo -52.51 -21.6 14.54 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 123.543 2.829 . . . . 0.0 113.53 -174.119 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.544 ' HD3' ' N ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -59.56 -22.06 61.19 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 175.903 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 10.2 pt-20 -118.36 19.34 13.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.921 0.391 . . . . 0.0 111.14 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 96.96 110.32 2.72 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.992 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -113.65 133.7 55.16 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 176.104 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.448 ' HB2' HG13 ' A' ' 5' ' ' ILE . 1.1 m95 -101.13 22.45 12.31 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.59 ' C ' ' H ' ' A' ' 22' ' ' HIS . 1.6 m -57.57 -6.25 0.46 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 -175.319 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 16.2 m -17.34 31.54 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 117.753 2.501 . . . . 0.0 117.753 -140.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.59 ' H ' ' C ' ' A' ' 20' ' ' CYS . 71.0 m80 -112.35 -84.4 0.58 Allowed 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 160.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -154.15 127.03 8.23 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.396 169.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.588 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 42.9 t -88.23 89.92 8.18 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 172.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.7 p -109.29 138.99 20.63 Favored Pre-proline 0 N--CA 1.439 -0.98 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.96 -169.084 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -65.89 119.07 6.04 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.137 1.892 . . . . 0.0 111.857 178.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.449 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 7.3 mm-40 -113.26 77.28 1.04 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.023 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.92 -110.42 3.31 Favored Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 119.972 -1.108 . . . . 0.0 111.566 -176.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.482 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 10.3 ptpp? -99.5 -5.67 28.88 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -175.446 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.482 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 96.2 mtt180 -136.38 178.3 7.17 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.617 0.246 . . . . 0.0 110.553 -177.252 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.488 ' O ' ' HD2' ' A' ' 10' ' ' ARG . 69.4 m-85 -112.46 142.99 44.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.694 178.33 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.449 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 55.4 m-85 -138.5 151.41 47.35 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.096 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 70.8 m -78.67 103.71 8.79 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 174.166 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -117.02 161.33 19.57 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.217 -178.001 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -100.68 88.18 3.54 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.31 0.576 . . . . 0.0 109.639 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.536 -0.745 . . . . 0.0 109.77 179.486 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 14.2 p . . . . . 0 N--CA 1.451 -0.404 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 77.1 mt -79.95 134.03 28.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -78.69 160.76 27.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.514 0.673 . . . . 0.0 111.339 -177.249 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.482 HD23 ' ND1' ' A' ' 22' ' ' HIS . 0.5 OUTLIER -63.66 127.22 30.38 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.793 -174.457 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.71 -9.48 44.36 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 115.715 -0.675 . . . . 0.0 113.077 177.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -91.6 175.34 6.94 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.013 0.435 . . . . 0.0 111.447 -177.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.5 mmt85 -80.18 150.52 30.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.44 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.516 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 26.4 p -136.58 148.66 64.62 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.865 175.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.29 149.37 45.29 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.238 1.959 . . . . 0.0 110.581 171.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.406 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 51.2 t-20 -48.98 120.39 9.42 Favored Pre-proline 0 C--N 1.33 -0.244 0 O-C-N 123.809 0.693 . . . . 0.0 110.637 -178.296 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.575 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 14.3 Cg_endo -56.08 -16.52 16.97 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.617 2.878 . . . . 0.0 113.435 -175.384 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -61.61 -31.7 71.78 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.729 0.299 . . . . 0.0 110.738 176.095 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -100.24 12.9 35.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.853 0.359 . . . . 0.0 110.63 178.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 88.56 108.9 1.08 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.301 -177.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.596 ' OD1' ' HB2' ' A' ' 20' ' ' CYS . 3.0 p30 -102.14 148.78 24.99 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.047 0.451 . . . . 0.0 110.427 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.506 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 26.8 m95 -106.5 31.0 5.53 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.431 0.634 . . . . 0.0 109.318 176.128 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.596 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 0.0 OUTLIER -68.1 -6.55 23.52 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 -174.896 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.0 p -20.35 29.22 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 118.584 2.809 . . . . 0.0 118.584 -138.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.529 ' H ' ' C ' ' A' ' 20' ' ' CYS . 3.4 m80 -106.0 -83.63 0.52 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 157.026 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.522 ' HA ' ' HE3' ' A' ' 23' ' ' LYS . 1.6 tpmt? -154.83 123.79 6.24 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.973 171.597 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.575 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 47.8 t -87.29 93.88 9.51 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 173.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.8 p -110.74 133.56 21.17 Favored Pre-proline 0 N--CA 1.439 -1.024 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.348 -171.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -67.36 121.66 8.81 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.496 2.131 . . . . 0.0 112.412 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -111.59 78.87 1.15 Allowed 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 173.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.5 -116.45 4.23 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -175.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -94.25 -8.09 40.15 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.5 0.667 . . . . 0.0 110.092 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 68.3 mtm180 -110.05 171.51 7.41 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.859 -174.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.465 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 94.0 m-85 -129.01 139.1 52.22 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.529 175.322 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -139.39 152.39 47.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.901 0.382 . . . . 0.0 110.656 -179.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 88.8 m -80.3 103.08 9.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.757 174.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -119.29 161.61 20.14 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.474 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -95.58 88.85 5.17 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.41 0.624 . . . . 0.0 109.824 178.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 . . . . . 0 C--O 1.247 0.969 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.541 -179.408 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 84.6 m . . . . . 0 N--CA 1.452 -0.367 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 83.7 mt -80.35 122.32 35.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 174.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.458 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.6 pm0 -61.88 145.31 53.14 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.772 0.796 . . . . 0.0 111.271 -174.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.447 ' HA ' HD22 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -65.64 124.84 23.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.55 -1.205 . . . . 0.0 110.829 -171.692 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 115.26 -21.21 13.32 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.771 -177.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.413 ' CG ' ' HG2' ' A' ' 6' ' ' GLU . 76.0 mm-40 -79.48 173.8 12.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.194 0.521 . . . . 0.0 111.789 -177.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.573 ' H ' ' HD3' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -80.67 155.78 26.64 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.82 172.964 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 12.1 p -136.45 146.07 54.29 Favored Pre-proline 0 C--N 1.319 -0.736 0 C-N-CA 121.156 -0.217 . . . . 0.0 110.545 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -65.8 161.29 39.83 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.404 2.069 . . . . 0.0 110.85 172.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.411 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 4.2 m-20 -49.92 118.61 8.99 Favored Pre-proline 0 C--N 1.33 -0.278 0 O-C-N 123.584 0.552 . . . . 0.0 110.919 -179.379 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.473 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 11.6 Cg_endo -57.46 -23.87 58.15 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.897 2.398 . . . . 0.0 112.568 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -68.18 -24.53 64.97 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.305 175.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -98.76 0.29 44.15 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.886 0.374 . . . . 0.0 110.513 -177.207 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.16 95.62 2.4 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.38 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.479 ' OD2' ' HB2' ' A' ' 20' ' ' CYS . 4.2 p-10 -99.86 148.68 24.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.079 0.466 . . . . 0.0 110.521 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -107.4 31.17 5.61 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.529 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -71.83 -8.78 56.38 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -171.092 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 24.6 p -19.86 29.38 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 118.576 2.806 . . . . 0.0 118.576 -140.211 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.529 ' H ' ' C ' ' A' ' 20' ' ' CYS . 17.3 m80 -103.02 -88.91 0.39 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 157.546 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.407 ' CE ' ' HB2' ' A' ' 36' ' ' GLN . 21.9 ttmm -155.83 124.62 6.02 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 120.756 0.312 . . . . 0.0 110.488 169.232 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.473 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 53.5 t -90.72 104.29 16.9 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 176.162 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.1 m -111.63 150.32 42.04 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.6 -173.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -76.52 118.96 5.04 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 122.629 2.219 . . . . 0.0 111.997 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -113.78 75.76 0.94 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.011 178.016 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.1 -111.73 3.32 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.488 -0.863 . . . . 0.0 111.948 -178.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.404 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 18.6 ptpt -85.62 -23.66 27.44 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -176.607 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.404 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 65.0 mtt180 -127.72 168.86 14.51 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.916 0.389 . . . . 0.0 111.139 -174.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 93.4 m-85 -105.71 144.15 32.85 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.93 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -135.48 149.92 49.66 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.148 0.499 . . . . 0.0 110.749 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.84 105.43 15.61 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.46 -176.294 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.417 ' C ' HD21 ' A' ' 7' ' ' LEU . 37.7 mmt180 -122.04 163.29 19.65 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.767 -175.179 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -110.39 89.6 3.08 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.312 0.577 . . . . 0.0 111.041 -177.792 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.407 ' HB2' ' CE ' ' A' ' 23' ' ' LYS . 2.0 mp0 . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.372 -0.823 . . . . 0.0 109.58 175.813 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 15.1 p . . . . . 0 CA--C 1.538 0.488 0 CA-C-O 120.535 0.207 . . . . 0.0 111.294 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 95.9 mt -75.51 137.65 22.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 122.067 -0.396 . . . . 0.0 110.844 -175.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.422 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 23.1 mm-40 -65.07 147.43 53.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.712 0.768 . . . . 0.0 111.78 -176.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.457 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.6 OUTLIER -71.43 119.71 15.97 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.801 -1.091 . . . . 0.0 109.72 -177.451 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.54 -16.64 28.89 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.718 -0.673 . . . . 0.0 112.309 -174.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.501 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 10.4 mm-40 -80.83 168.76 18.41 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.045 0.45 . . . . 0.0 111.341 -178.122 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.501 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -83.86 137.02 33.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.594 177.409 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.6 p -126.61 156.28 73.52 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 116.853 -0.158 . . . . 0.0 111.376 -175.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -72.73 156.21 53.41 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.706 2.271 . . . . 0.0 111.363 173.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.492 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 52.1 t-20 -50.83 118.2 9.68 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.003 -177.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.415 ' HA ' ' HB3' ' A' ' 18' ' ' ASP . 19.1 Cg_endo -59.47 -17.25 39.92 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.129 2.553 . . . . 0.0 113.147 -177.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -66.16 -25.34 66.91 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.698 0.285 . . . . 0.0 110.84 177.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 12.2 pt-20 -105.43 18.77 21.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.048 0.451 . . . . 0.0 110.441 177.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 91.13 104.0 1.32 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.091 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.415 ' HB3' ' HA ' ' A' ' 14' ' ' PRO . 19.0 p-10 -94.05 124.28 37.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.079 0.466 . . . . 0.0 110.813 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.473 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 12.6 m95 -84.06 38.8 0.67 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.91 0.862 . . . . 0.0 108.818 177.265 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.567 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -85.14 -5.84 59.32 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.242 -1.345 . . . . 0.0 113.124 -170.339 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.2 p -16.4 30.0 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 118.265 2.691 . . . . 0.0 118.265 -140.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.567 ' H ' ' C ' ' A' ' 20' ' ' CYS . 31.3 m80 -107.07 -94.42 0.38 Allowed 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 153.809 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -156.37 118.92 4.06 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 120.89 0.376 . . . . 0.0 111.295 168.689 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.551 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 42.8 t -80.0 124.04 28.35 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 173.465 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.1 m -130.36 159.19 71.81 Favored Pre-proline 0 C--N 1.317 -0.815 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.226 -176.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -80.7 120.08 3.82 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.812 2.341 . . . . 0.0 112.303 -177.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.495 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 10.8 mm-40 -113.03 75.5 0.92 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.246 -0.888 . . . . 0.0 108.99 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.8 -111.04 3.61 Favored Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 120.239 -0.981 . . . . 0.0 111.929 -176.198 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.6 pttm -79.72 -29.65 40.72 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -175.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -125.54 175.7 7.36 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.956 0.408 . . . . 0.0 111.356 -174.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.551 ' HB3' ' SG ' ' A' ' 24' ' ' CYS . 97.2 m-85 -110.79 141.27 44.34 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.379 -179.207 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.495 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 27.8 m-85 -131.31 149.4 52.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.441 -178.733 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -84.1 110.25 18.34 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.794 -177.013 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.5 mmt180 -120.75 160.77 22.67 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.717 -176.426 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -98.14 88.15 4.13 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.677 0.751 . . . . 0.0 110.595 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 . . . . . 0 C--O 1.246 0.878 0 CA-C-O 118.495 -0.764 . . . . 0.0 110.376 178.34 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 82.1 mt -73.46 134.4 29.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.159 0.504 . . . . 0.0 111.31 -173.021 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.466 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 3.8 mp0 -59.45 151.24 24.43 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.028 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.524 HD23 ' CG ' ' A' ' 22' ' ' HIS . 1.4 tm? -75.2 121.49 22.21 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.444 -178.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 107.72 -5.51 34.94 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.161 -176.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.466 ' HG3' ' HB2' ' A' ' 6' ' ' GLU . 8.7 mm-40 -91.19 170.95 9.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.707 0.289 . . . . 0.0 110.237 178.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.13 150.52 25.48 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 25.4 p -129.64 145.81 58.54 Favored Pre-proline 0 C--N 1.318 -0.781 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.308 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -68.04 154.07 73.49 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.039 1.826 . . . . 0.0 110.325 173.658 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -49.17 121.76 11.24 Favored Pre-proline 0 C--N 1.33 -0.257 0 O-C-N 123.748 0.655 . . . . 0.0 109.92 -177.117 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.465 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 10.3 Cg_endo -51.84 -26.48 24.34 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.73 2.953 . . . . 0.0 114.14 -172.479 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -77.38 -12.41 59.95 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.727 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -101.54 13.64 34.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.885 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.75 80.7 1.14 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.621 178.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -88.65 147.2 24.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.002 0.43 . . . . 0.0 110.586 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.7 m0 -106.25 29.79 6.49 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 174.661 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.535 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.5 OUTLIER -63.97 -8.01 10.17 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 -171.241 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 11.5 p -20.8 30.17 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 118.462 2.764 . . . . 0.0 118.462 -141.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.535 ' H ' ' C ' ' A' ' 20' ' ' CYS . 78.3 m80 -111.07 -83.48 0.57 Allowed 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 164.135 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.418 ' HG2' ' HB ' ' A' ' 25' ' ' VAL . 24.9 ttmm -154.92 118.84 4.61 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.974 168.215 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.465 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 20.1 t -82.55 89.64 6.7 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 173.285 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.418 ' HB ' ' HG2' ' A' ' 23' ' ' LYS . 7.1 p -109.48 135.81 20.29 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.093 -170.399 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -64.15 119.53 6.6 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.06 1.84 . . . . 0.0 111.918 178.123 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -111.69 75.79 0.94 Allowed 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 178.583 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 82.93 -109.92 3.17 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 119.542 -1.313 . . . . 0.0 111.369 -173.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.467 ' NZ ' ' HB2' ' A' ' 29' ' ' LYS . 4.6 ttmp? -91.77 -35.51 14.08 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.843 0.354 . . . . 0.0 111.569 -177.663 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -103.62 178.26 4.61 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.074 0.464 . . . . 0.0 111.199 -173.25 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -116.34 140.08 49.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.745 176.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -139.44 150.53 45.34 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.765 0.317 . . . . 0.0 110.541 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 67.4 m -77.58 103.25 7.41 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.047 176.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -116.5 157.94 24.41 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.231 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -104.95 88.76 2.96 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 177.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.705 -0.664 . . . . 0.0 109.881 -179.968 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 77.6 m . . . . . 0 N--CA 1.447 -0.617 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 83.2 mt -68.99 136.69 25.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 176.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -62.12 148.27 44.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.663 0.744 . . . . 0.0 110.995 -178.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.516 HD23 ' CG ' ' A' ' 22' ' ' HIS . 1.0 OUTLIER -74.28 117.62 16.31 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.937 -1.028 . . . . 0.0 110.008 -175.041 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 114.24 -13.77 21.25 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.131 -175.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -82.3 170.71 15.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.008 0.432 . . . . 0.0 110.799 -179.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.436 ' N ' ' HD3' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -87.23 141.31 28.75 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.588 178.118 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 26.1 p -127.42 148.46 66.51 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.85 161.72 44.14 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.282 1.988 . . . . 0.0 111.021 175.155 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -50.05 118.35 8.83 Favored Pre-proline 0 C--N 1.329 -0.311 0 O-C-N 123.462 0.476 . . . . 0.0 109.886 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -54.03 -19.29 15.41 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 123.433 2.756 . . . . 0.0 113.501 -174.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.4 mmm180 -68.16 -18.46 64.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.897 177.001 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -92.85 -4.7 52.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.507 178.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 125.56 98.04 1.13 Allowed Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.589 -175.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -78.24 114.07 16.79 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.819 0.342 . . . . 0.0 110.859 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 3.5 m0 -110.44 13.68 22.72 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.265 176.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.613 ' C ' ' H ' ' A' ' 22' ' ' HIS . 51.2 t -74.03 -9.21 58.4 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -176.503 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.7 p -17.69 31.62 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 117.643 2.46 . . . . 0.0 117.643 -138.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.613 ' H ' ' C ' ' A' ' 20' ' ' CYS . 73.3 m80 -99.38 -87.37 0.36 Allowed 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 159.153 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -155.1 117.84 4.31 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.297 164.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 45.4 t -80.37 91.03 5.63 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 172.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.4 p -110.15 138.99 20.98 Favored Pre-proline 0 C--N 1.313 -0.99 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.244 -167.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -59.73 119.7 7.07 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.212 1.941 . . . . 0.0 111.536 177.113 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -120.81 77.61 1.31 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.38 -0.827 . . . . 0.0 108.945 -177.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.26 -111.09 3.42 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.307 -0.949 . . . . 0.0 111.528 -174.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -94.64 -24.6 17.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.872 0.368 . . . . 0.0 111.331 -177.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -119.47 176.29 5.42 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.482 -174.043 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.469 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 97.3 m-85 -103.14 140.72 36.96 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.897 176.067 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -132.05 150.41 52.16 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.284 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.412 ' O ' HD22 ' A' ' 7' ' ' LEU . 6.2 t -84.14 97.31 9.28 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.114 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -114.43 160.51 19.08 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.382 -174.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -103.9 90.07 3.5 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.005 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 . . . . . 0 C--O 1.246 0.911 0 CA-C-O 118.421 -0.8 . . . . 0.0 109.691 178.451 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.544 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 47.8 m . . . . . 0 N--CA 1.45 -0.441 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.443 ' HB ' ' SG ' ' A' ' 33' ' ' CYS . 77.7 mt -59.43 130.95 23.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.031 0.443 . . . . 0.0 109.928 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.488 ' H ' ' CD ' ' A' ' 6' ' ' GLU . 1.8 pm0 -69.46 150.95 46.66 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.93 0.871 . . . . 0.0 111.358 -177.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.42 HD23 ' ND1' ' A' ' 22' ' ' HIS . 0.5 OUTLIER -68.46 115.62 8.09 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.338 -1.301 . . . . 0.0 110.58 -171.44 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 116.91 -13.45 14.45 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.358 -176.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -84.17 170.78 13.43 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.247 0.546 . . . . 0.0 111.694 179.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.481 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 9.5 mpt_? -79.92 155.33 27.78 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.303 -177.267 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.461 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 30.2 t -135.13 140.22 34.12 Favored Pre-proline 0 C--N 1.316 -0.852 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.555 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.34 162.74 41.41 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.769 2.313 . . . . 0.0 110.551 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.1 t-20 -53.79 112.79 4.11 Favored Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.67 -15.73 21.93 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.442 2.762 . . . . 0.0 113.943 -171.349 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.9 ptm180 -63.99 -25.46 68.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.011 0.434 . . . . 0.0 110.414 175.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -88.05 -2.97 58.93 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.47 178.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 131.14 156.22 8.44 Favored Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 -177.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -123.35 109.94 14.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.358 0.579 . . . . 0.0 111.102 -178.262 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.544 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 45.3 t-105 -107.16 21.9 16.82 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.092 0.948 . . . . 0.0 108.563 173.336 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.511 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -83.73 -5.27 59.15 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.571 -1.195 . . . . 0.0 112.161 -175.187 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 22.4 m -20.84 30.62 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 118.672 2.841 . . . . 0.0 118.672 -142.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.511 ' H ' ' C ' ' A' ' 20' ' ' CYS . 57.1 m80 -107.65 -83.48 0.54 Allowed 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 159.134 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.4 tttm -154.28 122.33 5.99 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.805 167.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 47.2 t -80.95 91.9 6.09 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 175.016 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 5.7 p -114.2 137.56 22.55 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.028 -169.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -66.64 120.07 7.15 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.508 2.139 . . . . 0.0 112.523 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -111.02 76.88 1.0 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.07 -0.968 . . . . 0.0 108.774 178.129 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.77 -111.08 3.45 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.263 -0.97 . . . . 0.0 111.833 -172.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.4 ptpp? -97.32 -23.81 15.95 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 117.055 0.428 . . . . 0.0 111.98 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -111.49 168.71 9.33 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.009 0.433 . . . . 0.0 110.978 -176.023 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.461 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 98.4 m-85 -104.05 143.94 32.23 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.711 176.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 59.6 m-85 -139.55 154.36 47.63 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.443 ' SG ' ' HB ' ' A' ' 5' ' ' ILE . 95.5 m -82.58 105.13 13.37 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.779 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -116.18 157.93 24.06 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.882 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -94.63 87.73 5.18 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 122.022 0.915 . . . . 0.0 110.017 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 . . . . . 0 C--O 1.249 1.033 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.923 -178.974 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 13.6 p . . . . . 0 N--CA 1.451 -0.399 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.422 ' CG2' ' HB2' ' A' ' 9' ' ' GLU . 77.9 mt -73.09 130.94 35.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.903 0.382 . . . . 0.0 110.114 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.456 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 3.4 pm0 -72.17 159.92 33.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.672 0.748 . . . . 0.0 111.176 -176.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.461 HD23 ' CG ' ' A' ' 22' ' ' HIS . 0.4 OUTLIER -70.3 120.6 16.21 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.017 -171.589 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 112.46 -9.42 26.33 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.616 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.475 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 16.0 mm-40 -89.98 167.23 12.96 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.022 0.439 . . . . 0.0 111.226 -179.201 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.475 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -78.2 142.4 37.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.966 -179.628 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.461 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 24.2 p -128.12 148.77 68.93 Favored Pre-proline 0 C--N 1.318 -0.799 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.44 177.283 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -72.12 150.74 54.46 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.335 2.023 . . . . 0.0 110.621 172.189 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.422 ' OD1' ' HG2' ' A' ' 15' ' ' ARG . 45.2 t-20 -49.67 122.77 13.78 Favored Pre-proline 0 C--N 1.333 -0.119 0 O-C-N 123.659 0.6 . . . . 0.0 110.238 -177.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.467 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 10.1 Cg_endo -51.28 -28.31 26.11 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 124.007 3.138 . . . . 0.0 114.065 -173.631 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.422 ' HG2' ' OD1' ' A' ' 13' ' ' ASN . 14.4 ptm180 -69.85 -18.49 63.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.907 0.384 . . . . 0.0 110.845 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -93.62 -8.54 40.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.374 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.31 86.31 1.91 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.158 -177.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.467 ' OD2' ' HB2' ' A' ' 20' ' ' CYS . 8.5 p-10 -90.09 146.85 24.01 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.976 0.417 . . . . 0.0 111.043 -178.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.491 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 36.7 m95 -107.44 35.67 2.99 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 176.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.592 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -70.97 -6.77 41.3 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 114.668 1.358 . . . . 0.0 114.668 -171.194 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.9 p -17.9 30.1 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 117.952 2.575 . . . . 0.0 117.952 -139.27 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.592 ' H ' ' C ' ' A' ' 20' ' ' CYS . 77.6 m80 -109.36 -91.65 0.45 Allowed 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 159.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.9 tttm -154.2 129.11 9.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 167.255 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.467 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 42.4 t -89.08 103.13 15.77 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 178.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 28.5 m -115.44 147.68 39.25 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.004 -175.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -75.15 119.41 5.59 Favored 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.44 2.093 . . . . 0.0 111.935 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -110.74 74.96 0.9 Allowed 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 178.336 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.14 -110.49 3.05 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.036 -1.078 . . . . 0.0 112.177 -177.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -87.98 -16.0 34.94 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -175.17 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -125.31 179.37 5.12 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.086 0.47 . . . . 0.0 111.352 -176.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.461 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 90.8 m-85 -117.58 143.76 45.8 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.169 171.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -138.81 148.82 44.23 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.962 0.41 . . . . 0.0 110.666 -179.127 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 98.4 m -75.86 103.71 6.06 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.598 174.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -113.07 159.22 19.41 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.486 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -94.37 88.74 5.63 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 176.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 . . . . . 0 C--N 1.315 -0.893 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.428 -177.92 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.604 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 62.7 m . . . . . 0 N--CA 1.45 -0.428 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.449 ' HB ' ' HA ' ' A' ' 20' ' ' CYS . 88.3 mt -71.29 136.14 26.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.01 0.433 . . . . 0.0 110.156 177.509 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -62.53 151.4 37.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.203 -178.204 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.502 HD23 ' CG ' ' A' ' 22' ' ' HIS . 0.9 OUTLIER -76.61 121.96 23.95 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.656 -177.632 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.33 -6.78 42.68 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.908 -175.36 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -83.77 173.99 10.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.001 0.429 . . . . 0.0 110.875 177.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.52 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 7.3 mpt_? -96.58 142.88 28.11 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.441 177.554 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.3 p -124.61 152.04 68.36 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-O 120.635 0.255 . . . . 0.0 110.989 -177.475 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.7 151.77 69.46 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.369 2.046 . . . . 0.0 110.755 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.584 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 46.9 t-20 -50.18 116.23 6.3 Favored Pre-proline 0 C--N 1.33 -0.282 0 O-C-N 123.704 0.627 . . . . 0.0 110.33 -178.689 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.557 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 9.9 Cg_endo -52.97 -22.48 18.57 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.505 2.804 . . . . 0.0 114.033 -171.898 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.482 ' HG3' ' OD1' ' A' ' 13' ' ' ASN . 0.0 OUTLIER -66.77 -14.65 62.86 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 178.864 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.584 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 11.4 pt-20 -107.57 10.3 29.23 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.765 0.317 . . . . 0.0 110.93 177.653 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 98.0 103.56 2.3 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.448 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -101.94 147.5 26.47 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.276 0.56 . . . . 0.0 110.501 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.604 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 1.2 m-90 -108.33 31.12 5.81 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 174.566 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.581 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -74.96 -9.51 58.6 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -169.386 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.9 m -18.75 30.86 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 118.013 2.597 . . . . 0.0 118.013 -141.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.581 ' H ' ' C ' ' A' ' 20' ' ' CYS . 70.5 m80 -104.78 -88.84 0.42 Allowed 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 162.077 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -155.07 120.7 5.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 166.001 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.557 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 46.3 t -83.57 94.25 8.03 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 174.218 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.0 p -115.84 137.18 23.11 Favored Pre-proline 0 N--CA 1.439 -1.003 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.256 -168.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.08 127.4 23.08 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.721 2.281 . . . . 0.0 112.863 -178.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.52 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 7.1 mm-40 -124.58 91.34 3.42 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.779 176.361 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.8 -111.82 3.49 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.371 -0.919 . . . . 0.0 111.595 -177.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.67 3.52 24.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.85 0.357 . . . . 0.0 110.982 -179.528 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 50.7 mtt180 -126.16 -179.22 4.62 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.166 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -120.73 139.94 52.35 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.786 176.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.52 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 17.7 m-85 -131.9 154.51 49.15 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.372 0.606 . . . . 0.0 110.851 -177.05 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.82 99.67 12.63 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.172 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -110.32 161.31 15.75 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.777 -177.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -102.38 88.34 3.25 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.281 0.562 . . . . 0.0 109.672 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.44 ' HA ' ' OE1' ' A' ' 36' ' ' GLN . 14.6 mm-40 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.442 -0.789 . . . . 0.0 109.844 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 71.9 m . . . . . 0 N--CA 1.452 -0.341 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 75.5 mt -64.51 123.51 17.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.447 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.4 pm0 -68.09 156.15 38.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.966 0.889 . . . . 0.0 111.975 -172.653 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.47 123.94 20.06 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.134 -1.394 . . . . 0.0 110.952 -174.141 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.65 -14.66 29.65 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.484 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -85.29 168.72 14.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.11 0.481 . . . . 0.0 111.197 -179.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.81 138.22 31.67 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.715 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.46 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 22.4 p -120.03 146.91 43.3 Favored Pre-proline 0 C--N 1.318 -0.788 0 C-N-CA 121.014 -0.275 . . . . 0.0 110.977 -179.018 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -63.68 150.37 88.61 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.287 1.991 . . . . 0.0 109.941 168.288 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.611 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 45.8 t-20 -49.4 122.6 12.75 Favored Pre-proline 0 C--N 1.329 -0.306 0 O-C-N 123.592 0.558 . . . . 0.0 110.098 -179.369 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.645 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 12.0 Cg_endo -55.02 -17.58 14.77 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 123.3 2.667 . . . . 0.0 113.48 -173.533 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -70.44 -22.0 62.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.97 177.557 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 12.7 pt-20 -106.75 13.48 27.92 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.045 0.45 . . . . 0.0 110.411 178.615 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 129.15 126.25 2.83 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.297 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -111.52 107.36 16.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.879 0.371 . . . . 0.0 110.27 -178.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.7 m95 -111.02 11.34 22.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.181 0.515 . . . . 0.0 110.075 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.559 ' C ' ' H ' ' A' ' 22' ' ' HIS . 1.0 OUTLIER -71.49 -4.95 29.52 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -172.636 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 10.7 m -18.24 29.79 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 118.387 2.736 . . . . 0.0 118.387 -139.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.559 ' H ' ' C ' ' A' ' 20' ' ' CYS . 37.0 m80 -106.44 -83.61 0.52 Allowed 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 158.017 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -154.89 123.98 6.29 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.293 167.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.645 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 49.1 t -86.38 91.65 8.58 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 173.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.6 p -114.85 139.74 24.57 Favored Pre-proline 0 C--N 1.313 -1.005 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.926 -169.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -57.62 126.07 20.7 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 122.659 2.239 . . . . 0.0 112.508 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -122.99 76.44 1.37 Allowed 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.08 -111.71 3.49 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.584 -0.817 . . . . 0.0 111.337 -173.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.6 tttp -92.23 -36.27 13.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.216 0.532 . . . . 0.0 110.779 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 87.6 mtt180 -100.89 178.86 4.56 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.328 -174.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 90.2 m-85 -113.39 143.83 43.8 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.754 178.284 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -135.48 148.13 49.11 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.465 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 88.1 m -78.51 101.87 7.58 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 174.652 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -112.96 160.59 17.93 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.743 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -100.9 88.04 3.45 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 176.338 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.37 -0.824 . . . . 0.0 109.546 -178.472 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.448 -0.531 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 93.5 mt -52.98 131.95 15.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 121.287 0.565 . . . . 0.0 111.973 -171.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.2 mp0 -61.29 157.22 16.91 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.324 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.581 HD23 ' CG ' ' A' ' 22' ' ' HIS . 1.1 tm? -79.88 126.59 31.19 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.069 -175.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.95 -7.93 53.42 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.96 -176.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -86.64 174.04 9.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.169 0.509 . . . . 0.0 111.25 -178.469 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -85.77 143.47 28.29 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.452 176.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 27.0 p -133.63 152.7 79.45 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.698 -179.621 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -77.98 154.07 29.32 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.66 2.24 . . . . 0.0 111.3 173.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -50.31 117.47 7.96 Favored Pre-proline 0 C--O 1.234 0.274 0 O-C-N 123.487 0.492 . . . . 0.0 110.118 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.435 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 18.3 Cg_endo -58.51 -13.68 18.04 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 123.347 2.698 . . . . 0.0 113.491 -172.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -66.79 -21.99 66.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.961 178.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -118.17 21.25 12.85 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.862 0.363 . . . . 0.0 111.486 -177.538 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 130.8 98.0 0.78 Allowed Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.542 178.834 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -92.18 106.91 18.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.971 0.415 . . . . 0.0 110.578 177.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 39.4 m95 -113.47 28.12 9.03 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.806 0.812 . . . . 0.0 109.174 178.354 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.592 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -85.15 -5.87 59.32 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.471 -170.73 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.6 p -14.25 29.76 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 117.796 2.517 . . . . 0.0 117.796 -139.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.592 ' H ' ' C ' ' A' ' 20' ' ' CYS . 72.9 m80 -111.22 -92.82 0.45 Allowed 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 164.032 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.2 tttm -155.22 118.41 4.4 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 165.411 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.435 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 42.2 t -82.2 102.4 11.1 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 174.703 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 9.9 p -121.6 136.09 25.7 Favored Pre-proline 0 N--CA 1.438 -1.065 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.52 -169.158 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -64.0 119.75 6.89 Favored 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 122.472 2.115 . . . . 0.0 112.25 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.408 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 5.7 mm-40 -113.74 76.91 1.01 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.293 -0.867 . . . . 0.0 108.73 178.802 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.6 -111.6 3.51 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.314 -0.946 . . . . 0.0 111.991 -174.713 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.51 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 18.3 ptpt -102.05 -8.3 21.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.887 0.343 . . . . 0.0 111.912 -175.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.51 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 95.4 mtt180 -127.97 171.64 11.64 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.843 0.354 . . . . 0.0 110.272 -178.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.409 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 93.1 m-85 -110.1 139.99 44.64 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.388 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.408 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 62.4 m-85 -134.73 151.8 51.27 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.736 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -86.0 103.93 15.15 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.116 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -115.17 158.82 21.71 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.151 -175.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -100.28 91.46 4.74 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.753 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.565 -0.731 . . . . 0.0 109.565 179.221 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 65.0 m . . . . . 0 N--CA 1.449 -0.511 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.471 HG22 ' HB2' ' A' ' 9' ' ' GLU . 75.7 mt -65.69 135.26 28.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.154 -176.152 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.7 mp0 -56.44 145.36 27.85 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 121.524 0.678 . . . . 0.0 111.307 -178.205 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.491 HD23 ' ND1' ' A' ' 22' ' ' HIS . 1.5 tm? -68.82 121.29 16.24 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.653 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 109.21 -8.34 33.05 Favored Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.139 -176.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.471 ' HB2' HG22 ' A' ' 5' ' ' ILE . 61.8 mm-40 -86.99 175.76 7.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.019 0.438 . . . . 0.0 110.969 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -91.53 144.85 25.13 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.132 179.245 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 9.4 p -129.46 147.17 64.05 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.65 179.03 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -68.78 160.53 49.22 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.202 1.935 . . . . 0.0 110.199 171.18 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.3 t-20 -49.74 117.78 7.69 Favored Pre-proline 0 C--O 1.234 0.285 0 O-C-N 123.36 0.412 . . . . 0.0 110.442 -176.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.488 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 13.5 Cg_endo -57.67 -18.69 34.39 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.523 2.815 . . . . 0.0 113.918 -173.527 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 -66.96 -24.04 66.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.87 0.367 . . . . 0.0 110.144 177.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -89.59 -3.7 58.18 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.087 177.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 137.23 134.71 3.29 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.477 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -110.73 106.51 15.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.375 0.587 . . . . 0.0 109.905 -179.089 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -103.29 9.34 38.1 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.486 0.66 . . . . 0.0 109.794 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.671 ' SG ' ' HB2' ' A' ' 24' ' ' CYS . 8.4 m -73.74 -2.8 24.88 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 124.184 0.993 . . . . 0.0 113.372 -175.015 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.8 m -17.0 29.7 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 118.309 2.707 . . . . 0.0 118.309 -138.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.554 ' H ' ' C ' ' A' ' 20' ' ' CYS . 32.1 m80 -104.51 -86.66 0.45 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 156.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.6 tttm -155.73 120.02 4.59 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 120.414 0.15 . . . . 0.0 110.657 169.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.671 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 41.9 t -85.07 110.17 18.75 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 175.618 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.1 m -124.52 158.91 60.13 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.338 -173.277 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -81.47 119.71 3.44 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 122.552 2.168 . . . . 0.0 112.034 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.421 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 6.5 mm-40 -110.57 75.31 0.92 Allowed 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 177.184 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 75.75 -111.65 3.38 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.921 -175.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.468 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 22.5 pttm -84.21 -28.68 27.13 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -176.226 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.468 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 62.4 mtt-85 -118.38 171.35 8.21 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.996 0.427 . . . . 0.0 110.995 -175.437 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.529 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 97.1 m-85 -107.32 145.1 33.23 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.899 177.499 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.421 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 37.5 m-85 -136.77 149.01 47.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.452 -179.214 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 85.0 m -79.3 102.78 8.81 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 175.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -115.09 161.48 18.32 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 -179.146 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -103.93 88.26 2.99 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.2 mm-40 . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.349 -179.619 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.543 ' HA ' ' O ' ' A' ' 19' ' ' TRP . 36.3 m . . . . . 0 C--O 1.232 0.157 0 CA-C-O 121.613 0.721 . . . . 0.0 110.524 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.17 138.25 23.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.182 -174.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.0 mp0 -55.58 141.31 37.84 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.074 -177.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.82 120.0 15.77 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.377 -177.475 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 111.46 -14.14 27.75 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.093 -175.092 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -84.53 165.16 18.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.989 0.423 . . . . 0.0 111.228 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.441 ' H ' ' HD3' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -78.99 145.9 33.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.475 175.262 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 7.6 p -125.42 137.95 30.85 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.712 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -57.57 157.53 22.65 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.654 2.236 . . . . 0.0 111.072 172.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -49.86 114.08 3.92 Favored Pre-proline 0 C--O 1.231 0.123 0 O-C-N 123.526 0.516 . . . . 0.0 110.456 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -57.89 -19.41 39.35 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 123.208 2.605 . . . . 0.0 113.616 -172.281 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -68.28 -19.7 64.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.748 0.309 . . . . 0.0 110.733 177.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -89.3 -8.82 52.55 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.964 0.411 . . . . 0.0 110.342 178.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 136.26 112.07 1.15 Allowed Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 111.603 -0.599 . . . . 0.0 111.603 -176.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -86.64 113.11 22.25 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.964 0.411 . . . . 0.0 110.541 -178.804 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.543 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 3.0 m0 -111.86 26.4 10.66 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 174.256 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.559 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -84.84 -6.02 59.34 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.88 -171.284 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.4 m -18.57 29.52 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 118.207 2.669 . . . . 0.0 118.207 -138.245 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.559 ' H ' ' C ' ' A' ' 20' ' ' CYS . 42.7 m80 -107.41 -90.83 0.43 Allowed 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 158.451 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -156.03 126.66 6.79 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 168.32 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.497 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 50.2 t -90.44 100.2 13.08 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 176.559 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.6 m -109.79 146.34 33.89 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-O 121.094 0.473 . . . . 0.0 111.656 -174.11 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.13 121.68 5.43 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.73 2.286 . . . . 0.0 112.188 178.066 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -118.86 90.3 3.31 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 176.597 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.42 -110.87 3.4 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.313 -0.946 . . . . 0.0 111.422 -174.55 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.5 tttp -104.65 -16.93 14.85 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.011 0.434 . . . . 0.0 110.869 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -111.38 167.08 10.58 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.929 -173.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.497 ' HB3' ' SG ' ' A' ' 24' ' ' CYS . 96.3 m-85 -110.49 140.75 44.45 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.014 177.24 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -135.55 149.14 49.36 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.015 0.436 . . . . 0.0 110.633 -179.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -85.84 107.44 17.67 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.533 -176.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -122.02 158.56 28.89 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.379 -174.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -97.7 88.65 4.39 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.911 0.862 . . . . 0.0 109.914 177.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 . . . . . 0 C--O 1.246 0.915 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.453 -178.586 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.585 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 62.5 m . . . . . 0 N--CA 1.449 -0.485 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.402 ' HB ' ' HA ' ' A' ' 20' ' ' CYS . 89.1 mt -64.73 130.27 29.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 118.152 0.433 . . . . 0.0 110.107 178.197 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.417 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 14.4 mm-40 -59.47 147.64 35.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.233 -177.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.447 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.7 OUTLIER -74.27 115.79 14.17 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.944 -175.248 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.5 -18.55 11.88 Favored Glycine 0 N--CA 1.445 -0.717 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.998 -174.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.421 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 8.2 mm-40 -75.91 166.63 23.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.036 0.446 . . . . 0.0 111.04 -179.121 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.421 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -84.77 138.24 32.72 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 176.304 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 23.1 p -117.81 148.55 43.45 Favored Pre-proline 0 C--N 1.316 -0.88 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.197 -178.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.23 154.46 69.8 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.684 2.256 . . . . 0.0 110.93 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASN . . . . . 0.597 ' OD1' ' HG2' ' A' ' 15' ' ' ARG . 47.5 t-20 -51.99 116.92 8.99 Favored Pre-proline 0 C--O 1.233 0.196 0 O-C-N 123.699 0.624 . . . . 0.0 110.543 -177.013 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.448 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 14.5 Cg_endo -56.62 -20.57 34.91 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.442 2.761 . . . . 0.0 114.129 -172.678 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.597 ' HG2' ' OD1' ' A' ' 13' ' ' ASN . 10.1 ptm180 -64.45 -23.99 67.47 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 121.045 -0.262 . . . . 0.0 111.046 177.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -92.11 0.48 57.46 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.908 0.385 . . . . 0.0 110.641 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 99.89 94.55 2.11 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.812 -0.709 . . . . 0.0 111.877 -177.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.412 ' HB3' ' HA ' ' A' ' 14' ' ' PRO . 9.2 p-10 -86.83 147.59 25.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.101 0.477 . . . . 0.0 110.679 -179.278 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.585 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 26.0 m95 -111.74 36.26 3.35 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 176.004 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.574 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -79.4 -6.97 58.0 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.329 -1.305 . . . . 0.0 113.179 -171.659 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.9 m -17.77 31.24 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 118.077 2.621 . . . . 0.0 118.077 -141.551 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.574 ' H ' ' C ' ' A' ' 20' ' ' CYS . 69.0 m80 -109.35 -87.98 0.5 Allowed 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 161.729 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -154.6 124.22 6.56 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.158 167.11 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.448 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 44.9 t -84.97 90.78 7.9 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 172.313 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.7 p -106.7 132.09 21.18 Favored Pre-proline 0 N--CA 1.44 -0.946 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.782 -168.084 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -67.36 119.82 6.85 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.441 2.094 . . . . 0.0 112.726 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -113.38 85.23 2.15 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.897 -1.047 . . . . 0.0 108.941 177.171 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 79.23 -111.15 3.19 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 119.945 -1.121 . . . . 0.0 111.326 -175.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -94.44 -30.19 14.58 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.093 0.473 . . . . 0.0 110.88 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -98.85 174.17 6.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.224 -173.09 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -117.06 137.78 52.03 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.414 174.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -130.89 150.44 52.05 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.009 0.433 . . . . 0.0 110.173 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -85.52 100.63 12.04 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.394 -178.463 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.0 mmm180 -119.91 163.66 17.22 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.193 -175.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -107.5 89.68 3.07 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.827 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 . . . . . 0 C--O 1.246 0.878 0 CA-C-O 118.516 -0.754 . . . . 0.0 110.119 -179.438 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 76.0 m . . . . . 0 N--CA 1.45 -0.44 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 89.2 mt -70.65 134.24 30.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 176.015 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -58.48 145.97 37.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.534 0.683 . . . . 0.0 110.796 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.484 ' HA ' HD22 ' A' ' 7' ' ' LEU . 0.7 OUTLIER -74.48 121.86 22.14 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.563 -176.769 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.25 -6.5 34.36 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.354 -174.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -86.17 168.74 13.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.101 0.477 . . . . 0.0 111.629 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.431 ' HD2' ' N ' ' A' ' 11' ' ' CYS . 2.3 tmm_? -88.52 127.85 35.54 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.161 177.647 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.431 ' N ' ' HD2' ' A' ' 10' ' ' ARG . 25.7 p -113.37 151.03 44.04 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-O 120.636 0.255 . . . . 0.0 111.315 -174.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.34 146.99 64.53 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.591 2.194 . . . . 0.0 110.87 173.792 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.6 t-20 -50.39 120.07 11.88 Favored Pre-proline 0 C--O 1.231 0.129 0 O-C-N 123.708 0.63 . . . . 0.0 110.112 -177.63 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.535 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 14.5 Cg_endo -56.44 -21.0 35.4 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 123.308 2.672 . . . . 0.0 113.589 -174.364 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.18 -18.0 63.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.846 0.355 . . . . 0.0 110.303 177.755 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -101.08 -4.68 26.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.566 178.692 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.63 107.72 3.23 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.159 -177.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -109.87 146.77 34.54 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.04 0.448 . . . . 0.0 110.39 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 2.1 m-90 -108.73 33.82 4.01 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 177.004 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.577 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -78.41 -9.29 59.23 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -169.379 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.7 p -19.29 29.93 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 118.231 2.678 . . . . 0.0 118.231 -140.175 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.577 ' H ' ' C ' ' A' ' 20' ' ' CYS . 66.7 m80 -103.03 -87.6 0.42 Allowed 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 161.395 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.413 ' HE3' ' N ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -155.39 117.7 4.18 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 167.96 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.535 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 45.5 t -82.76 93.37 7.41 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 169.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.1 p -112.62 137.9 21.86 Favored Pre-proline 0 C--N 1.313 -1.013 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.336 -166.616 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -66.7 119.27 6.28 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.254 1.969 . . . . 0.0 111.91 178.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -116.72 76.91 1.06 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.36 -0.837 . . . . 0.0 108.863 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.56 -111.7 3.46 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.105 -1.045 . . . . 0.0 111.598 -175.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.7 pttm -99.59 -12.0 20.49 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -176.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -120.84 175.16 6.18 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.01 0.434 . . . . 0.0 111.123 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -113.33 137.19 51.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.51 173.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -133.67 152.32 51.86 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.057 0.456 . . . . 0.0 109.871 179.25 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -83.28 101.66 11.43 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.301 -178.466 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -114.87 160.46 19.47 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.316 -177.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -109.67 88.68 2.8 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.07 0.462 . . . . 0.0 110.266 178.221 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.399 -0.81 . . . . 0.0 109.293 176.473 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.662 ' HA ' ' O ' ' A' ' 19' ' ' TRP . 33.3 m . . . . . 0 CA--C 1.533 0.306 0 CA-C-O 121.793 0.806 . . . . 0.0 111.55 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 86.6 mt -72.56 137.97 22.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.347 -176.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -55.28 138.48 45.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.231 177.088 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.463 ' HA ' HD22 ' A' ' 7' ' ' LEU . 1.3 tm? -70.06 121.96 18.47 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.16 -173.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 111.25 -16.19 27.37 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.134 -176.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.401 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 18.1 mm-40 -78.71 168.71 19.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.903 0.382 . . . . 0.0 110.898 -179.734 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.401 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -74.73 151.71 39.16 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 176.047 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.57 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 11.7 t -140.04 139.99 22.79 Favored Pre-proline 0 C--N 1.314 -0.942 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.24 -174.656 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -71.93 158.79 51.97 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.532 2.155 . . . . 0.0 110.86 176.215 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -53.22 115.73 8.13 Favored Pre-proline 0 C--N 1.331 -0.225 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.44 -24.95 46.11 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 123.454 2.769 . . . . 0.0 113.621 -172.475 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 17.4 ptt180 -71.22 -17.83 62.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.837 0.351 . . . . 0.0 110.405 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -98.9 -0.59 41.99 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.575 179.414 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 135.16 93.93 0.44 Allowed Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.959 -0.638 . . . . 0.0 111.971 -177.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -81.54 124.79 29.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.603 0.239 . . . . 0.0 110.649 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.662 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 20.5 m95 -118.89 12.23 12.81 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-O 120.988 0.423 . . . . 0.0 109.938 174.601 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.583 ' C ' ' H ' ' A' ' 22' ' ' HIS . 38.8 t -73.65 -6.49 47.05 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -170.187 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.7 m -15.88 31.85 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 117.566 2.432 . . . . 0.0 117.566 -138.473 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.583 ' H ' ' C ' ' A' ' 20' ' ' CYS . 72.8 m80 -108.37 -88.07 0.48 Allowed 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 163.076 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.7 tttm -156.49 119.65 4.19 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 165.475 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.2 t -86.03 107.95 18.02 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.1 m -120.79 149.65 51.09 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-O 121.001 0.429 . . . . 0.0 111.553 -173.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -70.74 122.88 9.27 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.601 2.201 . . . . 0.0 112.397 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.465 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 6.9 mm-40 -119.26 75.71 1.07 Allowed 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.182 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.76 -111.16 3.28 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.348 -0.93 . . . . 0.0 112.189 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -83.05 -29.93 28.44 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -177.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -126.46 171.65 10.86 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.045 0.45 . . . . 0.0 111.016 -174.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.57 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 87.4 m-85 -98.02 148.87 23.06 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.369 176.245 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.465 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 11.7 m-85 -133.18 156.28 47.77 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 -179.085 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 4.6 t -88.34 103.38 15.76 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -179.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.441 ' HB3' HE22 ' A' ' 36' ' ' GLN . 30.5 mmt180 -116.55 163.39 16.15 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.751 -176.161 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -104.76 88.31 2.88 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.231 0.538 . . . . 0.0 111.551 -178.157 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.441 HE22 ' HB3' ' A' ' 34' ' ' ARG . 2.5 mp0 . . . . . 0 C--O 1.252 1.193 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.558 172.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.617 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 71.4 m . . . . . 0 N--CA 1.451 -0.409 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 81.2 mt -58.52 135.01 23.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 CA-C-O 121.209 0.528 . . . . 0.0 111.099 -178.431 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.456 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 11.4 mp0 -60.43 152.89 24.42 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.89 -177.105 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.522 HD23 ' CG ' ' A' ' 22' ' ' HIS . 1.2 tm? -74.32 117.66 16.38 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.939 -177.288 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.9 -14.5 29.04 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.806 -0.633 . . . . 0.0 112.013 -176.125 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.471 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 12.7 mm-40 -78.72 167.32 21.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.041 0.448 . . . . 0.0 110.619 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.471 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -82.21 145.16 30.2 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.372 177.222 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.556 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 15.1 p -125.34 147.29 57.14 Favored Pre-proline 0 C--N 1.313 -0.992 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.244 177.249 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PRO . . . . . 0.541 ' HG3' ' CZ3' ' A' ' 19' ' ' TRP . 56.0 Cg_endo -68.98 159.42 54.03 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.398 2.065 . . . . 0.0 110.29 174.516 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -52.54 115.62 7.39 Favored Pre-proline 0 C--N 1.328 -0.353 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -54.67 -22.33 28.36 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.303 2.668 . . . . 0.0 113.79 -171.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -70.13 -20.27 63.18 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.982 179.347 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -97.57 -1.76 43.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.601 0.239 . . . . 0.0 111.059 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 135.93 118.72 1.82 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.797 -178.599 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -102.0 107.27 18.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.984 0.421 . . . . 0.0 111.141 -177.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.617 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 1.7 m0 -106.95 21.39 17.63 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 173.242 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.533 ' O ' ' N ' ' A' ' 22' ' ' HIS . 3.8 t -81.41 -8.54 59.75 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.412 -1.267 . . . . 0.0 111.803 -170.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 20.3 m -21.93 31.13 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 118.591 2.811 . . . . 0.0 118.591 -142.444 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.533 ' N ' ' O ' ' A' ' 20' ' ' CYS . 77.4 m80 -104.43 -88.29 0.43 Allowed 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 161.624 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -156.32 118.79 4.06 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 163.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.412 ' HB2' ' CB ' ' A' ' 20' ' ' CYS . 48.9 t -83.92 97.56 9.3 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.619 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.415 ' HA ' ' HD3' ' A' ' 26' ' ' PRO . 18.2 m -109.07 145.6 32.09 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.1 -176.636 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 25' ' ' VAL . 3.5 Cg_exo -71.46 119.8 6.51 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.465 2.11 . . . . 0.0 111.492 176.766 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -110.79 76.81 1.0 Allowed 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 176.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.12 -111.68 3.43 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.475 -0.869 . . . . 0.0 111.088 -173.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -99.82 -13.62 19.14 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.182 0.515 . . . . 0.0 110.648 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -106.56 176.1 5.28 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.942 -177.155 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.556 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 87.7 m-85 -126.96 141.66 51.74 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 176.362 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -137.71 148.4 45.63 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.002 0.43 . . . . 0.0 111.189 -178.352 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.439 ' O ' HD22 ' A' ' 7' ' ' LEU . 55.6 m -79.37 101.4 8.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.684 174.7 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -107.89 154.67 21.25 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.215 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -89.87 88.84 7.49 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.512 177.491 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 . . . . . 0 C--O 1.245 0.855 0 CA-C-O 118.192 -0.909 . . . . 0.0 110.029 -178.331 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 19' ' ' TRP . 63.2 m . . . . . 0 N--CA 1.448 -0.54 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.456 HG13 ' HB2' ' A' ' 19' ' ' TRP . 79.8 mt -81.34 133.61 28.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 -178.701 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.427 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 1.5 pm0 -70.16 157.26 37.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.797 0.808 . . . . 0.0 111.648 -174.931 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.544 HD23 ' ND1' ' A' ' 22' ' ' HIS . 0.4 OUTLIER -67.06 123.71 20.99 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.913 -172.94 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.68 -9.51 34.88 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.524 179.224 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.454 ' HB2' HG22 ' A' ' 5' ' ' ILE . 32.2 mm-40 -84.32 170.84 13.23 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.986 0.422 . . . . 0.0 111.12 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.578 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 5.3 mpt_? -89.92 137.9 31.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.55 -179.843 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.577 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 17.2 p -124.72 149.21 61.67 Favored Pre-proline 0 C--N 1.318 -0.794 0 CA-C-O 120.564 0.221 . . . . 0.0 110.865 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -71.05 151.58 61.85 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.132 1.888 . . . . 0.0 110.127 170.357 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -49.54 124.27 14.97 Favored Pre-proline 0 C--N 1.332 -0.192 0 O-C-N 123.63 0.581 . . . . 0.0 109.638 -179.02 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.478 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 9.2 Cg_endo -51.71 -22.3 13.01 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 123.739 2.959 . . . . 0.0 113.757 -174.469 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -68.55 -20.03 64.52 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.8 0.333 . . . . 0.0 110.551 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -92.24 -7.78 47.2 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.629 175.274 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 104.64 96.49 2.42 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.264 -178.043 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -94.22 147.71 22.91 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.818 0.342 . . . . 0.0 110.175 179.081 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.489 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 20.6 m95 -111.48 21.35 16.28 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 175.416 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.567 ' C ' ' H ' ' A' ' 22' ' ' HIS . 4.7 m -56.75 -5.81 0.26 Allowed 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 115.592 1.701 . . . . 0.0 115.592 -174.46 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.1 m -17.21 30.33 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 118.181 2.66 . . . . 0.0 118.181 -140.081 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' HIS . . . . . 0.567 ' H ' ' C ' ' A' ' 20' ' ' CYS . 24.6 m80 -109.55 -85.37 0.54 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 158.69 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.6 tttm -156.64 131.14 8.73 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 121.353 -0.139 . . . . 0.0 110.7 167.787 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.524 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 50.4 t -90.44 105.69 17.98 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 176.619 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 31.6 m -116.5 147.38 39.55 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.462 -173.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -73.78 119.65 6.0 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.527 2.151 . . . . 0.0 112.415 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -115.19 75.76 0.96 Allowed 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.209 177.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.22 -111.28 3.81 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.235 -178.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 8.4 ptpp? -71.17 -32.73 69.27 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -175.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -127.27 -179.57 4.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.924 0.392 . . . . 0.0 110.998 -172.687 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.577 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 62.4 m-85 -111.93 147.24 36.28 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 175.117 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.429 ' CZ ' ' HG3' ' A' ' 10' ' ' ARG . 30.5 m-85 -136.42 144.03 44.26 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.799 0.333 . . . . 0.0 110.797 -178.158 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.438 ' SG ' ' HB3' ' A' ' 11' ' ' CYS . 73.0 m -76.5 103.9 6.73 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.521 176.362 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -119.02 163.63 16.68 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.488 -178.613 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -104.8 88.95 3.03 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.23 0.538 . . . . 0.0 110.507 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.237 -0.887 . . . . 0.0 109.787 178.238 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.674 0 N-CA-C 111.832 -0.507 . . . . 0.0 111.832 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.401 ' O ' ' HB3' ' A' ' 3' ' ' TYR . 5.4 t -102.81 57.58 0.77 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.123 0.487 . . . . 0.0 110.618 -178.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.401 ' HB3' ' O ' ' A' ' 2' ' ' THR . 54.3 t80 73.03 -46.25 0.64 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.141 -178.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.476 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 61.7 m -135.13 179.57 6.24 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.506 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 71.9 mt -63.11 130.56 27.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.415 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 1.3 pm0 -68.01 154.74 40.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.769 0.795 . . . . 0.0 111.701 -173.199 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.522 HD23 ' ND1' ' A' ' 22' ' ' HIS . 0.4 OUTLIER -66.67 120.48 13.54 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.606 -173.941 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.465 ' HA2' ' NH1' ' A' ' 34' ' ' ARG . . . 116.57 -15.38 14.69 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.772 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.557 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 16.6 mm-40 -84.82 165.92 17.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.195 0.522 . . . . 0.0 111.61 -177.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.557 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -82.57 141.88 32.23 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.735 179.361 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.52 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 18.6 p -126.56 153.33 75.3 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.76 178.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -70.14 169.11 20.18 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.498 2.132 . . . . 0.0 110.853 172.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.431 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 46.8 t-20 -50.02 119.89 10.9 Favored Pre-proline 0 C--N 1.328 -0.348 0 O-C-N 123.351 0.407 . . . . 0.0 110.797 -178.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.431 ' HD2' ' HA ' ' A' ' 13' ' ' ASN . 11.7 Cg_endo -56.41 -16.08 17.13 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 123.886 3.057 . . . . 0.0 113.938 -175.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.412 ' HG2' ' OD1' ' A' ' 13' ' ' ASN . 23.8 mmt180 -63.88 -21.53 66.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.084 0.469 . . . . 0.0 110.39 176.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -81.42 -10.3 59.54 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.653 177.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 120.33 135.88 5.04 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 111.514 -0.635 . . . . 0.0 111.514 -177.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -77.64 103.88 7.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.282 0.541 . . . . 0.0 110.327 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.476 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 5.3 m-90 -94.55 8.42 42.29 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-O 121.995 0.902 . . . . 0.0 109.093 172.49 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.522 ' C ' ' H ' ' A' ' 22' ' ' HIS . 56.1 m -84.75 -2.34 57.5 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 113.903 -1.499 . . . . 0.0 112.087 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.8 m -18.56 28.28 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 118.737 2.866 . . . . 0.0 118.737 -138.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.522 ' H ' ' C ' ' A' ' 20' ' ' CYS . 49.7 m80 -94.77 -82.39 0.37 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 153.525 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -155.26 131.34 10.15 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.192 165.371 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.439 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 43.3 t -87.01 100.21 12.45 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 170.011 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 4.9 p -121.93 138.96 29.43 Favored Pre-proline 0 C--N 1.312 -1.041 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.548 -166.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -66.51 120.02 7.1 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.385 2.056 . . . . 0.0 112.394 177.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -119.87 84.36 2.2 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.284 -0.871 . . . . 0.0 108.809 177.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 85.02 -110.93 3.45 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.207 -0.997 . . . . 0.0 111.927 -174.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.407 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 0.9 OUTLIER -106.63 -7.94 17.16 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.374 -0.486 . . . . 0.0 111.969 -177.352 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.407 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 93.1 mtt180 -119.27 172.5 7.56 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.011 0.434 . . . . 0.0 110.6 -178.365 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.408 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 91.1 m-85 -109.59 140.53 43.29 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.476 -0.784 . . . . 0.0 108.962 173.179 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -136.37 149.54 48.38 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.818 0.342 . . . . 0.0 110.621 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 65.9 m -78.52 96.49 5.44 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 173.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.465 ' NH1' ' HA2' ' A' ' 8' ' ' GLY . 40.4 mmt180 -119.03 165.3 14.29 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.132 -175.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -103.09 86.96 2.79 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 170.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 . . . . . 0 C--O 1.246 0.885 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.766 -170.798 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.723 0 N-CA-C 112.351 -0.299 . . . . 0.0 112.351 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.2 t -153.26 -178.59 7.06 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -178.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -66.81 128.18 35.3 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.52 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 20.1 p 48.77 -158.25 0.06 Allowed 'General case' 0 N--CA 1.469 0.476 0 O-C-N 124.261 0.975 . . . . 0.0 110.916 -174.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.409 ' HB ' ' SG ' ' A' ' 33' ' ' CYS . 79.6 mt -77.09 133.48 30.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 178.183 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.483 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 2.4 pm0 -66.0 149.46 50.21 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 121.841 0.829 . . . . 0.0 110.61 -178.341 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.478 HD23 ' CG ' ' A' ' 22' ' ' HIS . 0.8 OUTLIER -68.78 121.35 16.34 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.726 -1.124 . . . . 0.0 110.682 -171.468 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.427 ' HA2' ' NH1' ' A' ' 34' ' ' ARG . . . 118.61 -21.33 9.83 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.834 -179.212 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.483 ' CG ' ' HG2' ' A' ' 6' ' ' GLU . 14.1 mm-40 -83.09 170.9 14.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.091 0.472 . . . . 0.0 111.64 -175.39 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.447 ' N ' ' HD3' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -81.94 143.48 31.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.205 179.316 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.446 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 14.2 p -122.76 149.58 56.48 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.347 177.136 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.36 159.88 51.44 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.308 2.005 . . . . 0.0 110.347 172.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 50.5 t-20 -50.61 117.2 7.9 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.46 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 11.6 Cg_endo -55.61 -27.69 61.67 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 123.372 2.715 . . . . 0.0 114.023 -171.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.74 -12.78 60.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.209 0.528 . . . . 0.0 110.494 178.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -105.49 13.82 29.55 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.152 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.17 107.3 2.05 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.248 -179.038 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -96.72 116.99 30.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.779 0.323 . . . . 0.0 110.859 -178.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.52 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 35.6 m95 -116.92 20.95 13.62 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 176.346 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.577 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -80.02 -6.93 58.47 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -171.348 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.7 p -18.06 30.94 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 118.088 2.625 . . . . 0.0 118.088 -141.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.577 ' H ' ' C ' ' A' ' 20' ' ' CYS . 76.9 m80 -113.07 -83.98 0.59 Allowed 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 162.496 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -154.04 125.24 7.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.03 167.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.504 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 45.4 t -88.02 88.58 7.69 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 172.402 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 5.8 p -107.98 135.4 19.86 Favored Pre-proline 0 N--CA 1.44 -0.971 0 CA-C-N 115.074 -0.967 . . . . 0.0 109.895 -168.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -67.24 119.13 6.13 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.237 1.958 . . . . 0.0 112.209 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -105.27 76.74 1.25 Allowed 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.92 -110.33 3.3 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.099 -1.048 . . . . 0.0 110.647 -169.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -94.95 -34.37 12.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.939 0.399 . . . . 0.0 111.06 179.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -92.56 171.1 9.24 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.977 0.417 . . . . 0.0 111.087 -172.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.504 ' HB3' ' SG ' ' A' ' 24' ' ' CYS . 94.0 m-85 -114.64 140.67 48.63 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.115 177.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -137.68 147.81 45.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.201 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.409 ' SG ' ' HB ' ' A' ' 5' ' ' ILE . 95.2 m -78.2 101.29 7.01 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 175.558 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.427 ' NH1' ' HA2' ' A' ' 8' ' ' GLY . 25.9 mmt180 -113.56 160.55 18.41 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.339 179.667 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -103.13 88.1 3.06 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 . . . . . 0 C--O 1.246 0.879 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.273 -173.775 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.732 0 N-CA-C 111.797 -0.521 . . . . 0.0 111.797 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.662 ' HB ' ' O ' ' A' ' 4' ' ' CYS . 2.0 p -117.0 100.66 7.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.689 0.281 . . . . 0.0 111.688 -177.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 92.8 t80 -58.52 -38.0 76.79 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.954 0.407 . . . . 0.0 109.906 172.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.662 ' O ' ' HB ' ' A' ' 2' ' ' THR . 82.3 m -98.01 143.2 28.82 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 171.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.448 HG13 ' HB2' ' A' ' 19' ' ' TRP . 91.4 mt -67.29 130.15 32.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.937 -177.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.517 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.5 pm0 -66.19 149.97 49.5 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.234 -0.893 . . . . 0.0 111.423 -176.055 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.4 OUTLIER -65.18 121.23 14.28 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.549 -1.205 . . . . 0.0 111.039 -172.758 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 113.73 -11.72 23.08 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.003 -0.617 . . . . 0.0 112.551 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -87.14 168.33 13.35 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.364 0.602 . . . . 0.0 111.939 -179.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.488 ' HD2' ' O ' ' A' ' 31' ' ' PHE . 9.0 mmm180 -81.07 139.51 35.65 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.377 177.069 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.545 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 17.9 p -121.48 142.28 35.21 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.942 178.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -62.04 144.49 96.21 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 122.13 1.886 . . . . 0.0 110.117 169.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.588 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 3.2 m-20 -49.37 123.8 13.87 Favored Pre-proline 0 C--N 1.328 -0.338 0 O-C-N 123.787 0.679 . . . . 0.0 110.622 -178.07 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.588 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 9.2 Cg_endo -52.51 -21.6 14.54 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 123.543 2.829 . . . . 0.0 113.53 -174.119 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.544 ' HD3' ' N ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -59.56 -22.06 61.19 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 175.903 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 10.2 pt-20 -118.36 19.34 13.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.921 0.391 . . . . 0.0 111.14 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 96.96 110.32 2.72 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.992 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -113.65 133.7 55.16 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 176.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.448 ' HB2' HG13 ' A' ' 5' ' ' ILE . 1.1 m95 -101.13 22.45 12.31 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.59 ' C ' ' H ' ' A' ' 22' ' ' HIS . 1.6 m -57.57 -6.25 0.46 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 -175.319 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 16.2 m -17.34 31.54 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 117.753 2.501 . . . . 0.0 117.753 -140.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.59 ' H ' ' C ' ' A' ' 20' ' ' CYS . 71.0 m80 -112.35 -84.4 0.58 Allowed 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 160.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -154.15 127.03 8.23 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.396 169.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.588 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 42.9 t -88.23 89.92 8.18 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 172.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.7 p -109.29 138.99 20.63 Favored Pre-proline 0 N--CA 1.439 -0.98 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.96 -169.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -65.89 119.07 6.04 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.137 1.892 . . . . 0.0 111.857 178.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.449 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 7.3 mm-40 -113.26 77.28 1.04 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.023 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.92 -110.42 3.31 Favored Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 119.972 -1.108 . . . . 0.0 111.566 -176.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.482 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 10.3 ptpp? -99.5 -5.67 28.88 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -175.446 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.482 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 96.2 mtt180 -136.38 178.3 7.17 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.617 0.246 . . . . 0.0 110.553 -177.252 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.488 ' O ' ' HD2' ' A' ' 10' ' ' ARG . 69.4 m-85 -112.46 142.99 44.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.694 178.33 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.449 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 55.4 m-85 -138.5 151.41 47.35 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.096 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 70.8 m -78.67 103.71 8.79 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 174.166 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -117.02 161.33 19.57 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.217 -178.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -100.68 88.18 3.54 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.31 0.576 . . . . 0.0 109.639 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.536 -0.745 . . . . 0.0 109.77 179.486 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.77 0 N-CA-C 112.157 -0.377 . . . . 0.0 112.157 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.41 ' C ' ' H ' ' A' ' 4' ' ' CYS . 11.6 t -175.52 174.15 2.33 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.181 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -79.36 33.85 0.25 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.441 0.639 . . . . 0.0 111.696 -177.477 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 14.2 p -174.57 -162.77 0.13 Allowed 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 177.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 77.1 mt -79.95 134.03 28.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -78.69 160.76 27.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.514 0.673 . . . . 0.0 111.339 -177.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.482 HD23 ' ND1' ' A' ' 22' ' ' HIS . 0.5 OUTLIER -63.66 127.22 30.38 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.793 -174.457 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.71 -9.48 44.36 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 115.715 -0.675 . . . . 0.0 113.077 177.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -91.6 175.34 6.94 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.013 0.435 . . . . 0.0 111.447 -177.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.5 mmt85 -80.18 150.52 30.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.44 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.516 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 26.4 p -136.58 148.66 64.62 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.865 175.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.29 149.37 45.29 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.238 1.959 . . . . 0.0 110.581 171.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.406 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 51.2 t-20 -48.98 120.39 9.42 Favored Pre-proline 0 C--N 1.33 -0.244 0 O-C-N 123.809 0.693 . . . . 0.0 110.637 -178.296 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.575 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 14.3 Cg_endo -56.08 -16.52 16.97 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.617 2.878 . . . . 0.0 113.435 -175.384 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -61.61 -31.7 71.78 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.729 0.299 . . . . 0.0 110.738 176.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -100.24 12.9 35.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.853 0.359 . . . . 0.0 110.63 178.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 88.56 108.9 1.08 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.301 -177.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.596 ' OD1' ' HB2' ' A' ' 20' ' ' CYS . 3.0 p30 -102.14 148.78 24.99 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.047 0.451 . . . . 0.0 110.427 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.506 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 26.8 m95 -106.5 31.0 5.53 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.431 0.634 . . . . 0.0 109.318 176.128 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.596 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 0.0 OUTLIER -68.1 -6.55 23.52 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 -174.896 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.0 p -20.35 29.22 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 118.584 2.809 . . . . 0.0 118.584 -138.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.529 ' H ' ' C ' ' A' ' 20' ' ' CYS . 3.4 m80 -106.0 -83.63 0.52 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 157.026 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.522 ' HA ' ' HE3' ' A' ' 23' ' ' LYS . 1.6 tpmt? -154.83 123.79 6.24 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.973 171.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.575 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 47.8 t -87.29 93.88 9.51 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 173.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.8 p -110.74 133.56 21.17 Favored Pre-proline 0 N--CA 1.439 -1.024 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.348 -171.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -67.36 121.66 8.81 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.496 2.131 . . . . 0.0 112.412 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -111.59 78.87 1.15 Allowed 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 173.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.5 -116.45 4.23 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -175.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -94.25 -8.09 40.15 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.5 0.667 . . . . 0.0 110.092 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 68.3 mtm180 -110.05 171.51 7.41 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.859 -174.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.465 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 94.0 m-85 -129.01 139.1 52.22 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.529 175.322 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -139.39 152.39 47.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.901 0.382 . . . . 0.0 110.656 -179.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 88.8 m -80.3 103.08 9.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.757 174.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -119.29 161.61 20.14 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.474 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -95.58 88.85 5.17 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.41 0.624 . . . . 0.0 109.824 178.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 . . . . . 0 C--O 1.247 0.969 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.541 -179.408 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.81 0 N-CA-C 112.587 -0.205 . . . . 0.0 112.587 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.585 HG23 ' O ' ' A' ' 4' ' ' CYS . 5.2 t -172.05 174.15 4.16 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 177.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -54.29 -50.15 67.98 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.782 0.325 . . . . 0.0 111.302 -177.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.585 ' O ' HG23 ' A' ' 2' ' ' THR . 84.6 m -101.34 -179.1 3.93 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 83.7 mt -80.35 122.32 35.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 174.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.458 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.6 pm0 -61.88 145.31 53.14 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.772 0.796 . . . . 0.0 111.271 -174.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.447 ' HA ' HD22 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -65.64 124.84 23.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.55 -1.205 . . . . 0.0 110.829 -171.692 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 115.26 -21.21 13.32 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.771 -177.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.413 ' CG ' ' HG2' ' A' ' 6' ' ' GLU . 76.0 mm-40 -79.48 173.8 12.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.194 0.521 . . . . 0.0 111.789 -177.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.573 ' H ' ' HD3' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -80.67 155.78 26.64 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.82 172.964 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 12.1 p -136.45 146.07 54.29 Favored Pre-proline 0 C--N 1.319 -0.736 0 C-N-CA 121.156 -0.217 . . . . 0.0 110.545 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -65.8 161.29 39.83 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.404 2.069 . . . . 0.0 110.85 172.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.411 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 4.2 m-20 -49.92 118.61 8.99 Favored Pre-proline 0 C--N 1.33 -0.278 0 O-C-N 123.584 0.552 . . . . 0.0 110.919 -179.379 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.473 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 11.6 Cg_endo -57.46 -23.87 58.15 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.897 2.398 . . . . 0.0 112.568 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -68.18 -24.53 64.97 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.305 175.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -98.76 0.29 44.15 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.886 0.374 . . . . 0.0 110.513 -177.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.16 95.62 2.4 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.38 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.479 ' OD2' ' HB2' ' A' ' 20' ' ' CYS . 4.2 p-10 -99.86 148.68 24.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.079 0.466 . . . . 0.0 110.521 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -107.4 31.17 5.61 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.529 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -71.83 -8.78 56.38 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -171.092 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 24.6 p -19.86 29.38 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 118.576 2.806 . . . . 0.0 118.576 -140.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.529 ' H ' ' C ' ' A' ' 20' ' ' CYS . 17.3 m80 -103.02 -88.91 0.39 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 157.546 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.407 ' CE ' ' HB2' ' A' ' 36' ' ' GLN . 21.9 ttmm -155.83 124.62 6.02 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 120.756 0.312 . . . . 0.0 110.488 169.232 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.473 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 53.5 t -90.72 104.29 16.9 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 176.162 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.1 m -111.63 150.32 42.04 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.6 -173.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -76.52 118.96 5.04 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 122.629 2.219 . . . . 0.0 111.997 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -113.78 75.76 0.94 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.011 178.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.1 -111.73 3.32 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.488 -0.863 . . . . 0.0 111.948 -178.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.404 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 18.6 ptpt -85.62 -23.66 27.44 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -176.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.404 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 65.0 mtt180 -127.72 168.86 14.51 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.916 0.389 . . . . 0.0 111.139 -174.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 93.4 m-85 -105.71 144.15 32.85 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.93 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -135.48 149.92 49.66 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.148 0.499 . . . . 0.0 110.749 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.84 105.43 15.61 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.46 -176.294 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.417 ' C ' HD21 ' A' ' 7' ' ' LEU . 37.7 mmt180 -122.04 163.29 19.65 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.767 -175.179 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -110.39 89.6 3.08 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.312 0.577 . . . . 0.0 111.041 -177.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.407 ' HB2' ' CE ' ' A' ' 23' ' ' LYS . 2.0 mp0 . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.372 -0.823 . . . . 0.0 109.58 175.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.825 0 N-CA-C 112.166 -0.373 . . . . 0.0 112.166 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 12.6 t -171.14 166.97 7.22 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -84.28 108.77 17.33 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -178.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 15.1 p 55.06 -170.28 0.07 Allowed 'General case' 0 CA--C 1.538 0.488 0 O-C-N 124.518 1.137 . . . . 0.0 111.294 -176.309 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 95.9 mt -75.51 137.65 22.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 122.067 -0.396 . . . . 0.0 110.844 -175.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.422 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 23.1 mm-40 -65.07 147.43 53.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.712 0.768 . . . . 0.0 111.78 -176.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.457 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.6 OUTLIER -71.43 119.71 15.97 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.801 -1.091 . . . . 0.0 109.72 -177.451 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.54 -16.64 28.89 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.718 -0.673 . . . . 0.0 112.309 -174.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.501 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 10.4 mm-40 -80.83 168.76 18.41 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.045 0.45 . . . . 0.0 111.341 -178.122 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.501 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -83.86 137.02 33.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.594 177.409 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.6 p -126.61 156.28 73.52 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 116.853 -0.158 . . . . 0.0 111.376 -175.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -72.73 156.21 53.41 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.706 2.271 . . . . 0.0 111.363 173.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.492 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 52.1 t-20 -50.83 118.2 9.68 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.003 -177.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.415 ' HA ' ' HB3' ' A' ' 18' ' ' ASP . 19.1 Cg_endo -59.47 -17.25 39.92 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.129 2.553 . . . . 0.0 113.147 -177.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -66.16 -25.34 66.91 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.698 0.285 . . . . 0.0 110.84 177.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 12.2 pt-20 -105.43 18.77 21.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.048 0.451 . . . . 0.0 110.441 177.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 91.13 104.0 1.32 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.091 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.415 ' HB3' ' HA ' ' A' ' 14' ' ' PRO . 19.0 p-10 -94.05 124.28 37.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.079 0.466 . . . . 0.0 110.813 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.473 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 12.6 m95 -84.06 38.8 0.67 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.91 0.862 . . . . 0.0 108.818 177.265 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.567 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -85.14 -5.84 59.32 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.242 -1.345 . . . . 0.0 113.124 -170.339 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.2 p -16.4 30.0 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 118.265 2.691 . . . . 0.0 118.265 -140.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.567 ' H ' ' C ' ' A' ' 20' ' ' CYS . 31.3 m80 -107.07 -94.42 0.38 Allowed 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 153.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -156.37 118.92 4.06 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 120.89 0.376 . . . . 0.0 111.295 168.689 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.551 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 42.8 t -80.0 124.04 28.35 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 173.465 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.1 m -130.36 159.19 71.81 Favored Pre-proline 0 C--N 1.317 -0.815 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.226 -176.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -80.7 120.08 3.82 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.812 2.341 . . . . 0.0 112.303 -177.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.495 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 10.8 mm-40 -113.03 75.5 0.92 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.246 -0.888 . . . . 0.0 108.99 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.8 -111.04 3.61 Favored Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 120.239 -0.981 . . . . 0.0 111.929 -176.198 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.6 pttm -79.72 -29.65 40.72 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -175.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -125.54 175.7 7.36 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.956 0.408 . . . . 0.0 111.356 -174.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.551 ' HB3' ' SG ' ' A' ' 24' ' ' CYS . 97.2 m-85 -110.79 141.27 44.34 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.379 -179.207 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.495 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 27.8 m-85 -131.31 149.4 52.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.441 -178.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -84.1 110.25 18.34 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.794 -177.013 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.5 mmt180 -120.75 160.77 22.67 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.717 -176.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -98.14 88.15 4.13 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.677 0.751 . . . . 0.0 110.595 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 . . . . . 0 C--O 1.246 0.878 0 CA-C-O 118.495 -0.764 . . . . 0.0 110.376 178.34 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.492 0 N-CA-C 111.848 -0.501 . . . . 0.0 111.848 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.451 HG22 ' HG3' ' A' ' 6' ' ' GLU . 15.1 t -106.67 39.07 1.91 Allowed 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.129 0.49 . . . . 0.0 110.567 -179.107 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 65.18 97.45 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.204 -172.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 73.62 -177.42 0.17 Allowed 'General case' 0 CA--C 1.532 0.272 0 O-C-N 124.385 1.053 . . . . 0.0 109.191 -167.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 82.1 mt -73.46 134.4 29.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.159 0.504 . . . . 0.0 111.31 -173.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.466 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 3.8 mp0 -59.45 151.24 24.43 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.028 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.524 HD23 ' CG ' ' A' ' 22' ' ' HIS . 1.4 tm? -75.2 121.49 22.21 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.444 -178.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 107.72 -5.51 34.94 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.161 -176.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.466 ' HG3' ' HB2' ' A' ' 6' ' ' GLU . 8.7 mm-40 -91.19 170.95 9.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.707 0.289 . . . . 0.0 110.237 178.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.13 150.52 25.48 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 25.4 p -129.64 145.81 58.54 Favored Pre-proline 0 C--N 1.318 -0.781 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.308 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -68.04 154.07 73.49 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.039 1.826 . . . . 0.0 110.325 173.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -49.17 121.76 11.24 Favored Pre-proline 0 C--N 1.33 -0.257 0 O-C-N 123.748 0.655 . . . . 0.0 109.92 -177.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.465 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 10.3 Cg_endo -51.84 -26.48 24.34 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.73 2.953 . . . . 0.0 114.14 -172.479 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -77.38 -12.41 59.95 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.727 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -101.54 13.64 34.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.885 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.75 80.7 1.14 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.621 178.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -88.65 147.2 24.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.002 0.43 . . . . 0.0 110.586 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.7 m0 -106.25 29.79 6.49 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 174.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.535 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.5 OUTLIER -63.97 -8.01 10.17 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 -171.241 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 11.5 p -20.8 30.17 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 118.462 2.764 . . . . 0.0 118.462 -141.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.535 ' H ' ' C ' ' A' ' 20' ' ' CYS . 78.3 m80 -111.07 -83.48 0.57 Allowed 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 164.135 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.418 ' HG2' ' HB ' ' A' ' 25' ' ' VAL . 24.9 ttmm -154.92 118.84 4.61 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.974 168.215 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.465 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 20.1 t -82.55 89.64 6.7 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 173.285 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.418 ' HB ' ' HG2' ' A' ' 23' ' ' LYS . 7.1 p -109.48 135.81 20.29 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.093 -170.399 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -64.15 119.53 6.6 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.06 1.84 . . . . 0.0 111.918 178.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -111.69 75.79 0.94 Allowed 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 178.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 82.93 -109.92 3.17 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 119.542 -1.313 . . . . 0.0 111.369 -173.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.467 ' NZ ' ' HB2' ' A' ' 29' ' ' LYS . 4.6 ttmp? -91.77 -35.51 14.08 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.843 0.354 . . . . 0.0 111.569 -177.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -103.62 178.26 4.61 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.074 0.464 . . . . 0.0 111.199 -173.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -116.34 140.08 49.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.745 176.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -139.44 150.53 45.34 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.765 0.317 . . . . 0.0 110.541 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 67.4 m -77.58 103.25 7.41 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.047 176.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -116.5 157.94 24.41 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.231 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -104.95 88.76 2.96 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 177.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.705 -0.664 . . . . 0.0 109.881 -179.968 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.75 0 N-CA-C 112.118 -0.393 . . . . 0.0 112.118 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.9 t -67.53 154.48 41.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.706 0.289 . . . . 0.0 110.508 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -82.27 43.46 0.8 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.788 0.804 . . . . 0.0 110.09 176.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 77.6 m -152.52 -177.1 6.01 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.267 -1.333 . . . . 0.0 107.913 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 83.2 mt -68.99 136.69 25.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 176.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -62.12 148.27 44.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.663 0.744 . . . . 0.0 110.995 -178.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.516 HD23 ' CG ' ' A' ' 22' ' ' HIS . 1.0 OUTLIER -74.28 117.62 16.31 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.937 -1.028 . . . . 0.0 110.008 -175.041 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 114.24 -13.77 21.25 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.131 -175.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -82.3 170.71 15.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.008 0.432 . . . . 0.0 110.799 -179.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.436 ' N ' ' HD3' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -87.23 141.31 28.75 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.588 178.118 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 26.1 p -127.42 148.46 66.51 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.85 161.72 44.14 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.282 1.988 . . . . 0.0 111.021 175.155 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -50.05 118.35 8.83 Favored Pre-proline 0 C--N 1.329 -0.311 0 O-C-N 123.462 0.476 . . . . 0.0 109.886 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -54.03 -19.29 15.41 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 123.433 2.756 . . . . 0.0 113.501 -174.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.4 mmm180 -68.16 -18.46 64.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.897 177.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -92.85 -4.7 52.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.507 178.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 125.56 98.04 1.13 Allowed Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.589 -175.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -78.24 114.07 16.79 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.819 0.342 . . . . 0.0 110.859 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 3.5 m0 -110.44 13.68 22.72 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.265 176.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.613 ' C ' ' H ' ' A' ' 22' ' ' HIS . 51.2 t -74.03 -9.21 58.4 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -176.503 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.7 p -17.69 31.62 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 117.643 2.46 . . . . 0.0 117.643 -138.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.613 ' H ' ' C ' ' A' ' 20' ' ' CYS . 73.3 m80 -99.38 -87.37 0.36 Allowed 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 159.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -155.1 117.84 4.31 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.297 164.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 45.4 t -80.37 91.03 5.63 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 172.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.4 p -110.15 138.99 20.98 Favored Pre-proline 0 C--N 1.313 -0.99 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.244 -167.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -59.73 119.7 7.07 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.212 1.941 . . . . 0.0 111.536 177.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -120.81 77.61 1.31 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.38 -0.827 . . . . 0.0 108.945 -177.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.26 -111.09 3.42 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.307 -0.949 . . . . 0.0 111.528 -174.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -94.64 -24.6 17.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.872 0.368 . . . . 0.0 111.331 -177.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -119.47 176.29 5.42 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.482 -174.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.469 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 97.3 m-85 -103.14 140.72 36.96 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.897 176.067 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -132.05 150.41 52.16 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.284 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.412 ' O ' HD22 ' A' ' 7' ' ' LEU . 6.2 t -84.14 97.31 9.28 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.114 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -114.43 160.51 19.08 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.382 -174.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -103.9 90.07 3.5 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.005 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 . . . . . 0 C--O 1.246 0.911 0 CA-C-O 118.421 -0.8 . . . . 0.0 109.691 178.451 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.841 0 N-CA-C 112.191 -0.364 . . . . 0.0 112.191 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.463 HG22 ' HA ' ' A' ' 6' ' ' GLU . 12.4 t -161.56 36.71 0.13 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.538 0.685 . . . . 0.0 109.613 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 70.32 -58.43 0.55 Allowed 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.354 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.544 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 47.8 m -96.08 -163.05 1.01 Allowed 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 176.026 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.443 ' HB ' ' SG ' ' A' ' 33' ' ' CYS . 77.7 mt -59.43 130.95 23.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.031 0.443 . . . . 0.0 109.928 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.488 ' H ' ' CD ' ' A' ' 6' ' ' GLU . 1.8 pm0 -69.46 150.95 46.66 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.93 0.871 . . . . 0.0 111.358 -177.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.42 HD23 ' ND1' ' A' ' 22' ' ' HIS . 0.5 OUTLIER -68.46 115.62 8.09 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.338 -1.301 . . . . 0.0 110.58 -171.44 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 116.91 -13.45 14.45 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.358 -176.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -84.17 170.78 13.43 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.247 0.546 . . . . 0.0 111.694 179.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.481 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 9.5 mpt_? -79.92 155.33 27.78 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.303 -177.267 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.461 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 30.2 t -135.13 140.22 34.12 Favored Pre-proline 0 C--N 1.316 -0.852 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.555 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.34 162.74 41.41 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.769 2.313 . . . . 0.0 110.551 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.1 t-20 -53.79 112.79 4.11 Favored Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.67 -15.73 21.93 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.442 2.762 . . . . 0.0 113.943 -171.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.9 ptm180 -63.99 -25.46 68.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.011 0.434 . . . . 0.0 110.414 175.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -88.05 -2.97 58.93 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.47 178.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 131.14 156.22 8.44 Favored Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 -177.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -123.35 109.94 14.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.358 0.579 . . . . 0.0 111.102 -178.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.544 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 45.3 t-105 -107.16 21.9 16.82 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.092 0.948 . . . . 0.0 108.563 173.336 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.511 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -83.73 -5.27 59.15 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.571 -1.195 . . . . 0.0 112.161 -175.187 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 22.4 m -20.84 30.62 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 118.672 2.841 . . . . 0.0 118.672 -142.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.511 ' H ' ' C ' ' A' ' 20' ' ' CYS . 57.1 m80 -107.65 -83.48 0.54 Allowed 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 159.134 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.4 tttm -154.28 122.33 5.99 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.805 167.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 47.2 t -80.95 91.9 6.09 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 175.016 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 5.7 p -114.2 137.56 22.55 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.028 -169.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -66.64 120.07 7.15 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.508 2.139 . . . . 0.0 112.523 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -111.02 76.88 1.0 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.07 -0.968 . . . . 0.0 108.774 178.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.77 -111.08 3.45 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.263 -0.97 . . . . 0.0 111.833 -172.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.4 ptpp? -97.32 -23.81 15.95 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 117.055 0.428 . . . . 0.0 111.98 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -111.49 168.71 9.33 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.009 0.433 . . . . 0.0 110.978 -176.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.461 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 98.4 m-85 -104.05 143.94 32.23 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.711 176.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 59.6 m-85 -139.55 154.36 47.63 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.443 ' SG ' ' HB ' ' A' ' 5' ' ' ILE . 95.5 m -82.58 105.13 13.37 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.779 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -116.18 157.93 24.06 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.882 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -94.63 87.73 5.18 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 122.022 0.915 . . . . 0.0 110.017 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 . . . . . 0 C--O 1.249 1.033 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.923 -178.974 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.766 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 11.5 t -107.92 151.8 25.3 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -85.88 54.02 2.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.51 0.671 . . . . 0.0 110.531 -176.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 13.6 p -175.19 -175.93 0.88 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.061 176.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.422 ' CG2' ' HB2' ' A' ' 9' ' ' GLU . 77.9 mt -73.09 130.94 35.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.903 0.382 . . . . 0.0 110.114 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.456 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 3.4 pm0 -72.17 159.92 33.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.672 0.748 . . . . 0.0 111.176 -176.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.461 HD23 ' CG ' ' A' ' 22' ' ' HIS . 0.4 OUTLIER -70.3 120.6 16.21 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.017 -171.589 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 112.46 -9.42 26.33 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.616 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.475 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 16.0 mm-40 -89.98 167.23 12.96 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.022 0.439 . . . . 0.0 111.226 -179.201 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.475 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -78.2 142.4 37.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.966 -179.628 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.461 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 24.2 p -128.12 148.77 68.93 Favored Pre-proline 0 C--N 1.318 -0.799 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.44 177.283 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -72.12 150.74 54.46 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.335 2.023 . . . . 0.0 110.621 172.189 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.422 ' OD1' ' HG2' ' A' ' 15' ' ' ARG . 45.2 t-20 -49.67 122.77 13.78 Favored Pre-proline 0 C--N 1.333 -0.119 0 O-C-N 123.659 0.6 . . . . 0.0 110.238 -177.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.467 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 10.1 Cg_endo -51.28 -28.31 26.11 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 124.007 3.138 . . . . 0.0 114.065 -173.631 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.422 ' HG2' ' OD1' ' A' ' 13' ' ' ASN . 14.4 ptm180 -69.85 -18.49 63.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.907 0.384 . . . . 0.0 110.845 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -93.62 -8.54 40.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.374 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.31 86.31 1.91 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.158 -177.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.467 ' OD2' ' HB2' ' A' ' 20' ' ' CYS . 8.5 p-10 -90.09 146.85 24.01 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.976 0.417 . . . . 0.0 111.043 -178.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.491 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 36.7 m95 -107.44 35.67 2.99 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 176.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.592 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -70.97 -6.77 41.3 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 114.668 1.358 . . . . 0.0 114.668 -171.194 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.9 p -17.9 30.1 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 117.952 2.575 . . . . 0.0 117.952 -139.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.592 ' H ' ' C ' ' A' ' 20' ' ' CYS . 77.6 m80 -109.36 -91.65 0.45 Allowed 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 159.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.9 tttm -154.2 129.11 9.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 167.255 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.467 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 42.4 t -89.08 103.13 15.77 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 178.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 28.5 m -115.44 147.68 39.25 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.004 -175.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -75.15 119.41 5.59 Favored 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.44 2.093 . . . . 0.0 111.935 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -110.74 74.96 0.9 Allowed 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 178.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.14 -110.49 3.05 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.036 -1.078 . . . . 0.0 112.177 -177.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -87.98 -16.0 34.94 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -175.17 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -125.31 179.37 5.12 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.086 0.47 . . . . 0.0 111.352 -176.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.461 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 90.8 m-85 -117.58 143.76 45.8 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.169 171.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -138.81 148.82 44.23 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.962 0.41 . . . . 0.0 110.666 -179.127 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 98.4 m -75.86 103.71 6.06 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.598 174.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -113.07 159.22 19.41 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.486 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -94.37 88.74 5.63 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 176.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 . . . . . 0 C--N 1.315 -0.893 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.428 -177.92 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.8 0 N-CA-C 111.983 -0.447 . . . . 0.0 111.983 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.8 t -116.66 158.11 24.31 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 22.9 p90 -75.48 -4.41 39.57 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.412 0.625 . . . . 0.0 110.662 177.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.604 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 62.7 m -106.87 -162.43 0.85 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.301 176.647 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.449 ' HB ' ' HA ' ' A' ' 20' ' ' CYS . 88.3 mt -71.29 136.14 26.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.01 0.433 . . . . 0.0 110.156 177.509 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -62.53 151.4 37.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.203 -178.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.502 HD23 ' CG ' ' A' ' 22' ' ' HIS . 0.9 OUTLIER -76.61 121.96 23.95 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.656 -177.632 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.33 -6.78 42.68 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.908 -175.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -83.77 173.99 10.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.001 0.429 . . . . 0.0 110.875 177.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.52 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 7.3 mpt_? -96.58 142.88 28.11 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.441 177.554 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.3 p -124.61 152.04 68.36 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-O 120.635 0.255 . . . . 0.0 110.989 -177.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.7 151.77 69.46 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.369 2.046 . . . . 0.0 110.755 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.584 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 46.9 t-20 -50.18 116.23 6.3 Favored Pre-proline 0 C--N 1.33 -0.282 0 O-C-N 123.704 0.627 . . . . 0.0 110.33 -178.689 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.557 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 9.9 Cg_endo -52.97 -22.48 18.57 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.505 2.804 . . . . 0.0 114.033 -171.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.482 ' HG3' ' OD1' ' A' ' 13' ' ' ASN . 0.0 OUTLIER -66.77 -14.65 62.86 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 178.864 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.584 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 11.4 pt-20 -107.57 10.3 29.23 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.765 0.317 . . . . 0.0 110.93 177.653 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 98.0 103.56 2.3 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.448 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -101.94 147.5 26.47 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.276 0.56 . . . . 0.0 110.501 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.604 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 1.2 m-90 -108.33 31.12 5.81 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 174.566 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.581 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -74.96 -9.51 58.6 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -169.386 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.9 m -18.75 30.86 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 118.013 2.597 . . . . 0.0 118.013 -141.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.581 ' H ' ' C ' ' A' ' 20' ' ' CYS . 70.5 m80 -104.78 -88.84 0.42 Allowed 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 162.077 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -155.07 120.7 5.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 166.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.557 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 46.3 t -83.57 94.25 8.03 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 174.218 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.0 p -115.84 137.18 23.11 Favored Pre-proline 0 N--CA 1.439 -1.003 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.256 -168.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.08 127.4 23.08 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.721 2.281 . . . . 0.0 112.863 -178.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.52 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 7.1 mm-40 -124.58 91.34 3.42 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.779 176.361 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.8 -111.82 3.49 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.371 -0.919 . . . . 0.0 111.595 -177.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.67 3.52 24.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.85 0.357 . . . . 0.0 110.982 -179.528 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 50.7 mtt180 -126.16 -179.22 4.62 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.166 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -120.73 139.94 52.35 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.786 176.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.52 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 17.7 m-85 -131.9 154.51 49.15 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.372 0.606 . . . . 0.0 110.851 -177.05 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.82 99.67 12.63 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.172 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -110.32 161.31 15.75 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.777 -177.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -102.38 88.34 3.25 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.281 0.562 . . . . 0.0 109.672 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.44 ' HA ' ' OE1' ' A' ' 36' ' ' GLN . 14.6 mm-40 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.442 -0.789 . . . . 0.0 109.844 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.891 0 N-CA-C 111.867 -0.493 . . . . 0.0 111.867 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.426 ' O ' ' HB3' ' A' ' 3' ' ' TYR . 3.7 t -175.65 76.42 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.016 0.436 . . . . 0.0 110.417 -177.625 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.426 ' HB3' ' O ' ' A' ' 2' ' ' THR . 50.6 t80 70.98 -49.01 0.68 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.252 0.621 . . . . 0.0 111.188 -177.118 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 71.9 m -134.86 151.17 50.69 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 173.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 75.5 mt -64.51 123.51 17.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.447 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.4 pm0 -68.09 156.15 38.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.966 0.889 . . . . 0.0 111.975 -172.653 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.47 123.94 20.06 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.134 -1.394 . . . . 0.0 110.952 -174.141 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.65 -14.66 29.65 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.484 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -85.29 168.72 14.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.11 0.481 . . . . 0.0 111.197 -179.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.81 138.22 31.67 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.715 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.46 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 22.4 p -120.03 146.91 43.3 Favored Pre-proline 0 C--N 1.318 -0.788 0 C-N-CA 121.014 -0.275 . . . . 0.0 110.977 -179.018 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -63.68 150.37 88.61 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.287 1.991 . . . . 0.0 109.941 168.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.611 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 45.8 t-20 -49.4 122.6 12.75 Favored Pre-proline 0 C--N 1.329 -0.306 0 O-C-N 123.592 0.558 . . . . 0.0 110.098 -179.369 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.645 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 12.0 Cg_endo -55.02 -17.58 14.77 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 123.3 2.667 . . . . 0.0 113.48 -173.533 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -70.44 -22.0 62.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.97 177.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 12.7 pt-20 -106.75 13.48 27.92 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.045 0.45 . . . . 0.0 110.411 178.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 129.15 126.25 2.83 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.297 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -111.52 107.36 16.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.879 0.371 . . . . 0.0 110.27 -178.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.7 m95 -111.02 11.34 22.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.181 0.515 . . . . 0.0 110.075 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.559 ' C ' ' H ' ' A' ' 22' ' ' HIS . 1.0 OUTLIER -71.49 -4.95 29.52 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -172.636 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 10.7 m -18.24 29.79 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 118.387 2.736 . . . . 0.0 118.387 -139.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.559 ' H ' ' C ' ' A' ' 20' ' ' CYS . 37.0 m80 -106.44 -83.61 0.52 Allowed 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 158.017 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -154.89 123.98 6.29 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.293 167.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.645 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 49.1 t -86.38 91.65 8.58 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 173.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.6 p -114.85 139.74 24.57 Favored Pre-proline 0 C--N 1.313 -1.005 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.926 -169.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -57.62 126.07 20.7 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 122.659 2.239 . . . . 0.0 112.508 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -122.99 76.44 1.37 Allowed 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.08 -111.71 3.49 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.584 -0.817 . . . . 0.0 111.337 -173.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.6 tttp -92.23 -36.27 13.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.216 0.532 . . . . 0.0 110.779 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 87.6 mtt180 -100.89 178.86 4.56 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.328 -174.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 90.2 m-85 -113.39 143.83 43.8 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.754 178.284 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -135.48 148.13 49.11 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.465 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 88.1 m -78.51 101.87 7.58 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 174.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -112.96 160.59 17.93 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.743 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -100.9 88.04 3.45 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 176.338 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.37 -0.824 . . . . 0.0 109.546 -178.472 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.769 0 N-CA-C 112.147 -0.381 . . . . 0.0 112.147 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 54.6 m -86.36 101.29 12.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.424 0.154 . . . . 0.0 111.255 -178.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -66.53 -40.61 89.23 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.43 0.633 . . . . 0.0 109.746 171.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -153.8 158.64 41.19 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.096 -0.956 . . . . 0.0 108.657 178.008 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 93.5 mt -52.98 131.95 15.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 121.287 0.565 . . . . 0.0 111.973 -171.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.2 mp0 -61.29 157.22 16.91 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.324 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.581 HD23 ' CG ' ' A' ' 22' ' ' HIS . 1.1 tm? -79.88 126.59 31.19 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.069 -175.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.95 -7.93 53.42 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.96 -176.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -86.64 174.04 9.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.169 0.509 . . . . 0.0 111.25 -178.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -85.77 143.47 28.29 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.452 176.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 27.0 p -133.63 152.7 79.45 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.698 -179.621 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -77.98 154.07 29.32 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.66 2.24 . . . . 0.0 111.3 173.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -50.31 117.47 7.96 Favored Pre-proline 0 C--O 1.234 0.274 0 O-C-N 123.487 0.492 . . . . 0.0 110.118 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.435 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 18.3 Cg_endo -58.51 -13.68 18.04 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 123.347 2.698 . . . . 0.0 113.491 -172.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -66.79 -21.99 66.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.961 178.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -118.17 21.25 12.85 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.862 0.363 . . . . 0.0 111.486 -177.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 130.8 98.0 0.78 Allowed Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.542 178.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -92.18 106.91 18.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.971 0.415 . . . . 0.0 110.578 177.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 39.4 m95 -113.47 28.12 9.03 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.806 0.812 . . . . 0.0 109.174 178.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.592 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -85.15 -5.87 59.32 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.471 -170.73 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.6 p -14.25 29.76 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 117.796 2.517 . . . . 0.0 117.796 -139.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.592 ' H ' ' C ' ' A' ' 20' ' ' CYS . 72.9 m80 -111.22 -92.82 0.45 Allowed 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 164.032 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.2 tttm -155.22 118.41 4.4 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 165.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.435 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 42.2 t -82.2 102.4 11.1 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 174.703 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 9.9 p -121.6 136.09 25.7 Favored Pre-proline 0 N--CA 1.438 -1.065 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.52 -169.158 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -64.0 119.75 6.89 Favored 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 122.472 2.115 . . . . 0.0 112.25 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.408 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 5.7 mm-40 -113.74 76.91 1.01 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.293 -0.867 . . . . 0.0 108.73 178.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.6 -111.6 3.51 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.314 -0.946 . . . . 0.0 111.991 -174.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.51 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 18.3 ptpt -102.05 -8.3 21.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.887 0.343 . . . . 0.0 111.912 -175.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.51 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 95.4 mtt180 -127.97 171.64 11.64 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.843 0.354 . . . . 0.0 110.272 -178.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.409 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 93.1 m-85 -110.1 139.99 44.64 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.388 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.408 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 62.4 m-85 -134.73 151.8 51.27 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.736 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -86.0 103.93 15.15 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.116 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -115.17 158.82 21.71 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.151 -175.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -100.28 91.46 4.74 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.753 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.565 -0.731 . . . . 0.0 109.565 179.221 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.785 0 N-CA-C 112.196 -0.362 . . . . 0.0 112.196 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.1 m 66.27 66.51 0.47 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.578 0.704 . . . . 0.0 110.452 -177.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 29.2 p90 -69.85 -28.95 66.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.999 173.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 65.0 m -127.3 142.33 51.49 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 171.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.471 HG22 ' HB2' ' A' ' 9' ' ' GLU . 75.7 mt -65.69 135.26 28.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.154 -176.152 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.7 mp0 -56.44 145.36 27.85 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 121.524 0.678 . . . . 0.0 111.307 -178.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.491 HD23 ' ND1' ' A' ' 22' ' ' HIS . 1.5 tm? -68.82 121.29 16.24 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.653 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 109.21 -8.34 33.05 Favored Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.139 -176.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.471 ' HB2' HG22 ' A' ' 5' ' ' ILE . 61.8 mm-40 -86.99 175.76 7.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.019 0.438 . . . . 0.0 110.969 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -91.53 144.85 25.13 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.132 179.245 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 9.4 p -129.46 147.17 64.05 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.65 179.03 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -68.78 160.53 49.22 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.202 1.935 . . . . 0.0 110.199 171.18 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.3 t-20 -49.74 117.78 7.69 Favored Pre-proline 0 C--O 1.234 0.285 0 O-C-N 123.36 0.412 . . . . 0.0 110.442 -176.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.488 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 13.5 Cg_endo -57.67 -18.69 34.39 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.523 2.815 . . . . 0.0 113.918 -173.527 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 -66.96 -24.04 66.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.87 0.367 . . . . 0.0 110.144 177.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -89.59 -3.7 58.18 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.087 177.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 137.23 134.71 3.29 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.477 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -110.73 106.51 15.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.375 0.587 . . . . 0.0 109.905 -179.089 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -103.29 9.34 38.1 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.486 0.66 . . . . 0.0 109.794 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.671 ' SG ' ' HB2' ' A' ' 24' ' ' CYS . 8.4 m -73.74 -2.8 24.88 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 124.184 0.993 . . . . 0.0 113.372 -175.015 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.8 m -17.0 29.7 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 118.309 2.707 . . . . 0.0 118.309 -138.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.554 ' H ' ' C ' ' A' ' 20' ' ' CYS . 32.1 m80 -104.51 -86.66 0.45 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 156.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.6 tttm -155.73 120.02 4.59 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 120.414 0.15 . . . . 0.0 110.657 169.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.671 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 41.9 t -85.07 110.17 18.75 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 175.618 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.1 m -124.52 158.91 60.13 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.338 -173.277 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -81.47 119.71 3.44 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 122.552 2.168 . . . . 0.0 112.034 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.421 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 6.5 mm-40 -110.57 75.31 0.92 Allowed 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 177.184 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 75.75 -111.65 3.38 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.921 -175.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.468 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 22.5 pttm -84.21 -28.68 27.13 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -176.226 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.468 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 62.4 mtt-85 -118.38 171.35 8.21 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.996 0.427 . . . . 0.0 110.995 -175.437 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.529 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 97.1 m-85 -107.32 145.1 33.23 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.899 177.499 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.421 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 37.5 m-85 -136.77 149.01 47.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.452 -179.214 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 85.0 m -79.3 102.78 8.81 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 175.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -115.09 161.48 18.32 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 -179.146 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -103.93 88.26 2.99 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.2 mm-40 . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.349 -179.619 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.78 0 N-CA-C 111.758 -0.537 . . . . 0.0 111.758 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.1 t -161.01 130.61 4.85 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -179.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 50.4 p90 -98.21 132.13 43.98 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.584 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.543 ' HA ' ' O ' ' A' ' 19' ' ' TRP . 36.3 m 67.05 116.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.524 -172.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.17 138.25 23.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.182 -174.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.0 mp0 -55.58 141.31 37.84 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.074 -177.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.82 120.0 15.77 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.377 -177.475 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 111.46 -14.14 27.75 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.093 -175.092 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -84.53 165.16 18.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.989 0.423 . . . . 0.0 111.228 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.441 ' H ' ' HD3' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -78.99 145.9 33.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.475 175.262 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 7.6 p -125.42 137.95 30.85 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.712 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -57.57 157.53 22.65 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.654 2.236 . . . . 0.0 111.072 172.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -49.86 114.08 3.92 Favored Pre-proline 0 C--O 1.231 0.123 0 O-C-N 123.526 0.516 . . . . 0.0 110.456 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -57.89 -19.41 39.35 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 123.208 2.605 . . . . 0.0 113.616 -172.281 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -68.28 -19.7 64.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.748 0.309 . . . . 0.0 110.733 177.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -89.3 -8.82 52.55 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.964 0.411 . . . . 0.0 110.342 178.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 136.26 112.07 1.15 Allowed Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 111.603 -0.599 . . . . 0.0 111.603 -176.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -86.64 113.11 22.25 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.964 0.411 . . . . 0.0 110.541 -178.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.543 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 3.0 m0 -111.86 26.4 10.66 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 174.256 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.559 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -84.84 -6.02 59.34 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.88 -171.284 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.4 m -18.57 29.52 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 118.207 2.669 . . . . 0.0 118.207 -138.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.559 ' H ' ' C ' ' A' ' 20' ' ' CYS . 42.7 m80 -107.41 -90.83 0.43 Allowed 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 158.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -156.03 126.66 6.79 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 168.32 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.497 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 50.2 t -90.44 100.2 13.08 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 176.559 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.6 m -109.79 146.34 33.89 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-O 121.094 0.473 . . . . 0.0 111.656 -174.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.13 121.68 5.43 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.73 2.286 . . . . 0.0 112.188 178.066 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -118.86 90.3 3.31 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 176.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.42 -110.87 3.4 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.313 -0.946 . . . . 0.0 111.422 -174.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.5 tttp -104.65 -16.93 14.85 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.011 0.434 . . . . 0.0 110.869 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -111.38 167.08 10.58 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.929 -173.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.497 ' HB3' ' SG ' ' A' ' 24' ' ' CYS . 96.3 m-85 -110.49 140.75 44.45 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.014 177.24 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -135.55 149.14 49.36 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.015 0.436 . . . . 0.0 110.633 -179.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -85.84 107.44 17.67 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.533 -176.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -122.02 158.56 28.89 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.379 -174.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -97.7 88.65 4.39 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.911 0.862 . . . . 0.0 109.914 177.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 . . . . . 0 C--O 1.246 0.915 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.453 -178.586 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.638 0 N-CA-C 112.183 -0.367 . . . . 0.0 112.183 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.6 t -175.86 152.98 1.3 Allowed 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 178.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 12.2 p90 -85.41 20.44 2.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.699 0.762 . . . . 0.0 110.525 175.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.585 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 62.5 m -132.73 -161.7 1.16 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 178.353 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.402 ' HB ' ' HA ' ' A' ' 20' ' ' CYS . 89.1 mt -64.73 130.27 29.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 118.152 0.433 . . . . 0.0 110.107 178.197 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.417 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 14.4 mm-40 -59.47 147.64 35.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.233 -177.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.447 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.7 OUTLIER -74.27 115.79 14.17 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.944 -175.248 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.5 -18.55 11.88 Favored Glycine 0 N--CA 1.445 -0.717 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.998 -174.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.421 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 8.2 mm-40 -75.91 166.63 23.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.036 0.446 . . . . 0.0 111.04 -179.121 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.421 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -84.77 138.24 32.72 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 176.304 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 23.1 p -117.81 148.55 43.45 Favored Pre-proline 0 C--N 1.316 -0.88 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.197 -178.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.23 154.46 69.8 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.684 2.256 . . . . 0.0 110.93 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.597 ' OD1' ' HG2' ' A' ' 15' ' ' ARG . 47.5 t-20 -51.99 116.92 8.99 Favored Pre-proline 0 C--O 1.233 0.196 0 O-C-N 123.699 0.624 . . . . 0.0 110.543 -177.013 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.448 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 14.5 Cg_endo -56.62 -20.57 34.91 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.442 2.761 . . . . 0.0 114.129 -172.678 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.597 ' HG2' ' OD1' ' A' ' 13' ' ' ASN . 10.1 ptm180 -64.45 -23.99 67.47 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 121.045 -0.262 . . . . 0.0 111.046 177.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -92.11 0.48 57.46 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.908 0.385 . . . . 0.0 110.641 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 99.89 94.55 2.11 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.812 -0.709 . . . . 0.0 111.877 -177.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.412 ' HB3' ' HA ' ' A' ' 14' ' ' PRO . 9.2 p-10 -86.83 147.59 25.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.101 0.477 . . . . 0.0 110.679 -179.278 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.585 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 26.0 m95 -111.74 36.26 3.35 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 176.004 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.574 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -79.4 -6.97 58.0 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.329 -1.305 . . . . 0.0 113.179 -171.659 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.9 m -17.77 31.24 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 118.077 2.621 . . . . 0.0 118.077 -141.551 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.574 ' H ' ' C ' ' A' ' 20' ' ' CYS . 69.0 m80 -109.35 -87.98 0.5 Allowed 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 161.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -154.6 124.22 6.56 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.158 167.11 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.448 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 44.9 t -84.97 90.78 7.9 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 172.313 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.7 p -106.7 132.09 21.18 Favored Pre-proline 0 N--CA 1.44 -0.946 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.782 -168.084 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -67.36 119.82 6.85 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.441 2.094 . . . . 0.0 112.726 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -113.38 85.23 2.15 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.897 -1.047 . . . . 0.0 108.941 177.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 79.23 -111.15 3.19 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 119.945 -1.121 . . . . 0.0 111.326 -175.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -94.44 -30.19 14.58 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.093 0.473 . . . . 0.0 110.88 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -98.85 174.17 6.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.224 -173.09 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -117.06 137.78 52.03 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.414 174.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -130.89 150.44 52.05 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.009 0.433 . . . . 0.0 110.173 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -85.52 100.63 12.04 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.394 -178.463 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.0 mmm180 -119.91 163.66 17.22 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.193 -175.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -107.5 89.68 3.07 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.827 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 . . . . . 0 C--O 1.246 0.878 0 CA-C-O 118.516 -0.754 . . . . 0.0 110.119 -179.438 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.791 0 N-CA-C 112.013 -0.435 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.514 HG23 ' H ' ' A' ' 4' ' ' CYS . 9.9 t -101.32 179.05 4.47 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.196 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 27.4 p90 -74.77 10.56 1.35 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.335 0.588 . . . . 0.0 111.727 -178.149 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.514 ' H ' HG23 ' A' ' 2' ' ' THR . 76.0 m -145.88 -173.69 4.22 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 176.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 89.2 mt -70.65 134.24 30.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 176.015 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -58.48 145.97 37.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.534 0.683 . . . . 0.0 110.796 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.484 ' HA ' HD22 ' A' ' 7' ' ' LEU . 0.7 OUTLIER -74.48 121.86 22.14 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.563 -176.769 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.25 -6.5 34.36 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.354 -174.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -86.17 168.74 13.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.101 0.477 . . . . 0.0 111.629 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.431 ' HD2' ' N ' ' A' ' 11' ' ' CYS . 2.3 tmm_? -88.52 127.85 35.54 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.161 177.647 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.431 ' N ' ' HD2' ' A' ' 10' ' ' ARG . 25.7 p -113.37 151.03 44.04 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-O 120.636 0.255 . . . . 0.0 111.315 -174.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.34 146.99 64.53 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.591 2.194 . . . . 0.0 110.87 173.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.6 t-20 -50.39 120.07 11.88 Favored Pre-proline 0 C--O 1.231 0.129 0 O-C-N 123.708 0.63 . . . . 0.0 110.112 -177.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.535 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 14.5 Cg_endo -56.44 -21.0 35.4 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 123.308 2.672 . . . . 0.0 113.589 -174.364 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.18 -18.0 63.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.846 0.355 . . . . 0.0 110.303 177.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -101.08 -4.68 26.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.566 178.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.63 107.72 3.23 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.159 -177.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -109.87 146.77 34.54 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.04 0.448 . . . . 0.0 110.39 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 2.1 m-90 -108.73 33.82 4.01 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 177.004 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.577 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -78.41 -9.29 59.23 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -169.379 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.7 p -19.29 29.93 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 118.231 2.678 . . . . 0.0 118.231 -140.175 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.577 ' H ' ' C ' ' A' ' 20' ' ' CYS . 66.7 m80 -103.03 -87.6 0.42 Allowed 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 161.395 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.413 ' HE3' ' N ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -155.39 117.7 4.18 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 167.96 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.535 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 45.5 t -82.76 93.37 7.41 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 169.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.1 p -112.62 137.9 21.86 Favored Pre-proline 0 C--N 1.313 -1.013 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.336 -166.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -66.7 119.27 6.28 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.254 1.969 . . . . 0.0 111.91 178.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -116.72 76.91 1.06 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.36 -0.837 . . . . 0.0 108.863 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.56 -111.7 3.46 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.105 -1.045 . . . . 0.0 111.598 -175.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.7 pttm -99.59 -12.0 20.49 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -176.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -120.84 175.16 6.18 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.01 0.434 . . . . 0.0 111.123 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -113.33 137.19 51.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.51 173.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -133.67 152.32 51.86 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.057 0.456 . . . . 0.0 109.871 179.25 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -83.28 101.66 11.43 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.301 -178.466 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -114.87 160.46 19.47 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.316 -177.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -109.67 88.68 2.8 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.07 0.462 . . . . 0.0 110.266 178.221 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.399 -0.81 . . . . 0.0 109.293 176.473 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.647 0 N-CA-C 111.765 -0.534 . . . . 0.0 111.765 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.9 t -169.26 151.52 4.64 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -85.85 73.37 10.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.167 0.508 . . . . 0.0 109.923 -179.431 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.662 ' HA ' ' O ' ' A' ' 19' ' ' TRP . 33.3 m 68.66 132.85 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.779 -1.101 . . . . 0.0 111.55 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 86.6 mt -72.56 137.97 22.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.347 -176.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -55.28 138.48 45.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.231 177.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.463 ' HA ' HD22 ' A' ' 7' ' ' LEU . 1.3 tm? -70.06 121.96 18.47 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.16 -173.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 111.25 -16.19 27.37 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.134 -176.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.401 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 18.1 mm-40 -78.71 168.71 19.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.903 0.382 . . . . 0.0 110.898 -179.734 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.401 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -74.73 151.71 39.16 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 176.047 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.57 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 11.7 t -140.04 139.99 22.79 Favored Pre-proline 0 C--N 1.314 -0.942 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.24 -174.656 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -71.93 158.79 51.97 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.532 2.155 . . . . 0.0 110.86 176.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -53.22 115.73 8.13 Favored Pre-proline 0 C--N 1.331 -0.225 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.44 -24.95 46.11 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 123.454 2.769 . . . . 0.0 113.621 -172.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 17.4 ptt180 -71.22 -17.83 62.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.837 0.351 . . . . 0.0 110.405 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -98.9 -0.59 41.99 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.575 179.414 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 135.16 93.93 0.44 Allowed Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.959 -0.638 . . . . 0.0 111.971 -177.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -81.54 124.79 29.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.603 0.239 . . . . 0.0 110.649 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.662 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 20.5 m95 -118.89 12.23 12.81 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-O 120.988 0.423 . . . . 0.0 109.938 174.601 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.583 ' C ' ' H ' ' A' ' 22' ' ' HIS . 38.8 t -73.65 -6.49 47.05 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -170.187 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.7 m -15.88 31.85 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 117.566 2.432 . . . . 0.0 117.566 -138.473 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.583 ' H ' ' C ' ' A' ' 20' ' ' CYS . 72.8 m80 -108.37 -88.07 0.48 Allowed 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 163.076 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.7 tttm -156.49 119.65 4.19 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 165.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.2 t -86.03 107.95 18.02 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.1 m -120.79 149.65 51.09 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-O 121.001 0.429 . . . . 0.0 111.553 -173.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -70.74 122.88 9.27 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.601 2.201 . . . . 0.0 112.397 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.465 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 6.9 mm-40 -119.26 75.71 1.07 Allowed 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.182 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.76 -111.16 3.28 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.348 -0.93 . . . . 0.0 112.189 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -83.05 -29.93 28.44 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -177.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -126.46 171.65 10.86 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.045 0.45 . . . . 0.0 111.016 -174.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.57 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 87.4 m-85 -98.02 148.87 23.06 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.369 176.245 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.465 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 11.7 m-85 -133.18 156.28 47.77 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 -179.085 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 4.6 t -88.34 103.38 15.76 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -179.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.441 ' HB3' HE22 ' A' ' 36' ' ' GLN . 30.5 mmt180 -116.55 163.39 16.15 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.751 -176.161 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -104.76 88.31 2.88 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.231 0.538 . . . . 0.0 111.551 -178.157 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.441 HE22 ' HB3' ' A' ' 34' ' ' ARG . 2.5 mp0 . . . . . 0 C--O 1.252 1.193 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.558 172.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.563 0 N-CA-C 112.055 -0.418 . . . . 0.0 112.055 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.4 ' CG2' ' HA ' ' A' ' 6' ' ' GLU . 8.4 t -136.07 60.54 1.67 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.449 0.642 . . . . 0.0 109.98 178.119 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 72.07 -48.36 0.68 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.896 -175.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.617 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 71.4 m -142.57 -156.87 0.72 Allowed 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 175.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 81.2 mt -58.52 135.01 23.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 CA-C-O 121.209 0.528 . . . . 0.0 111.099 -178.431 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.456 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 11.4 mp0 -60.43 152.89 24.42 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.89 -177.105 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.522 HD23 ' CG ' ' A' ' 22' ' ' HIS . 1.2 tm? -74.32 117.66 16.38 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.939 -177.288 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.9 -14.5 29.04 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.806 -0.633 . . . . 0.0 112.013 -176.125 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.471 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 12.7 mm-40 -78.72 167.32 21.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.041 0.448 . . . . 0.0 110.619 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.471 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -82.21 145.16 30.2 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.372 177.222 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.556 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 15.1 p -125.34 147.29 57.14 Favored Pre-proline 0 C--N 1.313 -0.992 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.244 177.249 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PRO . . . . . 0.541 ' HG3' ' CZ3' ' A' ' 19' ' ' TRP . 56.0 Cg_endo -68.98 159.42 54.03 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.398 2.065 . . . . 0.0 110.29 174.516 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -52.54 115.62 7.39 Favored Pre-proline 0 C--N 1.328 -0.353 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -54.67 -22.33 28.36 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.303 2.668 . . . . 0.0 113.79 -171.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -70.13 -20.27 63.18 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.982 179.347 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -97.57 -1.76 43.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.601 0.239 . . . . 0.0 111.059 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 135.93 118.72 1.82 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.797 -178.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -102.0 107.27 18.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.984 0.421 . . . . 0.0 111.141 -177.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.617 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 1.7 m0 -106.95 21.39 17.63 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 173.242 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.533 ' O ' ' N ' ' A' ' 22' ' ' HIS . 3.8 t -81.41 -8.54 59.75 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.412 -1.267 . . . . 0.0 111.803 -170.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 20.3 m -21.93 31.13 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 118.591 2.811 . . . . 0.0 118.591 -142.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.533 ' N ' ' O ' ' A' ' 20' ' ' CYS . 77.4 m80 -104.43 -88.29 0.43 Allowed 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 161.624 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -156.32 118.79 4.06 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 163.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.412 ' HB2' ' CB ' ' A' ' 20' ' ' CYS . 48.9 t -83.92 97.56 9.3 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.619 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.415 ' HA ' ' HD3' ' A' ' 26' ' ' PRO . 18.2 m -109.07 145.6 32.09 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.1 -176.636 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 25' ' ' VAL . 3.5 Cg_exo -71.46 119.8 6.51 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.465 2.11 . . . . 0.0 111.492 176.766 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -110.79 76.81 1.0 Allowed 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 176.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.12 -111.68 3.43 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.475 -0.869 . . . . 0.0 111.088 -173.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -99.82 -13.62 19.14 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.182 0.515 . . . . 0.0 110.648 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -106.56 176.1 5.28 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.942 -177.155 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.556 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 87.7 m-85 -126.96 141.66 51.74 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 176.362 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -137.71 148.4 45.63 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.002 0.43 . . . . 0.0 111.189 -178.352 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.439 ' O ' HD22 ' A' ' 7' ' ' LEU . 55.6 m -79.37 101.4 8.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.684 174.7 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -107.89 154.67 21.25 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.215 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -89.87 88.84 7.49 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.512 177.491 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 . . . . . 0 C--O 1.245 0.855 0 CA-C-O 118.192 -0.909 . . . . 0.0 110.029 -178.331 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.576 0 N-CA-C 112.222 -0.351 . . . . 0.0 112.222 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.1 t -153.83 40.04 0.49 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.846 0.832 . . . . 0.0 109.265 178.347 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 81.3 t80 72.6 -52.19 0.7 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 114.48 -1.236 . . . . 0.0 110.755 -174.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 19' ' ' TRP . 63.2 m -96.68 144.57 26.58 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 177.483 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.456 HG13 ' HB2' ' A' ' 19' ' ' TRP . 79.8 mt -81.34 133.61 28.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 -178.701 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.427 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 1.5 pm0 -70.16 157.26 37.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.797 0.808 . . . . 0.0 111.648 -174.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.544 HD23 ' ND1' ' A' ' 22' ' ' HIS . 0.4 OUTLIER -67.06 123.71 20.99 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.913 -172.94 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.68 -9.51 34.88 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.524 179.224 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.454 ' HB2' HG22 ' A' ' 5' ' ' ILE . 32.2 mm-40 -84.32 170.84 13.23 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.986 0.422 . . . . 0.0 111.12 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.578 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 5.3 mpt_? -89.92 137.9 31.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.55 -179.843 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.577 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 17.2 p -124.72 149.21 61.67 Favored Pre-proline 0 C--N 1.318 -0.794 0 CA-C-O 120.564 0.221 . . . . 0.0 110.865 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -71.05 151.58 61.85 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.132 1.888 . . . . 0.0 110.127 170.357 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -49.54 124.27 14.97 Favored Pre-proline 0 C--N 1.332 -0.192 0 O-C-N 123.63 0.581 . . . . 0.0 109.638 -179.02 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.478 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 9.2 Cg_endo -51.71 -22.3 13.01 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 123.739 2.959 . . . . 0.0 113.757 -174.469 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -68.55 -20.03 64.52 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.8 0.333 . . . . 0.0 110.551 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -92.24 -7.78 47.2 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.629 175.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 104.64 96.49 2.42 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.264 -178.043 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -94.22 147.71 22.91 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.818 0.342 . . . . 0.0 110.175 179.081 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.489 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 20.6 m95 -111.48 21.35 16.28 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 175.416 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.567 ' C ' ' H ' ' A' ' 22' ' ' HIS . 4.7 m -56.75 -5.81 0.26 Allowed 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 115.592 1.701 . . . . 0.0 115.592 -174.46 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.1 m -17.21 30.33 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 118.181 2.66 . . . . 0.0 118.181 -140.081 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' HIS . . . . . 0.567 ' H ' ' C ' ' A' ' 20' ' ' CYS . 24.6 m80 -109.55 -85.37 0.54 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 158.69 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.6 tttm -156.64 131.14 8.73 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 121.353 -0.139 . . . . 0.0 110.7 167.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.524 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 50.4 t -90.44 105.69 17.98 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 176.619 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 31.6 m -116.5 147.38 39.55 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.462 -173.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -73.78 119.65 6.0 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.527 2.151 . . . . 0.0 112.415 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -115.19 75.76 0.96 Allowed 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.209 177.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.22 -111.28 3.81 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.235 -178.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 8.4 ptpp? -71.17 -32.73 69.27 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -175.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -127.27 -179.57 4.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.924 0.392 . . . . 0.0 110.998 -172.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.577 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 62.4 m-85 -111.93 147.24 36.28 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 175.117 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.429 ' CZ ' ' HG3' ' A' ' 10' ' ' ARG . 30.5 m-85 -136.42 144.03 44.26 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.799 0.333 . . . . 0.0 110.797 -178.158 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.438 ' SG ' ' HB3' ' A' ' 11' ' ' CYS . 73.0 m -76.5 103.9 6.73 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.521 176.362 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -119.02 163.63 16.68 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.488 -178.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -104.8 88.95 3.03 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.23 0.538 . . . . 0.0 110.507 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.237 -0.887 . . . . 0.0 109.787 178.238 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.476 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 61.7 m . . . . . 0 N--CA 1.453 -0.302 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 71.9 mt -63.11 130.56 27.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.415 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 1.3 pm0 -68.01 154.74 40.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.769 0.795 . . . . 0.0 111.701 -173.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.522 HD23 ' ND1' ' A' ' 22' ' ' HIS . 0.4 OUTLIER -66.67 120.48 13.54 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.606 -173.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.465 ' HA2' ' NH1' ' A' ' 34' ' ' ARG . . . 116.57 -15.38 14.69 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.772 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.557 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 16.6 mm-40 -84.82 165.92 17.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.195 0.522 . . . . 0.0 111.61 -177.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.557 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -82.57 141.88 32.23 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.735 179.361 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.52 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 18.6 p -126.56 153.33 75.3 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.76 178.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -70.14 169.11 20.18 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.498 2.132 . . . . 0.0 110.853 172.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.431 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 46.8 t-20 -50.02 119.89 10.9 Favored Pre-proline 0 C--N 1.328 -0.348 0 O-C-N 123.351 0.407 . . . . 0.0 110.797 -178.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.431 ' HD2' ' HA ' ' A' ' 13' ' ' ASN . 11.7 Cg_endo -56.41 -16.08 17.13 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 123.886 3.057 . . . . 0.0 113.938 -175.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.412 ' HG2' ' OD1' ' A' ' 13' ' ' ASN . 23.8 mmt180 -63.88 -21.53 66.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.084 0.469 . . . . 0.0 110.39 176.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -81.42 -10.3 59.54 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.653 177.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 120.33 135.88 5.04 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 111.514 -0.635 . . . . 0.0 111.514 -177.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -77.64 103.88 7.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.282 0.541 . . . . 0.0 110.327 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.476 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 5.3 m-90 -94.55 8.42 42.29 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-O 121.995 0.902 . . . . 0.0 109.093 172.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.522 ' C ' ' H ' ' A' ' 22' ' ' HIS . 56.1 m -84.75 -2.34 57.5 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 113.903 -1.499 . . . . 0.0 112.087 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.8 m -18.56 28.28 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 118.737 2.866 . . . . 0.0 118.737 -138.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.522 ' H ' ' C ' ' A' ' 20' ' ' CYS . 49.7 m80 -94.77 -82.39 0.37 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 153.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -155.26 131.34 10.15 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.192 165.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.439 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 43.3 t -87.01 100.21 12.45 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 170.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 4.9 p -121.93 138.96 29.43 Favored Pre-proline 0 C--N 1.312 -1.041 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.548 -166.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -66.51 120.02 7.1 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.385 2.056 . . . . 0.0 112.394 177.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -119.87 84.36 2.2 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.284 -0.871 . . . . 0.0 108.809 177.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 85.02 -110.93 3.45 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.207 -0.997 . . . . 0.0 111.927 -174.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.407 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 0.9 OUTLIER -106.63 -7.94 17.16 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.374 -0.486 . . . . 0.0 111.969 -177.352 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.407 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 93.1 mtt180 -119.27 172.5 7.56 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.011 0.434 . . . . 0.0 110.6 -178.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.408 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 91.1 m-85 -109.59 140.53 43.29 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.476 -0.784 . . . . 0.0 108.962 173.179 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -136.37 149.54 48.38 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.818 0.342 . . . . 0.0 110.621 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 65.9 m -78.52 96.49 5.44 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 173.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.465 ' NH1' ' HA2' ' A' ' 8' ' ' GLY . 40.4 mmt180 -119.03 165.3 14.29 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.132 -175.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -103.09 86.96 2.79 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 170.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 . . . . . 0 C--O 1.246 0.885 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.766 -170.798 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.52 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 20.1 p . . . . . 0 N--CA 1.469 0.476 0 N-CA-C 110.916 -0.031 . . . . 0.0 110.916 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.409 ' HB ' ' SG ' ' A' ' 33' ' ' CYS . 79.6 mt -77.09 133.48 30.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 178.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.483 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 2.4 pm0 -66.0 149.46 50.21 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 121.841 0.829 . . . . 0.0 110.61 -178.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.478 HD23 ' CG ' ' A' ' 22' ' ' HIS . 0.8 OUTLIER -68.78 121.35 16.34 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.726 -1.124 . . . . 0.0 110.682 -171.468 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.427 ' HA2' ' NH1' ' A' ' 34' ' ' ARG . . . 118.61 -21.33 9.83 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.834 -179.212 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.483 ' CG ' ' HG2' ' A' ' 6' ' ' GLU . 14.1 mm-40 -83.09 170.9 14.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.091 0.472 . . . . 0.0 111.64 -175.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.447 ' N ' ' HD3' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -81.94 143.48 31.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.205 179.316 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.446 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 14.2 p -122.76 149.58 56.48 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.347 177.136 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.36 159.88 51.44 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.308 2.005 . . . . 0.0 110.347 172.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 50.5 t-20 -50.61 117.2 7.9 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.46 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 11.6 Cg_endo -55.61 -27.69 61.67 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 123.372 2.715 . . . . 0.0 114.023 -171.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.74 -12.78 60.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.209 0.528 . . . . 0.0 110.494 178.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -105.49 13.82 29.55 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.152 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.17 107.3 2.05 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.248 -179.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -96.72 116.99 30.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.779 0.323 . . . . 0.0 110.859 -178.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.52 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 35.6 m95 -116.92 20.95 13.62 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 176.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.577 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -80.02 -6.93 58.47 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -171.348 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.7 p -18.06 30.94 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 118.088 2.625 . . . . 0.0 118.088 -141.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.577 ' H ' ' C ' ' A' ' 20' ' ' CYS . 76.9 m80 -113.07 -83.98 0.59 Allowed 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 162.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -154.04 125.24 7.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.03 167.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.504 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 45.4 t -88.02 88.58 7.69 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 172.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 5.8 p -107.98 135.4 19.86 Favored Pre-proline 0 N--CA 1.44 -0.971 0 CA-C-N 115.074 -0.967 . . . . 0.0 109.895 -168.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -67.24 119.13 6.13 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.237 1.958 . . . . 0.0 112.209 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -105.27 76.74 1.25 Allowed 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.92 -110.33 3.3 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.099 -1.048 . . . . 0.0 110.647 -169.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -94.95 -34.37 12.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.939 0.399 . . . . 0.0 111.06 179.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -92.56 171.1 9.24 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.977 0.417 . . . . 0.0 111.087 -172.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.504 ' HB3' ' SG ' ' A' ' 24' ' ' CYS . 94.0 m-85 -114.64 140.67 48.63 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.115 177.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -137.68 147.81 45.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.201 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.409 ' SG ' ' HB ' ' A' ' 5' ' ' ILE . 95.2 m -78.2 101.29 7.01 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 175.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.427 ' NH1' ' HA2' ' A' ' 8' ' ' GLY . 25.9 mmt180 -113.56 160.55 18.41 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.339 179.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -103.13 88.1 3.06 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 . . . . . 0 C--O 1.246 0.879 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.273 -173.775 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 82.3 m . . . . . 0 N--CA 1.45 -0.429 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.448 HG13 ' HB2' ' A' ' 19' ' ' TRP . 91.4 mt -67.29 130.15 32.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.937 -177.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.517 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.5 pm0 -66.19 149.97 49.5 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.234 -0.893 . . . . 0.0 111.423 -176.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.4 OUTLIER -65.18 121.23 14.28 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.549 -1.205 . . . . 0.0 111.039 -172.758 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 113.73 -11.72 23.08 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.003 -0.617 . . . . 0.0 112.551 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -87.14 168.33 13.35 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.364 0.602 . . . . 0.0 111.939 -179.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.488 ' HD2' ' O ' ' A' ' 31' ' ' PHE . 9.0 mmm180 -81.07 139.51 35.65 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.377 177.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.545 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 17.9 p -121.48 142.28 35.21 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.942 178.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -62.04 144.49 96.21 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 122.13 1.886 . . . . 0.0 110.117 169.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.588 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 3.2 m-20 -49.37 123.8 13.87 Favored Pre-proline 0 C--N 1.328 -0.338 0 O-C-N 123.787 0.679 . . . . 0.0 110.622 -178.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.588 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 9.2 Cg_endo -52.51 -21.6 14.54 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 123.543 2.829 . . . . 0.0 113.53 -174.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.544 ' HD3' ' N ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -59.56 -22.06 61.19 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 175.903 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 10.2 pt-20 -118.36 19.34 13.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.921 0.391 . . . . 0.0 111.14 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 96.96 110.32 2.72 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.992 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -113.65 133.7 55.16 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 176.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.448 ' HB2' HG13 ' A' ' 5' ' ' ILE . 1.1 m95 -101.13 22.45 12.31 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.59 ' C ' ' H ' ' A' ' 22' ' ' HIS . 1.6 m -57.57 -6.25 0.46 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 -175.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 16.2 m -17.34 31.54 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 117.753 2.501 . . . . 0.0 117.753 -140.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.59 ' H ' ' C ' ' A' ' 20' ' ' CYS . 71.0 m80 -112.35 -84.4 0.58 Allowed 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 160.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -154.15 127.03 8.23 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.396 169.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.588 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 42.9 t -88.23 89.92 8.18 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 172.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.7 p -109.29 138.99 20.63 Favored Pre-proline 0 N--CA 1.439 -0.98 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.96 -169.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -65.89 119.07 6.04 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.137 1.892 . . . . 0.0 111.857 178.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.449 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 7.3 mm-40 -113.26 77.28 1.04 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.023 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.92 -110.42 3.31 Favored Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 119.972 -1.108 . . . . 0.0 111.566 -176.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.482 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 10.3 ptpp? -99.5 -5.67 28.88 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -175.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.482 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 96.2 mtt180 -136.38 178.3 7.17 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.617 0.246 . . . . 0.0 110.553 -177.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.488 ' O ' ' HD2' ' A' ' 10' ' ' ARG . 69.4 m-85 -112.46 142.99 44.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.694 178.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.449 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 55.4 m-85 -138.5 151.41 47.35 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.096 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 70.8 m -78.67 103.71 8.79 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 174.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -117.02 161.33 19.57 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.217 -178.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -100.68 88.18 3.54 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.31 0.576 . . . . 0.0 109.639 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.536 -0.745 . . . . 0.0 109.77 179.486 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 14.2 p . . . . . 0 N--CA 1.451 -0.404 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 77.1 mt -79.95 134.03 28.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -78.69 160.76 27.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.514 0.673 . . . . 0.0 111.339 -177.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.482 HD23 ' ND1' ' A' ' 22' ' ' HIS . 0.5 OUTLIER -63.66 127.22 30.38 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.793 -174.457 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.71 -9.48 44.36 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 115.715 -0.675 . . . . 0.0 113.077 177.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -91.6 175.34 6.94 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.013 0.435 . . . . 0.0 111.447 -177.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.5 mmt85 -80.18 150.52 30.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.44 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.516 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 26.4 p -136.58 148.66 64.62 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.865 175.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.29 149.37 45.29 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.238 1.959 . . . . 0.0 110.581 171.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.406 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 51.2 t-20 -48.98 120.39 9.42 Favored Pre-proline 0 C--N 1.33 -0.244 0 O-C-N 123.809 0.693 . . . . 0.0 110.637 -178.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.575 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 14.3 Cg_endo -56.08 -16.52 16.97 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.617 2.878 . . . . 0.0 113.435 -175.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -61.61 -31.7 71.78 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.729 0.299 . . . . 0.0 110.738 176.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -100.24 12.9 35.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.853 0.359 . . . . 0.0 110.63 178.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 88.56 108.9 1.08 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.301 -177.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.596 ' OD1' ' HB2' ' A' ' 20' ' ' CYS . 3.0 p30 -102.14 148.78 24.99 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.047 0.451 . . . . 0.0 110.427 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.506 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 26.8 m95 -106.5 31.0 5.53 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.431 0.634 . . . . 0.0 109.318 176.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.596 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 0.0 OUTLIER -68.1 -6.55 23.52 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 -174.896 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.0 p -20.35 29.22 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 118.584 2.809 . . . . 0.0 118.584 -138.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.529 ' H ' ' C ' ' A' ' 20' ' ' CYS . 3.4 m80 -106.0 -83.63 0.52 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 157.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.522 ' HA ' ' HE3' ' A' ' 23' ' ' LYS . 1.6 tpmt? -154.83 123.79 6.24 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.973 171.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.575 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 47.8 t -87.29 93.88 9.51 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 173.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.8 p -110.74 133.56 21.17 Favored Pre-proline 0 N--CA 1.439 -1.024 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.348 -171.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -67.36 121.66 8.81 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.496 2.131 . . . . 0.0 112.412 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -111.59 78.87 1.15 Allowed 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 173.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.5 -116.45 4.23 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -175.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -94.25 -8.09 40.15 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.5 0.667 . . . . 0.0 110.092 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 68.3 mtm180 -110.05 171.51 7.41 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.859 -174.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.465 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 94.0 m-85 -129.01 139.1 52.22 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.529 175.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -139.39 152.39 47.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.901 0.382 . . . . 0.0 110.656 -179.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 88.8 m -80.3 103.08 9.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.757 174.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -119.29 161.61 20.14 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.474 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -95.58 88.85 5.17 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.41 0.624 . . . . 0.0 109.824 178.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 . . . . . 0 C--O 1.247 0.969 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.541 -179.408 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 84.6 m . . . . . 0 N--CA 1.452 -0.367 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 83.7 mt -80.35 122.32 35.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 174.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.458 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.6 pm0 -61.88 145.31 53.14 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.772 0.796 . . . . 0.0 111.271 -174.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.447 ' HA ' HD22 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -65.64 124.84 23.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.55 -1.205 . . . . 0.0 110.829 -171.692 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 115.26 -21.21 13.32 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.771 -177.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.413 ' CG ' ' HG2' ' A' ' 6' ' ' GLU . 76.0 mm-40 -79.48 173.8 12.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.194 0.521 . . . . 0.0 111.789 -177.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.573 ' H ' ' HD3' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -80.67 155.78 26.64 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.82 172.964 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 12.1 p -136.45 146.07 54.29 Favored Pre-proline 0 C--N 1.319 -0.736 0 C-N-CA 121.156 -0.217 . . . . 0.0 110.545 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -65.8 161.29 39.83 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.404 2.069 . . . . 0.0 110.85 172.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.411 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 4.2 m-20 -49.92 118.61 8.99 Favored Pre-proline 0 C--N 1.33 -0.278 0 O-C-N 123.584 0.552 . . . . 0.0 110.919 -179.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.473 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 11.6 Cg_endo -57.46 -23.87 58.15 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.897 2.398 . . . . 0.0 112.568 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -68.18 -24.53 64.97 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.305 175.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -98.76 0.29 44.15 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.886 0.374 . . . . 0.0 110.513 -177.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.16 95.62 2.4 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.38 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.479 ' OD2' ' HB2' ' A' ' 20' ' ' CYS . 4.2 p-10 -99.86 148.68 24.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.079 0.466 . . . . 0.0 110.521 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -107.4 31.17 5.61 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.529 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -71.83 -8.78 56.38 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -171.092 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 24.6 p -19.86 29.38 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 118.576 2.806 . . . . 0.0 118.576 -140.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.529 ' H ' ' C ' ' A' ' 20' ' ' CYS . 17.3 m80 -103.02 -88.91 0.39 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 157.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.407 ' CE ' ' HB2' ' A' ' 36' ' ' GLN . 21.9 ttmm -155.83 124.62 6.02 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 120.756 0.312 . . . . 0.0 110.488 169.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.473 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 53.5 t -90.72 104.29 16.9 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 176.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.1 m -111.63 150.32 42.04 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.6 -173.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -76.52 118.96 5.04 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 122.629 2.219 . . . . 0.0 111.997 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -113.78 75.76 0.94 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.011 178.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.1 -111.73 3.32 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.488 -0.863 . . . . 0.0 111.948 -178.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.404 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 18.6 ptpt -85.62 -23.66 27.44 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -176.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.404 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 65.0 mtt180 -127.72 168.86 14.51 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.916 0.389 . . . . 0.0 111.139 -174.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 93.4 m-85 -105.71 144.15 32.85 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.93 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -135.48 149.92 49.66 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.148 0.499 . . . . 0.0 110.749 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.84 105.43 15.61 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.46 -176.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.417 ' C ' HD21 ' A' ' 7' ' ' LEU . 37.7 mmt180 -122.04 163.29 19.65 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.767 -175.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -110.39 89.6 3.08 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.312 0.577 . . . . 0.0 111.041 -177.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.407 ' HB2' ' CE ' ' A' ' 23' ' ' LYS . 2.0 mp0 . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.372 -0.823 . . . . 0.0 109.58 175.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 15.1 p . . . . . 0 CA--C 1.538 0.488 0 CA-C-O 120.535 0.207 . . . . 0.0 111.294 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 95.9 mt -75.51 137.65 22.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 122.067 -0.396 . . . . 0.0 110.844 -175.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.422 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 23.1 mm-40 -65.07 147.43 53.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.712 0.768 . . . . 0.0 111.78 -176.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.457 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.6 OUTLIER -71.43 119.71 15.97 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.801 -1.091 . . . . 0.0 109.72 -177.451 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.54 -16.64 28.89 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.718 -0.673 . . . . 0.0 112.309 -174.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.501 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 10.4 mm-40 -80.83 168.76 18.41 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.045 0.45 . . . . 0.0 111.341 -178.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.501 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -83.86 137.02 33.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.594 177.409 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.6 p -126.61 156.28 73.52 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 116.853 -0.158 . . . . 0.0 111.376 -175.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -72.73 156.21 53.41 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.706 2.271 . . . . 0.0 111.363 173.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.492 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 52.1 t-20 -50.83 118.2 9.68 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.003 -177.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.415 ' HA ' ' HB3' ' A' ' 18' ' ' ASP . 19.1 Cg_endo -59.47 -17.25 39.92 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.129 2.553 . . . . 0.0 113.147 -177.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -66.16 -25.34 66.91 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.698 0.285 . . . . 0.0 110.84 177.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 12.2 pt-20 -105.43 18.77 21.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.048 0.451 . . . . 0.0 110.441 177.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 91.13 104.0 1.32 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.091 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.415 ' HB3' ' HA ' ' A' ' 14' ' ' PRO . 19.0 p-10 -94.05 124.28 37.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.079 0.466 . . . . 0.0 110.813 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.473 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 12.6 m95 -84.06 38.8 0.67 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.91 0.862 . . . . 0.0 108.818 177.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.567 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -85.14 -5.84 59.32 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.242 -1.345 . . . . 0.0 113.124 -170.339 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.2 p -16.4 30.0 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 118.265 2.691 . . . . 0.0 118.265 -140.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.567 ' H ' ' C ' ' A' ' 20' ' ' CYS . 31.3 m80 -107.07 -94.42 0.38 Allowed 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 153.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -156.37 118.92 4.06 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 120.89 0.376 . . . . 0.0 111.295 168.689 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.551 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 42.8 t -80.0 124.04 28.35 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 173.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.1 m -130.36 159.19 71.81 Favored Pre-proline 0 C--N 1.317 -0.815 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.226 -176.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -80.7 120.08 3.82 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.812 2.341 . . . . 0.0 112.303 -177.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.495 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 10.8 mm-40 -113.03 75.5 0.92 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.246 -0.888 . . . . 0.0 108.99 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.8 -111.04 3.61 Favored Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 120.239 -0.981 . . . . 0.0 111.929 -176.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.6 pttm -79.72 -29.65 40.72 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -175.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -125.54 175.7 7.36 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.956 0.408 . . . . 0.0 111.356 -174.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.551 ' HB3' ' SG ' ' A' ' 24' ' ' CYS . 97.2 m-85 -110.79 141.27 44.34 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.379 -179.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.495 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 27.8 m-85 -131.31 149.4 52.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.441 -178.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -84.1 110.25 18.34 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.794 -177.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.5 mmt180 -120.75 160.77 22.67 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.717 -176.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -98.14 88.15 4.13 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.677 0.751 . . . . 0.0 110.595 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 . . . . . 0 C--O 1.246 0.878 0 CA-C-O 118.495 -0.764 . . . . 0.0 110.376 178.34 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 82.1 mt -73.46 134.4 29.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.159 0.504 . . . . 0.0 111.31 -173.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.466 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 3.8 mp0 -59.45 151.24 24.43 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.028 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.524 HD23 ' CG ' ' A' ' 22' ' ' HIS . 1.4 tm? -75.2 121.49 22.21 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.444 -178.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 107.72 -5.51 34.94 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.161 -176.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.466 ' HG3' ' HB2' ' A' ' 6' ' ' GLU . 8.7 mm-40 -91.19 170.95 9.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.707 0.289 . . . . 0.0 110.237 178.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.13 150.52 25.48 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 25.4 p -129.64 145.81 58.54 Favored Pre-proline 0 C--N 1.318 -0.781 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.308 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -68.04 154.07 73.49 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.039 1.826 . . . . 0.0 110.325 173.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -49.17 121.76 11.24 Favored Pre-proline 0 C--N 1.33 -0.257 0 O-C-N 123.748 0.655 . . . . 0.0 109.92 -177.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.465 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 10.3 Cg_endo -51.84 -26.48 24.34 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.73 2.953 . . . . 0.0 114.14 -172.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -77.38 -12.41 59.95 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.727 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -101.54 13.64 34.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.885 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.75 80.7 1.14 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.621 178.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -88.65 147.2 24.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.002 0.43 . . . . 0.0 110.586 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.7 m0 -106.25 29.79 6.49 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 174.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.535 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.5 OUTLIER -63.97 -8.01 10.17 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 -171.241 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 11.5 p -20.8 30.17 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 118.462 2.764 . . . . 0.0 118.462 -141.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.535 ' H ' ' C ' ' A' ' 20' ' ' CYS . 78.3 m80 -111.07 -83.48 0.57 Allowed 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 164.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.418 ' HG2' ' HB ' ' A' ' 25' ' ' VAL . 24.9 ttmm -154.92 118.84 4.61 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.974 168.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.465 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 20.1 t -82.55 89.64 6.7 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 173.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.418 ' HB ' ' HG2' ' A' ' 23' ' ' LYS . 7.1 p -109.48 135.81 20.29 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.093 -170.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -64.15 119.53 6.6 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.06 1.84 . . . . 0.0 111.918 178.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -111.69 75.79 0.94 Allowed 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 178.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 82.93 -109.92 3.17 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 119.542 -1.313 . . . . 0.0 111.369 -173.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.467 ' NZ ' ' HB2' ' A' ' 29' ' ' LYS . 4.6 ttmp? -91.77 -35.51 14.08 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.843 0.354 . . . . 0.0 111.569 -177.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -103.62 178.26 4.61 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.074 0.464 . . . . 0.0 111.199 -173.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -116.34 140.08 49.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.745 176.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -139.44 150.53 45.34 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.765 0.317 . . . . 0.0 110.541 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 67.4 m -77.58 103.25 7.41 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.047 176.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -116.5 157.94 24.41 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.231 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -104.95 88.76 2.96 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 177.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.705 -0.664 . . . . 0.0 109.881 -179.968 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 77.6 m . . . . . 0 N--CA 1.447 -0.617 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 83.2 mt -68.99 136.69 25.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 176.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -62.12 148.27 44.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.663 0.744 . . . . 0.0 110.995 -178.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.516 HD23 ' CG ' ' A' ' 22' ' ' HIS . 1.0 OUTLIER -74.28 117.62 16.31 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.937 -1.028 . . . . 0.0 110.008 -175.041 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 114.24 -13.77 21.25 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.131 -175.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -82.3 170.71 15.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.008 0.432 . . . . 0.0 110.799 -179.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.436 ' N ' ' HD3' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -87.23 141.31 28.75 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.588 178.118 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 26.1 p -127.42 148.46 66.51 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.85 161.72 44.14 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.282 1.988 . . . . 0.0 111.021 175.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -50.05 118.35 8.83 Favored Pre-proline 0 C--N 1.329 -0.311 0 O-C-N 123.462 0.476 . . . . 0.0 109.886 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -54.03 -19.29 15.41 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 123.433 2.756 . . . . 0.0 113.501 -174.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.4 mmm180 -68.16 -18.46 64.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.897 177.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -92.85 -4.7 52.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.507 178.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 125.56 98.04 1.13 Allowed Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.589 -175.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -78.24 114.07 16.79 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.819 0.342 . . . . 0.0 110.859 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 3.5 m0 -110.44 13.68 22.72 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.265 176.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.613 ' C ' ' H ' ' A' ' 22' ' ' HIS . 51.2 t -74.03 -9.21 58.4 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -176.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.7 p -17.69 31.62 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 117.643 2.46 . . . . 0.0 117.643 -138.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.613 ' H ' ' C ' ' A' ' 20' ' ' CYS . 73.3 m80 -99.38 -87.37 0.36 Allowed 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 159.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -155.1 117.84 4.31 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.297 164.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 45.4 t -80.37 91.03 5.63 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 172.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.4 p -110.15 138.99 20.98 Favored Pre-proline 0 C--N 1.313 -0.99 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.244 -167.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -59.73 119.7 7.07 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.212 1.941 . . . . 0.0 111.536 177.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -120.81 77.61 1.31 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.38 -0.827 . . . . 0.0 108.945 -177.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.26 -111.09 3.42 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.307 -0.949 . . . . 0.0 111.528 -174.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -94.64 -24.6 17.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.872 0.368 . . . . 0.0 111.331 -177.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -119.47 176.29 5.42 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.482 -174.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.469 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 97.3 m-85 -103.14 140.72 36.96 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.897 176.067 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -132.05 150.41 52.16 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.284 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.412 ' O ' HD22 ' A' ' 7' ' ' LEU . 6.2 t -84.14 97.31 9.28 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -114.43 160.51 19.08 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.382 -174.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -103.9 90.07 3.5 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.005 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 . . . . . 0 C--O 1.246 0.911 0 CA-C-O 118.421 -0.8 . . . . 0.0 109.691 178.451 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.544 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 47.8 m . . . . . 0 N--CA 1.45 -0.441 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.443 ' HB ' ' SG ' ' A' ' 33' ' ' CYS . 77.7 mt -59.43 130.95 23.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.031 0.443 . . . . 0.0 109.928 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.488 ' H ' ' CD ' ' A' ' 6' ' ' GLU . 1.8 pm0 -69.46 150.95 46.66 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.93 0.871 . . . . 0.0 111.358 -177.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.42 HD23 ' ND1' ' A' ' 22' ' ' HIS . 0.5 OUTLIER -68.46 115.62 8.09 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.338 -1.301 . . . . 0.0 110.58 -171.44 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 116.91 -13.45 14.45 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.358 -176.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -84.17 170.78 13.43 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.247 0.546 . . . . 0.0 111.694 179.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.481 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 9.5 mpt_? -79.92 155.33 27.78 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.303 -177.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.461 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 30.2 t -135.13 140.22 34.12 Favored Pre-proline 0 C--N 1.316 -0.852 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.555 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.34 162.74 41.41 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.769 2.313 . . . . 0.0 110.551 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.1 t-20 -53.79 112.79 4.11 Favored Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.67 -15.73 21.93 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.442 2.762 . . . . 0.0 113.943 -171.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.9 ptm180 -63.99 -25.46 68.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.011 0.434 . . . . 0.0 110.414 175.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -88.05 -2.97 58.93 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.47 178.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 131.14 156.22 8.44 Favored Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 -177.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -123.35 109.94 14.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.358 0.579 . . . . 0.0 111.102 -178.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.544 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 45.3 t-105 -107.16 21.9 16.82 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.092 0.948 . . . . 0.0 108.563 173.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.511 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -83.73 -5.27 59.15 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.571 -1.195 . . . . 0.0 112.161 -175.187 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 22.4 m -20.84 30.62 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 118.672 2.841 . . . . 0.0 118.672 -142.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.511 ' H ' ' C ' ' A' ' 20' ' ' CYS . 57.1 m80 -107.65 -83.48 0.54 Allowed 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 159.134 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.4 tttm -154.28 122.33 5.99 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.805 167.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 47.2 t -80.95 91.9 6.09 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 175.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 5.7 p -114.2 137.56 22.55 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.028 -169.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -66.64 120.07 7.15 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.508 2.139 . . . . 0.0 112.523 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -111.02 76.88 1.0 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.07 -0.968 . . . . 0.0 108.774 178.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.77 -111.08 3.45 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.263 -0.97 . . . . 0.0 111.833 -172.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.4 ptpp? -97.32 -23.81 15.95 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 117.055 0.428 . . . . 0.0 111.98 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -111.49 168.71 9.33 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.009 0.433 . . . . 0.0 110.978 -176.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.461 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 98.4 m-85 -104.05 143.94 32.23 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.711 176.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 59.6 m-85 -139.55 154.36 47.63 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.443 ' SG ' ' HB ' ' A' ' 5' ' ' ILE . 95.5 m -82.58 105.13 13.37 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.779 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -116.18 157.93 24.06 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.882 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -94.63 87.73 5.18 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 122.022 0.915 . . . . 0.0 110.017 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 . . . . . 0 C--O 1.249 1.033 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.923 -178.974 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 13.6 p . . . . . 0 N--CA 1.451 -0.399 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.422 ' CG2' ' HB2' ' A' ' 9' ' ' GLU . 77.9 mt -73.09 130.94 35.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.903 0.382 . . . . 0.0 110.114 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.456 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 3.4 pm0 -72.17 159.92 33.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.672 0.748 . . . . 0.0 111.176 -176.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.461 HD23 ' CG ' ' A' ' 22' ' ' HIS . 0.4 OUTLIER -70.3 120.6 16.21 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.017 -171.589 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 112.46 -9.42 26.33 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.616 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.475 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 16.0 mm-40 -89.98 167.23 12.96 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.022 0.439 . . . . 0.0 111.226 -179.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.475 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -78.2 142.4 37.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.966 -179.628 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.461 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 24.2 p -128.12 148.77 68.93 Favored Pre-proline 0 C--N 1.318 -0.799 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.44 177.283 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -72.12 150.74 54.46 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.335 2.023 . . . . 0.0 110.621 172.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.422 ' OD1' ' HG2' ' A' ' 15' ' ' ARG . 45.2 t-20 -49.67 122.77 13.78 Favored Pre-proline 0 C--N 1.333 -0.119 0 O-C-N 123.659 0.6 . . . . 0.0 110.238 -177.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.467 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 10.1 Cg_endo -51.28 -28.31 26.11 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 124.007 3.138 . . . . 0.0 114.065 -173.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.422 ' HG2' ' OD1' ' A' ' 13' ' ' ASN . 14.4 ptm180 -69.85 -18.49 63.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.907 0.384 . . . . 0.0 110.845 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -93.62 -8.54 40.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.374 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.31 86.31 1.91 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.158 -177.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.467 ' OD2' ' HB2' ' A' ' 20' ' ' CYS . 8.5 p-10 -90.09 146.85 24.01 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.976 0.417 . . . . 0.0 111.043 -178.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.491 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 36.7 m95 -107.44 35.67 2.99 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 176.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.592 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -70.97 -6.77 41.3 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 114.668 1.358 . . . . 0.0 114.668 -171.194 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.9 p -17.9 30.1 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 117.952 2.575 . . . . 0.0 117.952 -139.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.592 ' H ' ' C ' ' A' ' 20' ' ' CYS . 77.6 m80 -109.36 -91.65 0.45 Allowed 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 159.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.9 tttm -154.2 129.11 9.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 167.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.467 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 42.4 t -89.08 103.13 15.77 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 178.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 28.5 m -115.44 147.68 39.25 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.004 -175.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -75.15 119.41 5.59 Favored 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.44 2.093 . . . . 0.0 111.935 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -110.74 74.96 0.9 Allowed 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 178.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.14 -110.49 3.05 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.036 -1.078 . . . . 0.0 112.177 -177.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -87.98 -16.0 34.94 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -175.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -125.31 179.37 5.12 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.086 0.47 . . . . 0.0 111.352 -176.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.461 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 90.8 m-85 -117.58 143.76 45.8 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.169 171.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -138.81 148.82 44.23 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.962 0.41 . . . . 0.0 110.666 -179.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 98.4 m -75.86 103.71 6.06 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.598 174.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -113.07 159.22 19.41 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.486 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -94.37 88.74 5.63 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 176.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 . . . . . 0 C--N 1.315 -0.893 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.428 -177.92 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.604 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 62.7 m . . . . . 0 N--CA 1.45 -0.428 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.449 ' HB ' ' HA ' ' A' ' 20' ' ' CYS . 88.3 mt -71.29 136.14 26.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.01 0.433 . . . . 0.0 110.156 177.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -62.53 151.4 37.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.203 -178.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.502 HD23 ' CG ' ' A' ' 22' ' ' HIS . 0.9 OUTLIER -76.61 121.96 23.95 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.656 -177.632 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.33 -6.78 42.68 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.908 -175.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -83.77 173.99 10.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.001 0.429 . . . . 0.0 110.875 177.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.52 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 7.3 mpt_? -96.58 142.88 28.11 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.441 177.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.3 p -124.61 152.04 68.36 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-O 120.635 0.255 . . . . 0.0 110.989 -177.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.7 151.77 69.46 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.369 2.046 . . . . 0.0 110.755 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.584 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 46.9 t-20 -50.18 116.23 6.3 Favored Pre-proline 0 C--N 1.33 -0.282 0 O-C-N 123.704 0.627 . . . . 0.0 110.33 -178.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.557 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 9.9 Cg_endo -52.97 -22.48 18.57 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.505 2.804 . . . . 0.0 114.033 -171.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.482 ' HG3' ' OD1' ' A' ' 13' ' ' ASN . 0.0 OUTLIER -66.77 -14.65 62.86 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 178.864 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.584 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 11.4 pt-20 -107.57 10.3 29.23 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.765 0.317 . . . . 0.0 110.93 177.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 98.0 103.56 2.3 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.448 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -101.94 147.5 26.47 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.276 0.56 . . . . 0.0 110.501 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.604 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 1.2 m-90 -108.33 31.12 5.81 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 174.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.581 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -74.96 -9.51 58.6 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -169.386 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.9 m -18.75 30.86 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 118.013 2.597 . . . . 0.0 118.013 -141.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.581 ' H ' ' C ' ' A' ' 20' ' ' CYS . 70.5 m80 -104.78 -88.84 0.42 Allowed 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 162.077 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -155.07 120.7 5.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 166.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.557 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 46.3 t -83.57 94.25 8.03 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 174.218 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.0 p -115.84 137.18 23.11 Favored Pre-proline 0 N--CA 1.439 -1.003 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.256 -168.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.08 127.4 23.08 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.721 2.281 . . . . 0.0 112.863 -178.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.52 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 7.1 mm-40 -124.58 91.34 3.42 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.779 176.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.8 -111.82 3.49 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.371 -0.919 . . . . 0.0 111.595 -177.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.67 3.52 24.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.85 0.357 . . . . 0.0 110.982 -179.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 50.7 mtt180 -126.16 -179.22 4.62 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.166 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -120.73 139.94 52.35 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.786 176.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.52 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 17.7 m-85 -131.9 154.51 49.15 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.372 0.606 . . . . 0.0 110.851 -177.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.82 99.67 12.63 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.172 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -110.32 161.31 15.75 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.777 -177.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -102.38 88.34 3.25 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.281 0.562 . . . . 0.0 109.672 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.44 ' HA ' ' OE1' ' A' ' 36' ' ' GLN . 14.6 mm-40 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.442 -0.789 . . . . 0.0 109.844 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 71.9 m . . . . . 0 N--CA 1.452 -0.341 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 75.5 mt -64.51 123.51 17.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.447 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.4 pm0 -68.09 156.15 38.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.966 0.889 . . . . 0.0 111.975 -172.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.47 123.94 20.06 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.134 -1.394 . . . . 0.0 110.952 -174.141 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.65 -14.66 29.65 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.484 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -85.29 168.72 14.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.11 0.481 . . . . 0.0 111.197 -179.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.81 138.22 31.67 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.715 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.46 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 22.4 p -120.03 146.91 43.3 Favored Pre-proline 0 C--N 1.318 -0.788 0 C-N-CA 121.014 -0.275 . . . . 0.0 110.977 -179.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -63.68 150.37 88.61 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.287 1.991 . . . . 0.0 109.941 168.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.611 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 45.8 t-20 -49.4 122.6 12.75 Favored Pre-proline 0 C--N 1.329 -0.306 0 O-C-N 123.592 0.558 . . . . 0.0 110.098 -179.369 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.645 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 12.0 Cg_endo -55.02 -17.58 14.77 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 123.3 2.667 . . . . 0.0 113.48 -173.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -70.44 -22.0 62.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.97 177.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 12.7 pt-20 -106.75 13.48 27.92 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.045 0.45 . . . . 0.0 110.411 178.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 129.15 126.25 2.83 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.297 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -111.52 107.36 16.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.879 0.371 . . . . 0.0 110.27 -178.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.7 m95 -111.02 11.34 22.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.181 0.515 . . . . 0.0 110.075 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.559 ' C ' ' H ' ' A' ' 22' ' ' HIS . 1.0 OUTLIER -71.49 -4.95 29.52 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -172.636 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 10.7 m -18.24 29.79 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 118.387 2.736 . . . . 0.0 118.387 -139.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.559 ' H ' ' C ' ' A' ' 20' ' ' CYS . 37.0 m80 -106.44 -83.61 0.52 Allowed 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 158.017 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -154.89 123.98 6.29 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.293 167.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.645 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 49.1 t -86.38 91.65 8.58 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 173.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.6 p -114.85 139.74 24.57 Favored Pre-proline 0 C--N 1.313 -1.005 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.926 -169.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -57.62 126.07 20.7 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 122.659 2.239 . . . . 0.0 112.508 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -122.99 76.44 1.37 Allowed 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.08 -111.71 3.49 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.584 -0.817 . . . . 0.0 111.337 -173.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.6 tttp -92.23 -36.27 13.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.216 0.532 . . . . 0.0 110.779 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 87.6 mtt180 -100.89 178.86 4.56 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.328 -174.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 90.2 m-85 -113.39 143.83 43.8 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.754 178.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -135.48 148.13 49.11 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.465 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 88.1 m -78.51 101.87 7.58 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 174.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -112.96 160.59 17.93 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.743 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -100.9 88.04 3.45 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 176.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.37 -0.824 . . . . 0.0 109.546 -178.472 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.448 -0.531 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 93.5 mt -52.98 131.95 15.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 121.287 0.565 . . . . 0.0 111.973 -171.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.2 mp0 -61.29 157.22 16.91 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.324 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.581 HD23 ' CG ' ' A' ' 22' ' ' HIS . 1.1 tm? -79.88 126.59 31.19 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.069 -175.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.95 -7.93 53.42 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.96 -176.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -86.64 174.04 9.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.169 0.509 . . . . 0.0 111.25 -178.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -85.77 143.47 28.29 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.452 176.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 27.0 p -133.63 152.7 79.45 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.698 -179.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -77.98 154.07 29.32 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.66 2.24 . . . . 0.0 111.3 173.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -50.31 117.47 7.96 Favored Pre-proline 0 C--O 1.234 0.274 0 O-C-N 123.487 0.492 . . . . 0.0 110.118 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.435 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 18.3 Cg_endo -58.51 -13.68 18.04 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 123.347 2.698 . . . . 0.0 113.491 -172.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -66.79 -21.99 66.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.961 178.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -118.17 21.25 12.85 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.862 0.363 . . . . 0.0 111.486 -177.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 130.8 98.0 0.78 Allowed Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.542 178.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -92.18 106.91 18.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.971 0.415 . . . . 0.0 110.578 177.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 39.4 m95 -113.47 28.12 9.03 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.806 0.812 . . . . 0.0 109.174 178.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.592 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -85.15 -5.87 59.32 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.471 -170.73 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.6 p -14.25 29.76 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 117.796 2.517 . . . . 0.0 117.796 -139.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.592 ' H ' ' C ' ' A' ' 20' ' ' CYS . 72.9 m80 -111.22 -92.82 0.45 Allowed 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 164.032 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.2 tttm -155.22 118.41 4.4 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 165.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.435 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 42.2 t -82.2 102.4 11.1 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 174.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 9.9 p -121.6 136.09 25.7 Favored Pre-proline 0 N--CA 1.438 -1.065 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.52 -169.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -64.0 119.75 6.89 Favored 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 122.472 2.115 . . . . 0.0 112.25 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.408 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 5.7 mm-40 -113.74 76.91 1.01 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.293 -0.867 . . . . 0.0 108.73 178.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.6 -111.6 3.51 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.314 -0.946 . . . . 0.0 111.991 -174.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.51 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 18.3 ptpt -102.05 -8.3 21.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.887 0.343 . . . . 0.0 111.912 -175.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.51 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 95.4 mtt180 -127.97 171.64 11.64 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.843 0.354 . . . . 0.0 110.272 -178.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.409 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 93.1 m-85 -110.1 139.99 44.64 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.388 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.408 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 62.4 m-85 -134.73 151.8 51.27 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.736 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -86.0 103.93 15.15 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -115.17 158.82 21.71 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.151 -175.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -100.28 91.46 4.74 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.753 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.565 -0.731 . . . . 0.0 109.565 179.221 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 65.0 m . . . . . 0 N--CA 1.449 -0.511 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.471 HG22 ' HB2' ' A' ' 9' ' ' GLU . 75.7 mt -65.69 135.26 28.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.154 -176.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.7 mp0 -56.44 145.36 27.85 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 121.524 0.678 . . . . 0.0 111.307 -178.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.491 HD23 ' ND1' ' A' ' 22' ' ' HIS . 1.5 tm? -68.82 121.29 16.24 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.653 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 109.21 -8.34 33.05 Favored Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.139 -176.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.471 ' HB2' HG22 ' A' ' 5' ' ' ILE . 61.8 mm-40 -86.99 175.76 7.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.019 0.438 . . . . 0.0 110.969 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -91.53 144.85 25.13 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.132 179.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 9.4 p -129.46 147.17 64.05 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.65 179.03 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -68.78 160.53 49.22 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.202 1.935 . . . . 0.0 110.199 171.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.3 t-20 -49.74 117.78 7.69 Favored Pre-proline 0 C--O 1.234 0.285 0 O-C-N 123.36 0.412 . . . . 0.0 110.442 -176.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.488 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 13.5 Cg_endo -57.67 -18.69 34.39 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.523 2.815 . . . . 0.0 113.918 -173.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 -66.96 -24.04 66.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.87 0.367 . . . . 0.0 110.144 177.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -89.59 -3.7 58.18 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.087 177.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 137.23 134.71 3.29 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.477 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -110.73 106.51 15.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.375 0.587 . . . . 0.0 109.905 -179.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -103.29 9.34 38.1 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.486 0.66 . . . . 0.0 109.794 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.671 ' SG ' ' HB2' ' A' ' 24' ' ' CYS . 8.4 m -73.74 -2.8 24.88 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 124.184 0.993 . . . . 0.0 113.372 -175.015 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.8 m -17.0 29.7 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 118.309 2.707 . . . . 0.0 118.309 -138.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.554 ' H ' ' C ' ' A' ' 20' ' ' CYS . 32.1 m80 -104.51 -86.66 0.45 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 156.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.6 tttm -155.73 120.02 4.59 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 120.414 0.15 . . . . 0.0 110.657 169.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.671 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 41.9 t -85.07 110.17 18.75 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 175.618 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.1 m -124.52 158.91 60.13 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.338 -173.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -81.47 119.71 3.44 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 122.552 2.168 . . . . 0.0 112.034 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.421 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 6.5 mm-40 -110.57 75.31 0.92 Allowed 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 177.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 75.75 -111.65 3.38 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.921 -175.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.468 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 22.5 pttm -84.21 -28.68 27.13 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -176.226 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.468 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 62.4 mtt-85 -118.38 171.35 8.21 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.996 0.427 . . . . 0.0 110.995 -175.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.529 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 97.1 m-85 -107.32 145.1 33.23 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.899 177.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.421 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 37.5 m-85 -136.77 149.01 47.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.452 -179.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 85.0 m -79.3 102.78 8.81 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 175.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -115.09 161.48 18.32 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 -179.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -103.93 88.26 2.99 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.2 mm-40 . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.349 -179.619 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.543 ' HA ' ' O ' ' A' ' 19' ' ' TRP . 36.3 m . . . . . 0 C--O 1.232 0.157 0 CA-C-O 121.613 0.721 . . . . 0.0 110.524 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.17 138.25 23.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.182 -174.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.0 mp0 -55.58 141.31 37.84 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.074 -177.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.82 120.0 15.77 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.377 -177.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 111.46 -14.14 27.75 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.093 -175.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -84.53 165.16 18.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.989 0.423 . . . . 0.0 111.228 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.441 ' H ' ' HD3' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -78.99 145.9 33.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.475 175.262 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 7.6 p -125.42 137.95 30.85 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.712 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -57.57 157.53 22.65 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.654 2.236 . . . . 0.0 111.072 172.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -49.86 114.08 3.92 Favored Pre-proline 0 C--O 1.231 0.123 0 O-C-N 123.526 0.516 . . . . 0.0 110.456 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -57.89 -19.41 39.35 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 123.208 2.605 . . . . 0.0 113.616 -172.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -68.28 -19.7 64.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.748 0.309 . . . . 0.0 110.733 177.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -89.3 -8.82 52.55 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.964 0.411 . . . . 0.0 110.342 178.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 136.26 112.07 1.15 Allowed Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 111.603 -0.599 . . . . 0.0 111.603 -176.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -86.64 113.11 22.25 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.964 0.411 . . . . 0.0 110.541 -178.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.543 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 3.0 m0 -111.86 26.4 10.66 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 174.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.559 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -84.84 -6.02 59.34 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.88 -171.284 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.4 m -18.57 29.52 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 118.207 2.669 . . . . 0.0 118.207 -138.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.559 ' H ' ' C ' ' A' ' 20' ' ' CYS . 42.7 m80 -107.41 -90.83 0.43 Allowed 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 158.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -156.03 126.66 6.79 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 168.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.497 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 50.2 t -90.44 100.2 13.08 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 176.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.6 m -109.79 146.34 33.89 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-O 121.094 0.473 . . . . 0.0 111.656 -174.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.13 121.68 5.43 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.73 2.286 . . . . 0.0 112.188 178.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -118.86 90.3 3.31 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 176.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.42 -110.87 3.4 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.313 -0.946 . . . . 0.0 111.422 -174.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.5 tttp -104.65 -16.93 14.85 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.011 0.434 . . . . 0.0 110.869 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -111.38 167.08 10.58 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.929 -173.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.497 ' HB3' ' SG ' ' A' ' 24' ' ' CYS . 96.3 m-85 -110.49 140.75 44.45 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.014 177.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -135.55 149.14 49.36 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.015 0.436 . . . . 0.0 110.633 -179.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -85.84 107.44 17.67 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.533 -176.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -122.02 158.56 28.89 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.379 -174.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -97.7 88.65 4.39 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.911 0.862 . . . . 0.0 109.914 177.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 . . . . . 0 C--O 1.246 0.915 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.453 -178.586 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.585 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 62.5 m . . . . . 0 N--CA 1.449 -0.485 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.402 ' HB ' ' HA ' ' A' ' 20' ' ' CYS . 89.1 mt -64.73 130.27 29.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 118.152 0.433 . . . . 0.0 110.107 178.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.417 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 14.4 mm-40 -59.47 147.64 35.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.233 -177.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.447 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.7 OUTLIER -74.27 115.79 14.17 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.944 -175.248 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.5 -18.55 11.88 Favored Glycine 0 N--CA 1.445 -0.717 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.998 -174.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.421 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 8.2 mm-40 -75.91 166.63 23.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.036 0.446 . . . . 0.0 111.04 -179.121 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.421 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -84.77 138.24 32.72 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 176.304 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 23.1 p -117.81 148.55 43.45 Favored Pre-proline 0 C--N 1.316 -0.88 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.197 -178.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.23 154.46 69.8 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.684 2.256 . . . . 0.0 110.93 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . 0.597 ' OD1' ' HG2' ' A' ' 15' ' ' ARG . 47.5 t-20 -51.99 116.92 8.99 Favored Pre-proline 0 C--O 1.233 0.196 0 O-C-N 123.699 0.624 . . . . 0.0 110.543 -177.013 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.448 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 14.5 Cg_endo -56.62 -20.57 34.91 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.442 2.761 . . . . 0.0 114.129 -172.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.597 ' HG2' ' OD1' ' A' ' 13' ' ' ASN . 10.1 ptm180 -64.45 -23.99 67.47 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 121.045 -0.262 . . . . 0.0 111.046 177.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -92.11 0.48 57.46 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.908 0.385 . . . . 0.0 110.641 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 99.89 94.55 2.11 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.812 -0.709 . . . . 0.0 111.877 -177.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.412 ' HB3' ' HA ' ' A' ' 14' ' ' PRO . 9.2 p-10 -86.83 147.59 25.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.101 0.477 . . . . 0.0 110.679 -179.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.585 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 26.0 m95 -111.74 36.26 3.35 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 176.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.574 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -79.4 -6.97 58.0 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.329 -1.305 . . . . 0.0 113.179 -171.659 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.9 m -17.77 31.24 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 118.077 2.621 . . . . 0.0 118.077 -141.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.574 ' H ' ' C ' ' A' ' 20' ' ' CYS . 69.0 m80 -109.35 -87.98 0.5 Allowed 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 161.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -154.6 124.22 6.56 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.158 167.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.448 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 44.9 t -84.97 90.78 7.9 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 172.313 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.7 p -106.7 132.09 21.18 Favored Pre-proline 0 N--CA 1.44 -0.946 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.782 -168.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -67.36 119.82 6.85 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.441 2.094 . . . . 0.0 112.726 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -113.38 85.23 2.15 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.897 -1.047 . . . . 0.0 108.941 177.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 79.23 -111.15 3.19 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 119.945 -1.121 . . . . 0.0 111.326 -175.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -94.44 -30.19 14.58 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.093 0.473 . . . . 0.0 110.88 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -98.85 174.17 6.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.224 -173.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -117.06 137.78 52.03 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.414 174.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -130.89 150.44 52.05 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.009 0.433 . . . . 0.0 110.173 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -85.52 100.63 12.04 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.394 -178.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.0 mmm180 -119.91 163.66 17.22 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.193 -175.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -107.5 89.68 3.07 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.827 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 . . . . . 0 C--O 1.246 0.878 0 CA-C-O 118.516 -0.754 . . . . 0.0 110.119 -179.438 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 76.0 m . . . . . 0 N--CA 1.45 -0.44 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 89.2 mt -70.65 134.24 30.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 176.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -58.48 145.97 37.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.534 0.683 . . . . 0.0 110.796 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.484 ' HA ' HD22 ' A' ' 7' ' ' LEU . 0.7 OUTLIER -74.48 121.86 22.14 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.563 -176.769 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.25 -6.5 34.36 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.354 -174.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -86.17 168.74 13.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.101 0.477 . . . . 0.0 111.629 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.431 ' HD2' ' N ' ' A' ' 11' ' ' CYS . 2.3 tmm_? -88.52 127.85 35.54 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.161 177.647 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.431 ' N ' ' HD2' ' A' ' 10' ' ' ARG . 25.7 p -113.37 151.03 44.04 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-O 120.636 0.255 . . . . 0.0 111.315 -174.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.34 146.99 64.53 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.591 2.194 . . . . 0.0 110.87 173.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.6 t-20 -50.39 120.07 11.88 Favored Pre-proline 0 C--O 1.231 0.129 0 O-C-N 123.708 0.63 . . . . 0.0 110.112 -177.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.535 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 14.5 Cg_endo -56.44 -21.0 35.4 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 123.308 2.672 . . . . 0.0 113.589 -174.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.18 -18.0 63.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.846 0.355 . . . . 0.0 110.303 177.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -101.08 -4.68 26.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.566 178.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.63 107.72 3.23 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.159 -177.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -109.87 146.77 34.54 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.04 0.448 . . . . 0.0 110.39 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 2.1 m-90 -108.73 33.82 4.01 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 177.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.577 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -78.41 -9.29 59.23 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -169.379 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.7 p -19.29 29.93 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 118.231 2.678 . . . . 0.0 118.231 -140.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.577 ' H ' ' C ' ' A' ' 20' ' ' CYS . 66.7 m80 -103.03 -87.6 0.42 Allowed 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 161.395 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.413 ' HE3' ' N ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -155.39 117.7 4.18 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 167.96 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.535 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 45.5 t -82.76 93.37 7.41 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 169.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.1 p -112.62 137.9 21.86 Favored Pre-proline 0 C--N 1.313 -1.013 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.336 -166.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -66.7 119.27 6.28 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.254 1.969 . . . . 0.0 111.91 178.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -116.72 76.91 1.06 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.36 -0.837 . . . . 0.0 108.863 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.56 -111.7 3.46 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.105 -1.045 . . . . 0.0 111.598 -175.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.7 pttm -99.59 -12.0 20.49 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -176.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -120.84 175.16 6.18 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.01 0.434 . . . . 0.0 111.123 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -113.33 137.19 51.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.51 173.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -133.67 152.32 51.86 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.057 0.456 . . . . 0.0 109.871 179.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -83.28 101.66 11.43 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.301 -178.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -114.87 160.46 19.47 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.316 -177.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -109.67 88.68 2.8 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.07 0.462 . . . . 0.0 110.266 178.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.399 -0.81 . . . . 0.0 109.293 176.473 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.662 ' HA ' ' O ' ' A' ' 19' ' ' TRP . 33.3 m . . . . . 0 CA--C 1.533 0.306 0 CA-C-O 121.793 0.806 . . . . 0.0 111.55 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 86.6 mt -72.56 137.97 22.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.347 -176.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -55.28 138.48 45.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.231 177.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.463 ' HA ' HD22 ' A' ' 7' ' ' LEU . 1.3 tm? -70.06 121.96 18.47 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.16 -173.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 111.25 -16.19 27.37 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.134 -176.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.401 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 18.1 mm-40 -78.71 168.71 19.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.903 0.382 . . . . 0.0 110.898 -179.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.401 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -74.73 151.71 39.16 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 176.047 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.57 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 11.7 t -140.04 139.99 22.79 Favored Pre-proline 0 C--N 1.314 -0.942 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.24 -174.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -71.93 158.79 51.97 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.532 2.155 . . . . 0.0 110.86 176.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -53.22 115.73 8.13 Favored Pre-proline 0 C--N 1.331 -0.225 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.44 -24.95 46.11 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 123.454 2.769 . . . . 0.0 113.621 -172.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 17.4 ptt180 -71.22 -17.83 62.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.837 0.351 . . . . 0.0 110.405 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -98.9 -0.59 41.99 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.575 179.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 135.16 93.93 0.44 Allowed Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.959 -0.638 . . . . 0.0 111.971 -177.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -81.54 124.79 29.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.603 0.239 . . . . 0.0 110.649 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.662 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 20.5 m95 -118.89 12.23 12.81 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-O 120.988 0.423 . . . . 0.0 109.938 174.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.583 ' C ' ' H ' ' A' ' 22' ' ' HIS . 38.8 t -73.65 -6.49 47.05 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -170.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.7 m -15.88 31.85 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 117.566 2.432 . . . . 0.0 117.566 -138.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.583 ' H ' ' C ' ' A' ' 20' ' ' CYS . 72.8 m80 -108.37 -88.07 0.48 Allowed 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 163.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.7 tttm -156.49 119.65 4.19 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 165.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.2 t -86.03 107.95 18.02 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.1 m -120.79 149.65 51.09 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-O 121.001 0.429 . . . . 0.0 111.553 -173.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -70.74 122.88 9.27 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.601 2.201 . . . . 0.0 112.397 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.465 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 6.9 mm-40 -119.26 75.71 1.07 Allowed 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.182 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.76 -111.16 3.28 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.348 -0.93 . . . . 0.0 112.189 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -83.05 -29.93 28.44 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -177.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -126.46 171.65 10.86 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.045 0.45 . . . . 0.0 111.016 -174.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.57 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 87.4 m-85 -98.02 148.87 23.06 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.369 176.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.465 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 11.7 m-85 -133.18 156.28 47.77 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 -179.085 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 4.6 t -88.34 103.38 15.76 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -179.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.441 ' HB3' HE22 ' A' ' 36' ' ' GLN . 30.5 mmt180 -116.55 163.39 16.15 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.751 -176.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -104.76 88.31 2.88 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.231 0.538 . . . . 0.0 111.551 -178.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.441 HE22 ' HB3' ' A' ' 34' ' ' ARG . 2.5 mp0 . . . . . 0 C--O 1.252 1.193 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.558 172.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.617 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 71.4 m . . . . . 0 N--CA 1.451 -0.409 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 81.2 mt -58.52 135.01 23.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 CA-C-O 121.209 0.528 . . . . 0.0 111.099 -178.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.456 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 11.4 mp0 -60.43 152.89 24.42 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.89 -177.105 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.522 HD23 ' CG ' ' A' ' 22' ' ' HIS . 1.2 tm? -74.32 117.66 16.38 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.939 -177.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.9 -14.5 29.04 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.806 -0.633 . . . . 0.0 112.013 -176.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.471 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 12.7 mm-40 -78.72 167.32 21.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.041 0.448 . . . . 0.0 110.619 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.471 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -82.21 145.16 30.2 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.372 177.222 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.556 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 15.1 p -125.34 147.29 57.14 Favored Pre-proline 0 C--N 1.313 -0.992 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.244 177.249 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . 0.541 ' HG3' ' CZ3' ' A' ' 19' ' ' TRP . 56.0 Cg_endo -68.98 159.42 54.03 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.398 2.065 . . . . 0.0 110.29 174.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -52.54 115.62 7.39 Favored Pre-proline 0 C--N 1.328 -0.353 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -54.67 -22.33 28.36 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.303 2.668 . . . . 0.0 113.79 -171.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -70.13 -20.27 63.18 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.982 179.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -97.57 -1.76 43.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.601 0.239 . . . . 0.0 111.059 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 135.93 118.72 1.82 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.797 -178.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -102.0 107.27 18.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.984 0.421 . . . . 0.0 111.141 -177.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.617 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 1.7 m0 -106.95 21.39 17.63 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 173.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.533 ' O ' ' N ' ' A' ' 22' ' ' HIS . 3.8 t -81.41 -8.54 59.75 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.412 -1.267 . . . . 0.0 111.803 -170.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 20.3 m -21.93 31.13 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 118.591 2.811 . . . . 0.0 118.591 -142.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.533 ' N ' ' O ' ' A' ' 20' ' ' CYS . 77.4 m80 -104.43 -88.29 0.43 Allowed 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 161.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -156.32 118.79 4.06 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 163.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.412 ' HB2' ' CB ' ' A' ' 20' ' ' CYS . 48.9 t -83.92 97.56 9.3 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.415 ' HA ' ' HD3' ' A' ' 26' ' ' PRO . 18.2 m -109.07 145.6 32.09 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.1 -176.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 25' ' ' VAL . 3.5 Cg_exo -71.46 119.8 6.51 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.465 2.11 . . . . 0.0 111.492 176.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -110.79 76.81 1.0 Allowed 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 176.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.12 -111.68 3.43 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.475 -0.869 . . . . 0.0 111.088 -173.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -99.82 -13.62 19.14 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.182 0.515 . . . . 0.0 110.648 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -106.56 176.1 5.28 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.942 -177.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.556 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 87.7 m-85 -126.96 141.66 51.74 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 176.362 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -137.71 148.4 45.63 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.002 0.43 . . . . 0.0 111.189 -178.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.439 ' O ' HD22 ' A' ' 7' ' ' LEU . 55.6 m -79.37 101.4 8.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.684 174.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -107.89 154.67 21.25 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.215 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -89.87 88.84 7.49 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.512 177.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 . . . . . 0 C--O 1.245 0.855 0 CA-C-O 118.192 -0.909 . . . . 0.0 110.029 -178.331 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 19' ' ' TRP . 63.2 m . . . . . 0 N--CA 1.448 -0.54 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.456 HG13 ' HB2' ' A' ' 19' ' ' TRP . 79.8 mt -81.34 133.61 28.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 -178.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.427 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 1.5 pm0 -70.16 157.26 37.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.797 0.808 . . . . 0.0 111.648 -174.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.544 HD23 ' ND1' ' A' ' 22' ' ' HIS . 0.4 OUTLIER -67.06 123.71 20.99 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.913 -172.94 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.68 -9.51 34.88 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.524 179.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.454 ' HB2' HG22 ' A' ' 5' ' ' ILE . 32.2 mm-40 -84.32 170.84 13.23 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.986 0.422 . . . . 0.0 111.12 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.578 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 5.3 mpt_? -89.92 137.9 31.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.55 -179.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.577 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 17.2 p -124.72 149.21 61.67 Favored Pre-proline 0 C--N 1.318 -0.794 0 CA-C-O 120.564 0.221 . . . . 0.0 110.865 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -71.05 151.58 61.85 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.132 1.888 . . . . 0.0 110.127 170.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -49.54 124.27 14.97 Favored Pre-proline 0 C--N 1.332 -0.192 0 O-C-N 123.63 0.581 . . . . 0.0 109.638 -179.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.478 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 9.2 Cg_endo -51.71 -22.3 13.01 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 123.739 2.959 . . . . 0.0 113.757 -174.469 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -68.55 -20.03 64.52 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.8 0.333 . . . . 0.0 110.551 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -92.24 -7.78 47.2 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.629 175.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 104.64 96.49 2.42 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.264 -178.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -94.22 147.71 22.91 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.818 0.342 . . . . 0.0 110.175 179.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.489 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 20.6 m95 -111.48 21.35 16.28 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 175.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.567 ' C ' ' H ' ' A' ' 22' ' ' HIS . 4.7 m -56.75 -5.81 0.26 Allowed 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 115.592 1.701 . . . . 0.0 115.592 -174.46 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.1 m -17.21 30.33 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 118.181 2.66 . . . . 0.0 118.181 -140.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' HIS . . . . . 0.567 ' H ' ' C ' ' A' ' 20' ' ' CYS . 24.6 m80 -109.55 -85.37 0.54 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 158.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.6 tttm -156.64 131.14 8.73 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 121.353 -0.139 . . . . 0.0 110.7 167.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.524 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 50.4 t -90.44 105.69 17.98 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 176.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 31.6 m -116.5 147.38 39.55 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.462 -173.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -73.78 119.65 6.0 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.527 2.151 . . . . 0.0 112.415 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -115.19 75.76 0.96 Allowed 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.209 177.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.22 -111.28 3.81 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.235 -178.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 8.4 ptpp? -71.17 -32.73 69.27 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -175.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -127.27 -179.57 4.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.924 0.392 . . . . 0.0 110.998 -172.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.577 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 62.4 m-85 -111.93 147.24 36.28 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 175.117 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.429 ' CZ ' ' HG3' ' A' ' 10' ' ' ARG . 30.5 m-85 -136.42 144.03 44.26 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.799 0.333 . . . . 0.0 110.797 -178.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.438 ' SG ' ' HB3' ' A' ' 11' ' ' CYS . 73.0 m -76.5 103.9 6.73 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.521 176.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -119.02 163.63 16.68 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.488 -178.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -104.8 88.95 3.03 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.23 0.538 . . . . 0.0 110.507 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.237 -0.887 . . . . 0.0 109.787 178.238 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.674 0 N-CA-C 111.832 -0.507 . . . . 0.0 111.832 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.401 ' O ' ' HB3' ' A' ' 3' ' ' TYR . 5.4 t -102.81 57.58 0.77 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.123 0.487 . . . . 0.0 110.618 -178.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.401 ' HB3' ' O ' ' A' ' 2' ' ' THR . 54.3 t80 73.03 -46.25 0.64 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.141 -178.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.476 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 61.7 m -135.13 179.57 6.24 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 174.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 71.9 mt -63.11 130.56 27.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.415 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 1.3 pm0 -68.01 154.74 40.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.769 0.795 . . . . 0.0 111.701 -173.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.522 HD23 ' ND1' ' A' ' 22' ' ' HIS . 0.4 OUTLIER -66.67 120.48 13.54 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.606 -173.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.465 ' HA2' ' NH1' ' A' ' 34' ' ' ARG . . . 116.57 -15.38 14.69 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.772 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.557 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 16.6 mm-40 -84.82 165.92 17.35 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.195 0.522 . . . . 0.0 111.61 -177.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.557 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -82.57 141.88 32.23 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.735 179.361 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.52 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 18.6 p -126.56 153.33 75.3 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 116.738 -0.21 . . . . 0.0 110.76 178.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_endo -70.14 169.11 20.18 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 122.498 2.132 . . . . 0.0 110.853 172.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.431 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 46.8 t-20 -50.02 119.89 10.9 Favored Pre-proline 0 C--N 1.328 -0.348 0 O-C-N 123.351 0.407 . . . . 0.0 110.797 -178.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.431 ' HD2' ' HA ' ' A' ' 13' ' ' ASN . 11.7 Cg_endo -56.41 -16.08 17.13 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 123.886 3.057 . . . . 0.0 113.938 -175.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.412 ' HG2' ' OD1' ' A' ' 13' ' ' ASN . 23.8 mmt180 -63.88 -21.53 66.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.084 0.469 . . . . 0.0 110.39 176.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -81.42 -10.3 59.54 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.653 177.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 120.33 135.88 5.04 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 111.514 -0.635 . . . . 0.0 111.514 -177.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -77.64 103.88 7.84 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.282 0.541 . . . . 0.0 110.327 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.476 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 5.3 m-90 -94.55 8.42 42.29 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-O 121.995 0.902 . . . . 0.0 109.093 172.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.522 ' C ' ' H ' ' A' ' 22' ' ' HIS . 56.1 m -84.75 -2.34 57.5 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 113.903 -1.499 . . . . 0.0 112.087 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.8 m -18.56 28.28 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 118.737 2.866 . . . . 0.0 118.737 -138.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.522 ' H ' ' C ' ' A' ' 20' ' ' CYS . 49.7 m80 -94.77 -82.39 0.37 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 107.025 -1.472 . . . . 0.0 107.025 153.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -155.26 131.34 10.15 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.192 165.371 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.439 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 43.3 t -87.01 100.21 12.45 Favored 'General case' 0 CA--C 1.512 -0.517 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 170.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 4.9 p -121.93 138.96 29.43 Favored Pre-proline 0 C--N 1.312 -1.041 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.548 -166.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -66.51 120.02 7.1 Favored 'Trans proline' 0 N--CA 1.461 -0.416 0 C-N-CA 122.385 2.056 . . . . 0.0 112.394 177.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -119.87 84.36 2.2 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.284 -0.871 . . . . 0.0 108.809 177.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 85.02 -110.93 3.45 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.207 -0.997 . . . . 0.0 111.927 -174.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.407 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 0.9 OUTLIER -106.63 -7.94 17.16 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.374 -0.486 . . . . 0.0 111.969 -177.352 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.407 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 93.1 mtt180 -119.27 172.5 7.56 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.011 0.434 . . . . 0.0 110.6 -178.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.408 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 91.1 m-85 -109.59 140.53 43.29 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.476 -0.784 . . . . 0.0 108.962 173.179 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -136.37 149.54 48.38 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.818 0.342 . . . . 0.0 110.621 -178.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 65.9 m -78.52 96.49 5.44 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 173.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.465 ' NH1' ' HA2' ' A' ' 8' ' ' GLY . 40.4 mmt180 -119.03 165.3 14.29 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.132 -175.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -103.09 86.96 2.79 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 107.34 -1.356 . . . . 0.0 107.34 170.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 . . . . . 0 C--O 1.246 0.885 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.766 -170.798 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.723 0 N-CA-C 112.351 -0.299 . . . . 0.0 112.351 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.2 t -153.26 -178.59 7.06 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -178.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -66.81 128.18 35.3 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.52 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 20.1 p 48.77 -158.25 0.06 Allowed 'General case' 0 N--CA 1.469 0.476 0 O-C-N 124.261 0.975 . . . . 0.0 110.916 -174.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.409 ' HB ' ' SG ' ' A' ' 33' ' ' CYS . 79.6 mt -77.09 133.48 30.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 178.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.483 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 2.4 pm0 -66.0 149.46 50.21 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 121.841 0.829 . . . . 0.0 110.61 -178.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.478 HD23 ' CG ' ' A' ' 22' ' ' HIS . 0.8 OUTLIER -68.78 121.35 16.34 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.726 -1.124 . . . . 0.0 110.682 -171.468 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.427 ' HA2' ' NH1' ' A' ' 34' ' ' ARG . . . 118.61 -21.33 9.83 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.834 -179.212 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.483 ' CG ' ' HG2' ' A' ' 6' ' ' GLU . 14.1 mm-40 -83.09 170.9 14.31 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.091 0.472 . . . . 0.0 111.64 -175.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.447 ' N ' ' HD3' ' A' ' 10' ' ' ARG . 0.4 OUTLIER -81.94 143.48 31.61 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.205 179.316 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.446 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 14.2 p -122.76 149.58 56.48 Favored Pre-proline 0 C--N 1.318 -0.786 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.347 177.136 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.36 159.88 51.44 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.308 2.005 . . . . 0.0 110.347 172.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 50.5 t-20 -50.61 117.2 7.9 Favored Pre-proline 0 C--N 1.328 -0.361 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.46 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 11.6 Cg_endo -55.61 -27.69 61.67 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 123.372 2.715 . . . . 0.0 114.023 -171.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.74 -12.78 60.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.209 0.528 . . . . 0.0 110.494 178.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -105.49 13.82 29.55 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.152 178.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.17 107.3 2.05 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.248 -179.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -96.72 116.99 30.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.779 0.323 . . . . 0.0 110.859 -178.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.52 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 35.6 m95 -116.92 20.95 13.62 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 176.346 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.577 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -80.02 -6.93 58.47 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -171.348 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.7 p -18.06 30.94 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 118.088 2.625 . . . . 0.0 118.088 -141.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.577 ' H ' ' C ' ' A' ' 20' ' ' CYS . 76.9 m80 -113.07 -83.98 0.59 Allowed 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 107.394 -1.335 . . . . 0.0 107.394 162.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -154.04 125.24 7.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.03 167.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.504 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 45.4 t -88.02 88.58 7.69 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 172.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 5.8 p -107.98 135.4 19.86 Favored Pre-proline 0 N--CA 1.44 -0.971 0 CA-C-N 115.074 -0.967 . . . . 0.0 109.895 -168.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -67.24 119.13 6.13 Favored 'Trans proline' 0 N--CA 1.459 -0.53 0 C-N-CA 122.237 1.958 . . . . 0.0 112.209 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -105.27 76.74 1.25 Allowed 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 177.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.92 -110.33 3.3 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.099 -1.048 . . . . 0.0 110.647 -169.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -94.95 -34.37 12.41 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.939 0.399 . . . . 0.0 111.06 179.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -92.56 171.1 9.24 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.977 0.417 . . . . 0.0 111.087 -172.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.504 ' HB3' ' SG ' ' A' ' 24' ' ' CYS . 94.0 m-85 -114.64 140.67 48.63 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.115 177.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -137.68 147.81 45.18 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.201 179.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.409 ' SG ' ' HB ' ' A' ' 5' ' ' ILE . 95.2 m -78.2 101.29 7.01 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 175.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.427 ' NH1' ' HA2' ' A' ' 8' ' ' GLY . 25.9 mmt180 -113.56 160.55 18.41 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.339 179.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -103.13 88.1 3.06 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 . . . . . 0 C--O 1.246 0.879 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.273 -173.775 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.732 0 N-CA-C 111.797 -0.521 . . . . 0.0 111.797 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.662 ' HB ' ' O ' ' A' ' 4' ' ' CYS . 2.0 p -117.0 100.66 7.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.689 0.281 . . . . 0.0 111.688 -177.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 92.8 t80 -58.52 -38.0 76.79 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.954 0.407 . . . . 0.0 109.906 172.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.662 ' O ' ' HB ' ' A' ' 2' ' ' THR . 82.3 m -98.01 143.2 28.82 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 171.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.448 HG13 ' HB2' ' A' ' 19' ' ' TRP . 91.4 mt -67.29 130.15 32.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 116.123 -0.489 . . . . 0.0 109.937 -177.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.517 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.5 pm0 -66.19 149.97 49.5 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.234 -0.893 . . . . 0.0 111.423 -176.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.4 OUTLIER -65.18 121.23 14.28 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.549 -1.205 . . . . 0.0 111.039 -172.758 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 113.73 -11.72 23.08 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 121.003 -0.617 . . . . 0.0 112.551 -179.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -87.14 168.33 13.35 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.364 0.602 . . . . 0.0 111.939 -179.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.488 ' HD2' ' O ' ' A' ' 31' ' ' PHE . 9.0 mmm180 -81.07 139.51 35.65 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.377 177.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.545 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 17.9 p -121.48 142.28 35.21 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.942 178.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -62.04 144.49 96.21 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 C-N-CA 122.13 1.886 . . . . 0.0 110.117 169.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.588 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 3.2 m-20 -49.37 123.8 13.87 Favored Pre-proline 0 C--N 1.328 -0.338 0 O-C-N 123.787 0.679 . . . . 0.0 110.622 -178.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.588 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 9.2 Cg_endo -52.51 -21.6 14.54 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 123.543 2.829 . . . . 0.0 113.53 -174.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.544 ' HD3' ' N ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -59.56 -22.06 61.19 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 175.903 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.588 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 10.2 pt-20 -118.36 19.34 13.44 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.921 0.391 . . . . 0.0 111.14 -179.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 96.96 110.32 2.72 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.992 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -113.65 133.7 55.16 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 176.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.448 ' HB2' HG13 ' A' ' 5' ' ' ILE . 1.1 m95 -101.13 22.45 12.31 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 -179.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.59 ' C ' ' H ' ' A' ' 22' ' ' HIS . 1.6 m -57.57 -6.25 0.46 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 -175.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 16.2 m -17.34 31.54 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 117.753 2.501 . . . . 0.0 117.753 -140.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.59 ' H ' ' C ' ' A' ' 20' ' ' CYS . 71.0 m80 -112.35 -84.4 0.58 Allowed 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 160.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -154.15 127.03 8.23 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.396 169.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.588 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 42.9 t -88.23 89.92 8.18 Favored 'General case' 0 CA--C 1.514 -0.442 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 172.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.7 p -109.29 138.99 20.63 Favored Pre-proline 0 N--CA 1.439 -0.98 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.96 -169.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -65.89 119.07 6.04 Favored 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 122.137 1.892 . . . . 0.0 111.857 178.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.449 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 7.3 mm-40 -113.26 77.28 1.04 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.075 -0.966 . . . . 0.0 109.023 -179.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.92 -110.42 3.31 Favored Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 119.972 -1.108 . . . . 0.0 111.566 -176.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.482 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 10.3 ptpp? -99.5 -5.67 28.88 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -175.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.482 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 96.2 mtt180 -136.38 178.3 7.17 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.617 0.246 . . . . 0.0 110.553 -177.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.488 ' O ' ' HD2' ' A' ' 10' ' ' ARG . 69.4 m-85 -112.46 142.99 44.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.694 178.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.449 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 55.4 m-85 -138.5 151.41 47.35 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.096 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 70.8 m -78.67 103.71 8.79 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 174.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -117.02 161.33 19.57 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.217 -178.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -100.68 88.18 3.54 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.31 0.576 . . . . 0.0 109.639 178.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.0 mm-40 . . . . . 0 C--O 1.247 0.945 0 CA-C-O 118.536 -0.745 . . . . 0.0 109.77 179.486 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.77 0 N-CA-C 112.157 -0.377 . . . . 0.0 112.157 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.41 ' C ' ' H ' ' A' ' 4' ' ' CYS . 11.6 t -175.52 174.15 2.33 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 -179.181 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -79.36 33.85 0.25 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-O 121.441 0.639 . . . . 0.0 111.696 -177.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.506 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 14.2 p -174.57 -162.77 0.13 Allowed 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 177.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 77.1 mt -79.95 134.03 28.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 177.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -78.69 160.76 27.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.514 0.673 . . . . 0.0 111.339 -177.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.482 HD23 ' ND1' ' A' ' 22' ' ' HIS . 0.5 OUTLIER -63.66 127.22 30.38 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.793 -174.457 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.71 -9.48 44.36 Favored Glycine 0 N--CA 1.449 -0.498 0 CA-C-N 115.715 -0.675 . . . . 0.0 113.077 177.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -91.6 175.34 6.94 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.013 0.435 . . . . 0.0 111.447 -177.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.5 mmt85 -80.18 150.52 30.12 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.44 179.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.516 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 26.4 p -136.58 148.66 64.62 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.865 175.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 63.2 Cg_endo -73.29 149.37 45.29 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.238 1.959 . . . . 0.0 110.581 171.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.406 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 51.2 t-20 -48.98 120.39 9.42 Favored Pre-proline 0 C--N 1.33 -0.244 0 O-C-N 123.809 0.693 . . . . 0.0 110.637 -178.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.575 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 14.3 Cg_endo -56.08 -16.52 16.97 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 123.617 2.878 . . . . 0.0 113.435 -175.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 81.9 mtp180 -61.61 -31.7 71.78 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.729 0.299 . . . . 0.0 110.738 176.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -100.24 12.9 35.99 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.853 0.359 . . . . 0.0 110.63 178.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 88.56 108.9 1.08 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.301 -177.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.596 ' OD1' ' HB2' ' A' ' 20' ' ' CYS . 3.0 p30 -102.14 148.78 24.99 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.047 0.451 . . . . 0.0 110.427 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.506 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 26.8 m95 -106.5 31.0 5.53 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.431 0.634 . . . . 0.0 109.318 176.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.596 ' HB2' ' OD1' ' A' ' 18' ' ' ASP . 0.0 OUTLIER -68.1 -6.55 23.52 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 113.721 1.008 . . . . 0.0 113.721 -174.896 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.0 p -20.35 29.22 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 118.584 2.809 . . . . 0.0 118.584 -138.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.529 ' H ' ' C ' ' A' ' 20' ' ' CYS . 3.4 m80 -106.0 -83.63 0.52 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 157.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.522 ' HA ' ' HE3' ' A' ' 23' ' ' LYS . 1.6 tpmt? -154.83 123.79 6.24 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.973 171.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.575 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 47.8 t -87.29 93.88 9.51 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 173.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.8 p -110.74 133.56 21.17 Favored Pre-proline 0 N--CA 1.439 -1.024 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.348 -171.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -67.36 121.66 8.81 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.496 2.131 . . . . 0.0 112.412 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -111.59 78.87 1.15 Allowed 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 173.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.5 -116.45 4.23 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -175.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -94.25 -8.09 40.15 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.5 0.667 . . . . 0.0 110.092 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 68.3 mtm180 -110.05 171.51 7.41 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.859 -174.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.465 ' HB3' ' SG ' ' A' ' 11' ' ' CYS . 94.0 m-85 -129.01 139.1 52.22 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.529 175.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -139.39 152.39 47.07 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 120.901 0.382 . . . . 0.0 110.656 -179.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 88.8 m -80.3 103.08 9.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.757 174.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 -119.29 161.61 20.14 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.474 -178.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -95.58 88.85 5.17 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.41 0.624 . . . . 0.0 109.824 178.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 . . . . . 0 C--O 1.247 0.969 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.541 -179.408 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.81 0 N-CA-C 112.587 -0.205 . . . . 0.0 112.587 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.585 HG23 ' O ' ' A' ' 4' ' ' CYS . 5.2 t -172.05 174.15 4.16 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 177.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -54.29 -50.15 67.98 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.782 0.325 . . . . 0.0 111.302 -177.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.585 ' O ' HG23 ' A' ' 2' ' ' THR . 84.6 m -101.34 -179.1 3.93 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 83.7 mt -80.35 122.32 35.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 174.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.458 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.6 pm0 -61.88 145.31 53.14 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.772 0.796 . . . . 0.0 111.271 -174.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.447 ' HA ' HD22 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -65.64 124.84 23.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.55 -1.205 . . . . 0.0 110.829 -171.692 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 115.26 -21.21 13.32 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.771 -177.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.413 ' CG ' ' HG2' ' A' ' 6' ' ' GLU . 76.0 mm-40 -79.48 173.8 12.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.194 0.521 . . . . 0.0 111.789 -177.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.573 ' H ' ' HD3' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -80.67 155.78 26.64 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.318 -0.855 . . . . 0.0 109.82 172.964 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 12.1 p -136.45 146.07 54.29 Favored Pre-proline 0 C--N 1.319 -0.736 0 C-N-CA 121.156 -0.217 . . . . 0.0 110.545 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -65.8 161.29 39.83 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 122.404 2.069 . . . . 0.0 110.85 172.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.411 ' HA ' ' HD2' ' A' ' 14' ' ' PRO . 4.2 m-20 -49.92 118.61 8.99 Favored Pre-proline 0 C--N 1.33 -0.278 0 O-C-N 123.584 0.552 . . . . 0.0 110.919 -179.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.473 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 11.6 Cg_endo -57.46 -23.87 58.15 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.897 2.398 . . . . 0.0 112.568 -179.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 36.7 mtp180 -68.18 -24.53 64.97 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.305 175.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -98.76 0.29 44.15 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.886 0.374 . . . . 0.0 110.513 -177.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.16 95.62 2.4 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.38 -179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.479 ' OD2' ' HB2' ' A' ' 20' ' ' CYS . 4.2 p-10 -99.86 148.68 24.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.079 0.466 . . . . 0.0 110.521 179.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -107.4 31.17 5.61 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.529 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -71.83 -8.78 56.38 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -171.092 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 24.6 p -19.86 29.38 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 118.576 2.806 . . . . 0.0 118.576 -140.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.529 ' H ' ' C ' ' A' ' 20' ' ' CYS . 17.3 m80 -103.02 -88.91 0.39 Allowed 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 157.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.407 ' CE ' ' HB2' ' A' ' 36' ' ' GLN . 21.9 ttmm -155.83 124.62 6.02 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 120.756 0.312 . . . . 0.0 110.488 169.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.473 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 53.5 t -90.72 104.29 16.9 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 176.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 16.1 m -111.63 150.32 42.04 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.6 -173.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -76.52 118.96 5.04 Favored 'Trans proline' 0 N--CA 1.455 -0.787 0 C-N-CA 122.629 2.219 . . . . 0.0 111.997 178.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -113.78 75.76 0.94 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.011 178.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.1 -111.73 3.32 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.488 -0.863 . . . . 0.0 111.948 -178.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.404 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 18.6 ptpt -85.62 -23.66 27.44 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -176.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.404 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 65.0 mtt180 -127.72 168.86 14.51 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.916 0.389 . . . . 0.0 111.139 -174.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 93.4 m-85 -105.71 144.15 32.85 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.93 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -135.48 149.92 49.66 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.148 0.499 . . . . 0.0 110.749 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -84.84 105.43 15.61 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.46 -176.294 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.417 ' C ' HD21 ' A' ' 7' ' ' LEU . 37.7 mmt180 -122.04 163.29 19.65 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.767 -175.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -110.39 89.6 3.08 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.312 0.577 . . . . 0.0 111.041 -177.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.407 ' HB2' ' CE ' ' A' ' 23' ' ' LYS . 2.0 mp0 . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.372 -0.823 . . . . 0.0 109.58 175.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.825 0 N-CA-C 112.166 -0.373 . . . . 0.0 112.166 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 12.6 t -171.14 166.97 7.22 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 60.9 m-85 -84.28 108.77 17.33 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 -178.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 15.1 p 55.06 -170.28 0.07 Allowed 'General case' 0 CA--C 1.538 0.488 0 O-C-N 124.518 1.137 . . . . 0.0 111.294 -176.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 95.9 mt -75.51 137.65 22.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 O-C-N 122.067 -0.396 . . . . 0.0 110.844 -175.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.422 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 23.1 mm-40 -65.07 147.43 53.48 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.712 0.768 . . . . 0.0 111.78 -176.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.457 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.6 OUTLIER -71.43 119.71 15.97 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.801 -1.091 . . . . 0.0 109.72 -177.451 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.54 -16.64 28.89 Favored Glycine 0 N--CA 1.449 -0.476 0 CA-C-N 115.718 -0.673 . . . . 0.0 112.309 -174.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.501 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 10.4 mm-40 -80.83 168.76 18.41 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.045 0.45 . . . . 0.0 111.341 -178.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.501 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -83.86 137.02 33.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.648 -0.705 . . . . 0.0 109.594 177.409 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.6 p -126.61 156.28 73.52 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 116.853 -0.158 . . . . 0.0 111.376 -175.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -72.73 156.21 53.41 Favored 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.706 2.271 . . . . 0.0 111.363 173.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.492 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 52.1 t-20 -50.83 118.2 9.68 Favored Pre-proline 0 CA--C 1.531 0.248 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.003 -177.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.415 ' HA ' ' HB3' ' A' ' 18' ' ' ASP . 19.1 Cg_endo -59.47 -17.25 39.92 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 123.129 2.553 . . . . 0.0 113.147 -177.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -66.16 -25.34 66.91 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.698 0.285 . . . . 0.0 110.84 177.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 12.2 pt-20 -105.43 18.77 21.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.048 0.451 . . . . 0.0 110.441 177.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 91.13 104.0 1.32 Allowed Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.091 -179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.415 ' HB3' ' HA ' ' A' ' 14' ' ' PRO . 19.0 p-10 -94.05 124.28 37.97 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.079 0.466 . . . . 0.0 110.813 179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.473 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 12.6 m95 -84.06 38.8 0.67 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.91 0.862 . . . . 0.0 108.818 177.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.567 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -85.14 -5.84 59.32 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.242 -1.345 . . . . 0.0 113.124 -170.339 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.2 p -16.4 30.0 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 118.265 2.691 . . . . 0.0 118.265 -140.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.567 ' H ' ' C ' ' A' ' 20' ' ' CYS . 31.3 m80 -107.07 -94.42 0.38 Allowed 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 153.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.578 ' HE2' ' HA ' ' A' ' 23' ' ' LYS . 0.2 OUTLIER -156.37 118.92 4.06 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 120.89 0.376 . . . . 0.0 111.295 168.689 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.551 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 42.8 t -80.0 124.04 28.35 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 173.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.1 m -130.36 159.19 71.81 Favored Pre-proline 0 C--N 1.317 -0.815 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.226 -176.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -80.7 120.08 3.82 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.812 2.341 . . . . 0.0 112.303 -177.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.495 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 10.8 mm-40 -113.03 75.5 0.92 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.246 -0.888 . . . . 0.0 108.99 177.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.8 -111.04 3.61 Favored Glycine 0 N--CA 1.446 -0.7 0 C-N-CA 120.239 -0.981 . . . . 0.0 111.929 -176.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.6 pttm -79.72 -29.65 40.72 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -175.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -125.54 175.7 7.36 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.956 0.408 . . . . 0.0 111.356 -174.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.551 ' HB3' ' SG ' ' A' ' 24' ' ' CYS . 97.2 m-85 -110.79 141.27 44.34 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.379 -179.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.495 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 27.8 m-85 -131.31 149.4 52.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.441 -178.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -84.1 110.25 18.34 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.794 -177.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.5 mmt180 -120.75 160.77 22.67 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.717 -176.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -98.14 88.15 4.13 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.677 0.751 . . . . 0.0 110.595 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 . . . . . 0 C--O 1.246 0.878 0 CA-C-O 118.495 -0.764 . . . . 0.0 110.376 178.34 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.492 0 N-CA-C 111.848 -0.501 . . . . 0.0 111.848 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.451 HG22 ' HG3' ' A' ' 6' ' ' GLU . 15.1 t -106.67 39.07 1.91 Allowed 'General case' 0 C--N 1.323 -0.543 0 CA-C-O 121.129 0.49 . . . . 0.0 110.567 -179.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 69.6 m-85 65.18 97.45 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.204 -172.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 73.62 -177.42 0.17 Allowed 'General case' 0 CA--C 1.532 0.272 0 O-C-N 124.385 1.053 . . . . 0.0 109.191 -167.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 82.1 mt -73.46 134.4 29.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.159 0.504 . . . . 0.0 111.31 -173.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.466 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 3.8 mp0 -59.45 151.24 24.43 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.043 -0.981 . . . . 0.0 111.028 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.524 HD23 ' CG ' ' A' ' 22' ' ' HIS . 1.4 tm? -75.2 121.49 22.21 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.444 -178.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 107.72 -5.51 34.94 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.161 -176.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.466 ' HG3' ' HB2' ' A' ' 6' ' ' GLU . 8.7 mm-40 -91.19 170.95 9.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.707 0.289 . . . . 0.0 110.237 178.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.13 150.52 25.48 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 177.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 25.4 p -129.64 145.81 58.54 Favored Pre-proline 0 C--N 1.318 -0.781 0 C-N-CA 121.055 -0.258 . . . . 0.0 110.308 179.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -68.04 154.07 73.49 Favored 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.039 1.826 . . . . 0.0 110.325 173.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 44.9 t-20 -49.17 121.76 11.24 Favored Pre-proline 0 C--N 1.33 -0.257 0 O-C-N 123.748 0.655 . . . . 0.0 109.92 -177.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.465 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 10.3 Cg_endo -51.84 -26.48 24.34 Favored 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 123.73 2.953 . . . . 0.0 114.14 -172.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -77.38 -12.41 59.95 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.686 -0.406 . . . . 0.0 110.727 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.5 mm-40 -101.54 13.64 34.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.885 -179.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 85.75 80.7 1.14 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.621 178.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -88.65 147.2 24.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.002 0.43 . . . . 0.0 110.586 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.7 m0 -106.25 29.79 6.49 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 174.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.535 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.5 OUTLIER -63.97 -8.01 10.17 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 -171.241 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 11.5 p -20.8 30.17 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 118.462 2.764 . . . . 0.0 118.462 -141.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.535 ' H ' ' C ' ' A' ' 20' ' ' CYS . 78.3 m80 -111.07 -83.48 0.57 Allowed 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 164.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.418 ' HG2' ' HB ' ' A' ' 25' ' ' VAL . 24.9 ttmm -154.92 118.84 4.61 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.974 168.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.465 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 20.1 t -82.55 89.64 6.7 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 173.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.418 ' HB ' ' HG2' ' A' ' 23' ' ' LYS . 7.1 p -109.48 135.81 20.29 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-N 115.002 -0.999 . . . . 0.0 110.093 -170.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -64.15 119.53 6.6 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 122.06 1.84 . . . . 0.0 111.918 178.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -111.69 75.79 0.94 Allowed 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 178.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 82.93 -109.92 3.17 Favored Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 119.542 -1.313 . . . . 0.0 111.369 -173.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.467 ' NZ ' ' HB2' ' A' ' 29' ' ' LYS . 4.6 ttmp? -91.77 -35.51 14.08 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.843 0.354 . . . . 0.0 111.569 -177.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -103.62 178.26 4.61 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.074 0.464 . . . . 0.0 111.199 -173.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -116.34 140.08 49.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.745 176.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -139.44 150.53 45.34 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.765 0.317 . . . . 0.0 110.541 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 67.4 m -77.58 103.25 7.41 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.047 176.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -116.5 157.94 24.41 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.231 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -104.95 88.76 2.96 Favored 'General case' 0 C--N 1.314 -0.935 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 177.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 . . . . . 0 C--O 1.251 1.162 0 CA-C-O 118.705 -0.664 . . . . 0.0 109.881 -179.968 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.75 0 N-CA-C 112.118 -0.393 . . . . 0.0 112.118 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 9.9 t -67.53 154.48 41.31 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.706 0.289 . . . . 0.0 110.508 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -82.27 43.46 0.8 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.788 0.804 . . . . 0.0 110.09 176.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 77.6 m -152.52 -177.1 6.01 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.267 -1.333 . . . . 0.0 107.913 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 83.2 mt -68.99 136.69 25.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 176.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -62.12 148.27 44.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.663 0.744 . . . . 0.0 110.995 -178.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.516 HD23 ' CG ' ' A' ' 22' ' ' HIS . 1.0 OUTLIER -74.28 117.62 16.31 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.937 -1.028 . . . . 0.0 110.008 -175.041 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 114.24 -13.77 21.25 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 115.477 -0.783 . . . . 0.0 112.131 -175.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -82.3 170.71 15.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.008 0.432 . . . . 0.0 110.799 -179.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.436 ' N ' ' HD3' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -87.23 141.31 28.75 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.588 178.118 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 26.1 p -127.42 148.46 66.51 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 110.268 -0.271 . . . . 0.0 110.268 -179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.85 161.72 44.14 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.282 1.988 . . . . 0.0 111.021 175.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -50.05 118.35 8.83 Favored Pre-proline 0 C--N 1.329 -0.311 0 O-C-N 123.462 0.476 . . . . 0.0 109.886 178.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -54.03 -19.29 15.41 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 123.433 2.756 . . . . 0.0 113.501 -174.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.4 mmm180 -68.16 -18.46 64.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.897 177.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -92.85 -4.7 52.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.507 178.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 125.56 98.04 1.13 Allowed Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.73 -0.748 . . . . 0.0 111.589 -175.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -78.24 114.07 16.79 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.819 0.342 . . . . 0.0 110.859 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 3.5 m0 -110.44 13.68 22.72 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.265 176.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.613 ' C ' ' H ' ' A' ' 22' ' ' HIS . 51.2 t -74.03 -9.21 58.4 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -176.503 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 29.7 p -17.69 31.62 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 117.643 2.46 . . . . 0.0 117.643 -138.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.613 ' H ' ' C ' ' A' ' 20' ' ' CYS . 73.3 m80 -99.38 -87.37 0.36 Allowed 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 106.865 -1.532 . . . . 0.0 106.865 159.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.7 ttmm -155.1 117.84 4.31 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.297 164.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 45.4 t -80.37 91.03 5.63 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 172.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.4 p -110.15 138.99 20.98 Favored Pre-proline 0 C--N 1.313 -0.99 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.244 -167.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -59.73 119.7 7.07 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.212 1.941 . . . . 0.0 111.536 177.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -120.81 77.61 1.31 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.38 -0.827 . . . . 0.0 108.945 -177.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.26 -111.09 3.42 Favored Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.307 -0.949 . . . . 0.0 111.528 -174.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 63.8 tttp -94.64 -24.6 17.12 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.872 0.368 . . . . 0.0 111.331 -177.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 81.3 mtp180 -119.47 176.29 5.42 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.482 -174.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.469 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 97.3 m-85 -103.14 140.72 36.96 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.897 176.067 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -132.05 150.41 52.16 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.284 -179.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.412 ' O ' HD22 ' A' ' 7' ' ' LEU . 6.2 t -84.14 97.31 9.28 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -114.43 160.51 19.08 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.382 -174.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -103.9 90.07 3.5 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.005 178.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 . . . . . 0 C--O 1.246 0.911 0 CA-C-O 118.421 -0.8 . . . . 0.0 109.691 178.451 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.841 0 N-CA-C 112.191 -0.364 . . . . 0.0 112.191 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.463 HG22 ' HA ' ' A' ' 6' ' ' GLU . 12.4 t -161.56 36.71 0.13 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.538 0.685 . . . . 0.0 109.613 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 70.32 -58.43 0.55 Allowed 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 114.993 -1.003 . . . . 0.0 111.354 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.544 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 47.8 m -96.08 -163.05 1.01 Allowed 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 176.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.443 ' HB ' ' SG ' ' A' ' 33' ' ' CYS . 77.7 mt -59.43 130.95 23.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 121.031 0.443 . . . . 0.0 109.928 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.488 ' H ' ' CD ' ' A' ' 6' ' ' GLU . 1.8 pm0 -69.46 150.95 46.66 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.93 0.871 . . . . 0.0 111.358 -177.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.42 HD23 ' ND1' ' A' ' 22' ' ' HIS . 0.5 OUTLIER -68.46 115.62 8.09 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.338 -1.301 . . . . 0.0 110.58 -171.44 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 116.91 -13.45 14.45 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.358 -176.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -84.17 170.78 13.43 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.247 0.546 . . . . 0.0 111.694 179.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.481 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 9.5 mpt_? -79.92 155.33 27.78 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.303 -177.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.461 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 30.2 t -135.13 140.22 34.12 Favored Pre-proline 0 C--N 1.316 -0.852 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.555 -179.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.34 162.74 41.41 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.769 2.313 . . . . 0.0 110.551 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.1 t-20 -53.79 112.79 4.11 Favored Pre-proline 0 C--N 1.331 -0.223 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.67 -15.73 21.93 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.442 2.762 . . . . 0.0 113.943 -171.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.9 ptm180 -63.99 -25.46 68.14 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.011 0.434 . . . . 0.0 110.414 175.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -88.05 -2.97 58.93 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.47 178.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 131.14 156.22 8.44 Favored Glycine 0 N--CA 1.445 -0.708 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 -177.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -123.35 109.94 14.54 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.358 0.579 . . . . 0.0 111.102 -178.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.544 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 45.3 t-105 -107.16 21.9 16.82 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 122.092 0.948 . . . . 0.0 108.563 173.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.511 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -83.73 -5.27 59.15 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.571 -1.195 . . . . 0.0 112.161 -175.187 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 22.4 m -20.84 30.62 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 118.672 2.841 . . . . 0.0 118.672 -142.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.511 ' H ' ' C ' ' A' ' 20' ' ' CYS . 57.1 m80 -107.65 -83.48 0.54 Allowed 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 159.134 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.4 tttm -154.28 122.33 5.99 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.805 167.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 47.2 t -80.95 91.9 6.09 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 175.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 5.7 p -114.2 137.56 22.55 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.028 -169.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -66.64 120.07 7.15 Favored 'Trans proline' 0 N--CA 1.462 -0.382 0 C-N-CA 122.508 2.139 . . . . 0.0 112.523 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -111.02 76.88 1.0 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.07 -0.968 . . . . 0.0 108.774 178.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.77 -111.08 3.45 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.263 -0.97 . . . . 0.0 111.833 -172.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 5.4 ptpp? -97.32 -23.81 15.95 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 117.055 0.428 . . . . 0.0 111.98 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 86.2 mtt180 -111.49 168.71 9.33 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.009 0.433 . . . . 0.0 110.978 -176.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.461 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 98.4 m-85 -104.05 143.94 32.23 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.711 176.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 59.6 m-85 -139.55 154.36 47.63 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.443 ' SG ' ' HB ' ' A' ' 5' ' ' ILE . 95.5 m -82.58 105.13 13.37 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.779 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.0 mmt180 -116.18 157.93 24.06 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.882 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -94.63 87.73 5.18 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 122.022 0.915 . . . . 0.0 110.017 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 85.2 mm-40 . . . . . 0 C--O 1.249 1.033 0 CA-C-N 114.981 -1.009 . . . . 0.0 109.923 -178.974 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.766 0 N-CA-C 111.692 -0.563 . . . . 0.0 111.692 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 11.5 t -107.92 151.8 25.3 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -85.88 54.02 2.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.51 0.671 . . . . 0.0 110.531 -176.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 19' ' ' TRP . 13.6 p -175.19 -175.93 0.88 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.197 -0.911 . . . . 0.0 109.061 176.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.422 ' CG2' ' HB2' ' A' ' 9' ' ' GLU . 77.9 mt -73.09 130.94 35.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.903 0.382 . . . . 0.0 110.114 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.456 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 3.4 pm0 -72.17 159.92 33.31 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.672 0.748 . . . . 0.0 111.176 -176.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.461 HD23 ' CG ' ' A' ' 22' ' ' HIS . 0.4 OUTLIER -70.3 120.6 16.21 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.017 -171.589 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 112.46 -9.42 26.33 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.616 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.475 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 16.0 mm-40 -89.98 167.23 12.96 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.022 0.439 . . . . 0.0 111.226 -179.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.475 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -78.2 142.4 37.96 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.966 -179.628 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.461 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 24.2 p -128.12 148.77 68.93 Favored Pre-proline 0 C--N 1.318 -0.799 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.44 177.283 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -72.12 150.74 54.46 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.335 2.023 . . . . 0.0 110.621 172.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.422 ' OD1' ' HG2' ' A' ' 15' ' ' ARG . 45.2 t-20 -49.67 122.77 13.78 Favored Pre-proline 0 C--N 1.333 -0.119 0 O-C-N 123.659 0.6 . . . . 0.0 110.238 -177.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.467 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 10.1 Cg_endo -51.28 -28.31 26.11 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 124.007 3.138 . . . . 0.0 114.065 -173.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.422 ' HG2' ' OD1' ' A' ' 13' ' ' ASN . 14.4 ptm180 -69.85 -18.49 63.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.907 0.384 . . . . 0.0 110.845 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -93.62 -8.54 40.79 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.374 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 105.31 86.31 1.91 Allowed Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.158 -177.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.467 ' OD2' ' HB2' ' A' ' 20' ' ' CYS . 8.5 p-10 -90.09 146.85 24.01 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.976 0.417 . . . . 0.0 111.043 -178.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.491 ' O ' ' HB2' ' A' ' 4' ' ' CYS . 36.7 m95 -107.44 35.67 2.99 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 176.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.592 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -70.97 -6.77 41.3 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 114.668 1.358 . . . . 0.0 114.668 -171.194 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.9 p -17.9 30.1 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.984 0 N-CA-C 117.952 2.575 . . . . 0.0 117.952 -139.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.592 ' H ' ' C ' ' A' ' 20' ' ' CYS . 77.6 m80 -109.36 -91.65 0.45 Allowed 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 159.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 54.9 tttm -154.2 129.11 9.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 167.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.467 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 42.4 t -89.08 103.13 15.77 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 178.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 28.5 m -115.44 147.68 39.25 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.004 -175.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -75.15 119.41 5.59 Favored 'Trans proline' 0 N--CA 1.452 -0.925 0 C-N-CA 122.44 2.093 . . . . 0.0 111.935 178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -110.74 74.96 0.9 Allowed 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 178.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.14 -110.49 3.05 Favored Glycine 0 N--CA 1.444 -0.832 0 C-N-CA 120.036 -1.078 . . . . 0.0 112.177 -177.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 20.3 pttm -87.98 -16.0 34.94 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -175.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -125.31 179.37 5.12 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.086 0.47 . . . . 0.0 111.352 -176.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.461 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 90.8 m-85 -117.58 143.76 45.8 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.169 171.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -138.81 148.82 44.23 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.962 0.41 . . . . 0.0 110.666 -179.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 98.4 m -75.86 103.71 6.06 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.598 174.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 35.0 mmt180 -113.07 159.22 19.41 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.486 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -94.37 88.74 5.63 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 176.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 . . . . . 0 C--N 1.315 -0.893 0 CA-C-N 115.341 -0.845 . . . . 0.0 109.428 -177.92 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.8 0 N-CA-C 111.983 -0.447 . . . . 0.0 111.983 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.8 t -116.66 158.11 24.31 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 22.9 p90 -75.48 -4.41 39.57 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.412 0.625 . . . . 0.0 110.662 177.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.604 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 62.7 m -106.87 -162.43 0.85 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.301 176.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.449 ' HB ' ' HA ' ' A' ' 20' ' ' CYS . 88.3 mt -71.29 136.14 26.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 121.01 0.433 . . . . 0.0 110.156 177.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -62.53 151.4 37.68 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.203 -178.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.502 HD23 ' CG ' ' A' ' 22' ' ' HIS . 0.9 OUTLIER -76.61 121.96 23.95 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.656 -177.632 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 105.33 -6.78 42.68 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.876 -0.678 . . . . 0.0 111.908 -175.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -83.77 173.99 10.83 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.001 0.429 . . . . 0.0 110.875 177.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.52 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 7.3 mpt_? -96.58 142.88 28.11 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.441 177.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.3 p -124.61 152.04 68.36 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-O 120.635 0.255 . . . . 0.0 110.989 -177.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -69.7 151.77 69.46 Favored 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.369 2.046 . . . . 0.0 110.755 172.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.584 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 46.9 t-20 -50.18 116.23 6.3 Favored Pre-proline 0 C--N 1.33 -0.282 0 O-C-N 123.704 0.627 . . . . 0.0 110.33 -178.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.557 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 9.9 Cg_endo -52.97 -22.48 18.57 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.505 2.804 . . . . 0.0 114.033 -171.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.482 ' HG3' ' OD1' ' A' ' 13' ' ' ASN . 0.0 OUTLIER -66.77 -14.65 62.86 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 178.864 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.584 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 11.4 pt-20 -107.57 10.3 29.23 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.765 0.317 . . . . 0.0 110.93 177.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 98.0 103.56 2.3 Favored Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.448 179.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -101.94 147.5 26.47 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.276 0.56 . . . . 0.0 110.501 179.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.604 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 1.2 m-90 -108.33 31.12 5.81 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 174.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.581 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -74.96 -9.51 58.6 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 113.514 0.931 . . . . 0.0 113.514 -169.386 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.9 m -18.75 30.86 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 118.013 2.597 . . . . 0.0 118.013 -141.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.581 ' H ' ' C ' ' A' ' 20' ' ' CYS . 70.5 m80 -104.78 -88.84 0.42 Allowed 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 162.077 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 51.5 tttm -155.07 120.7 5.06 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 166.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.557 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 46.3 t -83.57 94.25 8.03 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 174.218 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 10.0 p -115.84 137.18 23.11 Favored Pre-proline 0 N--CA 1.439 -1.003 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.256 -168.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -60.08 127.4 23.08 Favored 'Trans proline' 0 N--CA 1.462 -0.334 0 C-N-CA 122.721 2.281 . . . . 0.0 112.863 -178.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.52 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 7.1 mm-40 -124.58 91.34 3.42 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.884 -1.053 . . . . 0.0 108.779 176.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.8 -111.82 3.49 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.371 -0.919 . . . . 0.0 111.595 -177.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.67 3.52 24.81 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.85 0.357 . . . . 0.0 110.982 -179.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 50.7 mtt180 -126.16 -179.22 4.62 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.166 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -120.73 139.94 52.35 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.786 176.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.52 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 17.7 m-85 -131.9 154.51 49.15 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.372 0.606 . . . . 0.0 110.851 -177.05 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.82 99.67 12.63 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.172 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.9 mmt180 -110.32 161.31 15.75 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.777 -177.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -102.38 88.34 3.25 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.281 0.562 . . . . 0.0 109.672 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.44 ' HA ' ' OE1' ' A' ' 36' ' ' GLN . 14.6 mm-40 . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.442 -0.789 . . . . 0.0 109.844 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.891 0 N-CA-C 111.867 -0.493 . . . . 0.0 111.867 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.426 ' O ' ' HB3' ' A' ' 3' ' ' TYR . 3.7 t -175.65 76.42 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 121.016 0.436 . . . . 0.0 110.417 -177.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.426 ' HB3' ' O ' ' A' ' 2' ' ' THR . 50.6 t80 70.98 -49.01 0.68 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.252 0.621 . . . . 0.0 111.188 -177.118 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 71.9 m -134.86 151.17 50.69 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 173.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 75.5 mt -64.51 123.51 17.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 -179.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.447 ' CD ' ' H ' ' A' ' 6' ' ' GLU . 1.4 pm0 -68.09 156.15 38.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.966 0.889 . . . . 0.0 111.975 -172.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.47 123.94 20.06 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.134 -1.394 . . . . 0.0 110.952 -174.141 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.65 -14.66 29.65 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.877 -0.677 . . . . 0.0 112.484 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.4 mm-40 -85.29 168.72 14.45 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.11 0.481 . . . . 0.0 111.197 -179.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.81 138.22 31.67 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.715 179.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.46 ' HB3' ' SG ' ' A' ' 20' ' ' CYS . 22.4 p -120.03 146.91 43.3 Favored Pre-proline 0 C--N 1.318 -0.788 0 C-N-CA 121.014 -0.275 . . . . 0.0 110.977 -179.018 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -63.68 150.37 88.61 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.287 1.991 . . . . 0.0 109.941 168.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.611 ' O ' ' HG2' ' A' ' 16' ' ' GLU . 45.8 t-20 -49.4 122.6 12.75 Favored Pre-proline 0 C--N 1.329 -0.306 0 O-C-N 123.592 0.558 . . . . 0.0 110.098 -179.369 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.645 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 12.0 Cg_endo -55.02 -17.58 14.77 Favored 'Trans proline' 0 C--N 1.349 0.565 0 C-N-CA 123.3 2.667 . . . . 0.0 113.48 -173.533 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -70.44 -22.0 62.74 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.97 177.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 13' ' ' ASN . 12.7 pt-20 -106.75 13.48 27.92 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.045 0.45 . . . . 0.0 110.411 178.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 129.15 126.25 2.83 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 121.014 -0.613 . . . . 0.0 112.297 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -111.52 107.36 16.51 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.879 0.371 . . . . 0.0 110.27 -178.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 1.7 m95 -111.02 11.34 22.1 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.181 0.515 . . . . 0.0 110.075 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.559 ' C ' ' H ' ' A' ' 22' ' ' HIS . 1.0 OUTLIER -71.49 -4.95 29.52 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 113.832 1.049 . . . . 0.0 113.832 -172.636 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 10.7 m -18.24 29.79 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 118.387 2.736 . . . . 0.0 118.387 -139.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.559 ' H ' ' C ' ' A' ' 20' ' ' CYS . 37.0 m80 -106.44 -83.61 0.52 Allowed 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 158.017 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -154.89 123.98 6.29 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.293 167.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.645 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 49.1 t -86.38 91.65 8.58 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 173.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 6.6 p -114.85 139.74 24.57 Favored Pre-proline 0 C--N 1.313 -1.005 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.926 -169.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -57.62 126.07 20.7 Favored 'Trans proline' 0 C--O 1.235 0.361 0 C-N-CA 122.659 2.239 . . . . 0.0 112.508 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -122.99 76.44 1.37 Allowed 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.08 -111.71 3.49 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.584 -0.817 . . . . 0.0 111.337 -173.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 58.6 tttp -92.23 -36.27 13.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.216 0.532 . . . . 0.0 110.779 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 87.6 mtt180 -100.89 178.86 4.56 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.328 -174.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 90.2 m-85 -113.39 143.83 43.8 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.018 -0.537 . . . . 0.0 109.754 178.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -135.48 148.13 49.11 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.465 -176.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 88.1 m -78.51 101.87 7.58 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 174.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -112.96 160.59 17.93 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.743 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -100.9 88.04 3.45 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 176.338 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.37 -0.824 . . . . 0.0 109.546 -178.472 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.769 0 N-CA-C 112.147 -0.381 . . . . 0.0 112.147 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 54.6 m -86.36 101.29 12.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.424 0.154 . . . . 0.0 111.255 -178.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -66.53 -40.61 89.23 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.43 0.633 . . . . 0.0 109.746 171.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -153.8 158.64 41.19 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.096 -0.956 . . . . 0.0 108.657 178.008 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 93.5 mt -52.98 131.95 15.13 Favored 'Isoleucine or valine' 0 C--O 1.236 0.364 0 CA-C-O 121.287 0.565 . . . . 0.0 111.973 -171.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.2 mp0 -61.29 157.22 16.91 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.324 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.581 HD23 ' CG ' ' A' ' 22' ' ' HIS . 1.1 tm? -79.88 126.59 31.19 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.069 -175.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 102.95 -7.93 53.42 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.96 -176.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -86.64 174.04 9.14 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.169 0.509 . . . . 0.0 111.25 -178.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -85.77 143.47 28.29 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.452 176.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 27.0 p -133.63 152.7 79.45 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.698 -179.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -77.98 154.07 29.32 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.66 2.24 . . . . 0.0 111.3 173.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -50.31 117.47 7.96 Favored Pre-proline 0 C--O 1.234 0.274 0 O-C-N 123.487 0.492 . . . . 0.0 110.118 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.435 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 18.3 Cg_endo -58.51 -13.68 18.04 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 123.347 2.698 . . . . 0.0 113.491 -172.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -66.79 -21.99 66.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.961 178.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -118.17 21.25 12.85 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.862 0.363 . . . . 0.0 111.486 -177.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 130.8 98.0 0.78 Allowed Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.542 178.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -92.18 106.91 18.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.971 0.415 . . . . 0.0 110.578 177.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 39.4 m95 -113.47 28.12 9.03 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.806 0.812 . . . . 0.0 109.174 178.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.592 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -85.15 -5.87 59.32 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 114.628 -1.169 . . . . 0.0 113.471 -170.73 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 14.6 p -14.25 29.76 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 117.796 2.517 . . . . 0.0 117.796 -139.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.592 ' H ' ' C ' ' A' ' 20' ' ' CYS . 72.9 m80 -111.22 -92.82 0.45 Allowed 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 164.032 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.2 tttm -155.22 118.41 4.4 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 165.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.435 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 42.2 t -82.2 102.4 11.1 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 174.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 9.9 p -121.6 136.09 25.7 Favored Pre-proline 0 N--CA 1.438 -1.065 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.52 -169.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -64.0 119.75 6.89 Favored 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 122.472 2.115 . . . . 0.0 112.25 179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.408 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 5.7 mm-40 -113.74 76.91 1.01 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.293 -0.867 . . . . 0.0 108.73 178.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.6 -111.6 3.51 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.314 -0.946 . . . . 0.0 111.991 -174.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.51 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 18.3 ptpt -102.05 -8.3 21.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.887 0.343 . . . . 0.0 111.912 -175.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.51 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 95.4 mtt180 -127.97 171.64 11.64 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.843 0.354 . . . . 0.0 110.272 -178.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.409 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 93.1 m-85 -110.1 139.99 44.64 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.388 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.408 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 62.4 m-85 -134.73 151.8 51.27 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.736 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -86.0 103.93 15.15 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -179.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -115.17 158.82 21.71 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.151 -175.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -100.28 91.46 4.74 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.753 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.565 -0.731 . . . . 0.0 109.565 179.221 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.785 0 N-CA-C 112.196 -0.362 . . . . 0.0 112.196 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.1 m 66.27 66.51 0.47 Allowed 'General case' 0 C--O 1.236 0.368 0 CA-C-O 121.578 0.704 . . . . 0.0 110.452 -177.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 29.2 p90 -69.85 -28.95 66.1 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.999 173.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 65.0 m -127.3 142.33 51.49 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 171.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.471 HG22 ' HB2' ' A' ' 9' ' ' GLU . 75.7 mt -65.69 135.26 28.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.154 -176.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.7 mp0 -56.44 145.36 27.85 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 121.524 0.678 . . . . 0.0 111.307 -178.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.491 HD23 ' ND1' ' A' ' 22' ' ' HIS . 1.5 tm? -68.82 121.29 16.24 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.653 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 109.21 -8.34 33.05 Favored Glycine 0 N--CA 1.448 -0.564 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.139 -176.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.471 ' HB2' HG22 ' A' ' 5' ' ' ILE . 61.8 mm-40 -86.99 175.76 7.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.019 0.438 . . . . 0.0 110.969 179.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -91.53 144.85 25.13 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.132 179.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 9.4 p -129.46 147.17 64.05 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.65 179.03 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -68.78 160.53 49.22 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.202 1.935 . . . . 0.0 110.199 171.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 48.3 t-20 -49.74 117.78 7.69 Favored Pre-proline 0 C--O 1.234 0.285 0 O-C-N 123.36 0.412 . . . . 0.0 110.442 -176.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.488 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 13.5 Cg_endo -57.67 -18.69 34.39 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 123.523 2.815 . . . . 0.0 113.918 -173.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 -66.96 -24.04 66.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.87 0.367 . . . . 0.0 110.144 177.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -89.59 -3.7 58.18 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.087 177.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 137.23 134.71 3.29 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.477 -177.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -110.73 106.51 15.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.375 0.587 . . . . 0.0 109.905 -179.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 10.6 m95 -103.29 9.34 38.1 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.486 0.66 . . . . 0.0 109.794 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.671 ' SG ' ' HB2' ' A' ' 24' ' ' CYS . 8.4 m -73.74 -2.8 24.88 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 124.184 0.993 . . . . 0.0 113.372 -175.015 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 4.8 m -17.0 29.7 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 118.309 2.707 . . . . 0.0 118.309 -138.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.554 ' H ' ' C ' ' A' ' 20' ' ' CYS . 32.1 m80 -104.51 -86.66 0.45 Allowed 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 156.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.6 tttm -155.73 120.02 4.59 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 120.414 0.15 . . . . 0.0 110.657 169.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.671 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 41.9 t -85.07 110.17 18.75 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 175.618 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.1 m -124.52 158.91 60.13 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.338 -173.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -81.47 119.71 3.44 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 122.552 2.168 . . . . 0.0 112.034 -178.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.421 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 6.5 mm-40 -110.57 75.31 0.92 Allowed 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 177.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 75.75 -111.65 3.38 Favored Glycine 0 N--CA 1.444 -0.795 0 C-N-CA 120.458 -0.877 . . . . 0.0 111.921 -175.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.468 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 22.5 pttm -84.21 -28.68 27.13 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -176.226 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.468 ' HG3' ' HG3' ' A' ' 29' ' ' LYS . 62.4 mtt-85 -118.38 171.35 8.21 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.996 0.427 . . . . 0.0 110.995 -175.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.529 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 97.1 m-85 -107.32 145.1 33.23 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.899 177.499 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.421 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 37.5 m-85 -136.77 149.01 47.56 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.452 -179.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 85.0 m -79.3 102.78 8.81 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 175.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -115.09 161.48 18.32 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 -179.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -103.93 88.26 2.99 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 81.2 mm-40 . . . . . 0 C--O 1.246 0.898 0 CA-C-O 118.37 -0.824 . . . . 0.0 110.349 -179.619 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.78 0 N-CA-C 111.758 -0.537 . . . . 0.0 111.758 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.1 t -161.01 130.61 4.85 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 -179.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 50.4 p90 -98.21 132.13 43.98 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.543 ' HA ' ' O ' ' A' ' 19' ' ' TRP . 36.3 m 67.05 116.43 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.524 -172.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 97.3 mt -63.17 138.25 23.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.182 -174.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.0 mp0 -55.58 141.31 37.84 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.074 -177.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.82 120.0 15.77 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.377 -177.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 111.46 -14.14 27.75 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.093 -175.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -84.53 165.16 18.29 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.989 0.423 . . . . 0.0 111.228 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.441 ' H ' ' HD3' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -78.99 145.9 33.67 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.475 175.262 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 7.6 p -125.42 137.95 30.85 Favored Pre-proline 0 C--N 1.318 -0.769 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.712 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -57.57 157.53 22.65 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.654 2.236 . . . . 0.0 111.072 172.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -49.86 114.08 3.92 Favored Pre-proline 0 C--O 1.231 0.123 0 O-C-N 123.526 0.516 . . . . 0.0 110.456 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -57.89 -19.41 39.35 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 123.208 2.605 . . . . 0.0 113.616 -172.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -68.28 -19.7 64.72 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.748 0.309 . . . . 0.0 110.733 177.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -89.3 -8.82 52.55 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.964 0.411 . . . . 0.0 110.342 178.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 136.26 112.07 1.15 Allowed Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 111.603 -0.599 . . . . 0.0 111.603 -176.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -86.64 113.11 22.25 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.964 0.411 . . . . 0.0 110.541 -178.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.543 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 3.0 m0 -111.86 26.4 10.66 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 174.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.559 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.1 OUTLIER -84.84 -6.02 59.34 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.88 -171.284 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.4 m -18.57 29.52 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 118.207 2.669 . . . . 0.0 118.207 -138.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.559 ' H ' ' C ' ' A' ' 20' ' ' CYS . 42.7 m80 -107.41 -90.83 0.43 Allowed 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 158.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -156.03 126.66 6.79 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 110.449 -0.204 . . . . 0.0 110.449 168.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.497 ' SG ' ' HB3' ' A' ' 31' ' ' PHE . 50.2 t -90.44 100.2 13.08 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 176.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.6 m -109.79 146.34 33.89 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-O 121.094 0.473 . . . . 0.0 111.656 -174.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.13 121.68 5.43 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.73 2.286 . . . . 0.0 112.188 178.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -118.86 90.3 3.31 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 176.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 84.42 -110.87 3.4 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.313 -0.946 . . . . 0.0 111.422 -174.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.5 tttp -104.65 -16.93 14.85 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.011 0.434 . . . . 0.0 110.869 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -111.38 167.08 10.58 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.929 -173.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.497 ' HB3' ' SG ' ' A' ' 24' ' ' CYS . 96.3 m-85 -110.49 140.75 44.45 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.014 177.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -135.55 149.14 49.36 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.015 0.436 . . . . 0.0 110.633 -179.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -85.84 107.44 17.67 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.533 -176.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 34.1 mmt180 -122.02 158.56 28.89 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.379 -174.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -97.7 88.65 4.39 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.911 0.862 . . . . 0.0 109.914 177.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 . . . . . 0 C--O 1.246 0.915 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.453 -178.586 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.638 0 N-CA-C 112.183 -0.367 . . . . 0.0 112.183 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.6 t -175.86 152.98 1.3 Allowed 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 178.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 12.2 p90 -85.41 20.44 2.03 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.699 0.762 . . . . 0.0 110.525 175.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.585 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 62.5 m -132.73 -161.7 1.16 Allowed 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.385 -0.969 . . . . 0.0 108.385 178.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.402 ' HB ' ' HA ' ' A' ' 20' ' ' CYS . 89.1 mt -64.73 130.27 29.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 118.152 0.433 . . . . 0.0 110.107 178.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.417 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 14.4 mm-40 -59.47 147.64 35.86 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.233 -177.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.447 HD22 ' HA ' ' A' ' 7' ' ' LEU . 0.7 OUTLIER -74.27 115.79 14.17 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.944 -175.248 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 117.5 -18.55 11.88 Favored Glycine 0 N--CA 1.445 -0.717 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.998 -174.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.421 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 8.2 mm-40 -75.91 166.63 23.23 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.036 0.446 . . . . 0.0 111.04 -179.121 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.421 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -84.77 138.24 32.72 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 176.304 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 23.1 p -117.81 148.55 43.45 Favored Pre-proline 0 C--N 1.316 -0.88 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.197 -178.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.23 154.46 69.8 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.684 2.256 . . . . 0.0 110.93 174.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.597 ' OD1' ' HG2' ' A' ' 15' ' ' ARG . 47.5 t-20 -51.99 116.92 8.99 Favored Pre-proline 0 C--O 1.233 0.196 0 O-C-N 123.699 0.624 . . . . 0.0 110.543 -177.013 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.448 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 14.5 Cg_endo -56.62 -20.57 34.91 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.442 2.761 . . . . 0.0 114.129 -172.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.597 ' HG2' ' OD1' ' A' ' 13' ' ' ASN . 10.1 ptm180 -64.45 -23.99 67.47 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 121.045 -0.262 . . . . 0.0 111.046 177.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -92.11 0.48 57.46 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.908 0.385 . . . . 0.0 110.641 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 99.89 94.55 2.11 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.812 -0.709 . . . . 0.0 111.877 -177.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.412 ' HB3' ' HA ' ' A' ' 14' ' ' PRO . 9.2 p-10 -86.83 147.59 25.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.101 0.477 . . . . 0.0 110.679 -179.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.585 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 26.0 m95 -111.74 36.26 3.35 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 176.004 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.574 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -79.4 -6.97 58.0 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.329 -1.305 . . . . 0.0 113.179 -171.659 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.9 m -17.77 31.24 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 118.077 2.621 . . . . 0.0 118.077 -141.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.574 ' H ' ' C ' ' A' ' 20' ' ' CYS . 69.0 m80 -109.35 -87.98 0.5 Allowed 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 161.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.1 ttmm -154.6 124.22 6.56 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.158 167.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.448 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 44.9 t -84.97 90.78 7.9 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 172.313 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 8.7 p -106.7 132.09 21.18 Favored Pre-proline 0 N--CA 1.44 -0.946 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.782 -168.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -67.36 119.82 6.85 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.441 2.094 . . . . 0.0 112.726 -179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -113.38 85.23 2.15 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.897 -1.047 . . . . 0.0 108.941 177.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 79.23 -111.15 3.19 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 119.945 -1.121 . . . . 0.0 111.326 -175.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -94.44 -30.19 14.58 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.093 0.473 . . . . 0.0 110.88 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -98.85 174.17 6.51 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.224 -173.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -117.06 137.78 52.03 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.414 174.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -130.89 150.44 52.05 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.009 0.433 . . . . 0.0 110.173 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -85.52 100.63 12.04 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.394 -178.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 27.0 mmm180 -119.91 163.66 17.22 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.193 -175.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -107.5 89.68 3.07 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.827 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 83.6 mm-40 . . . . . 0 C--O 1.246 0.878 0 CA-C-O 118.516 -0.754 . . . . 0.0 110.119 -179.438 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.791 0 N-CA-C 112.013 -0.435 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.514 HG23 ' H ' ' A' ' 4' ' ' CYS . 9.9 t -101.32 179.05 4.47 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 27.4 p90 -74.77 10.56 1.35 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.335 0.588 . . . . 0.0 111.727 -178.149 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.514 ' H ' HG23 ' A' ' 2' ' ' THR . 76.0 m -145.88 -173.69 4.22 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 176.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 89.2 mt -70.65 134.24 30.41 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 176.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -58.48 145.97 37.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.534 0.683 . . . . 0.0 110.796 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.484 ' HA ' HD22 ' A' ' 7' ' ' LEU . 0.7 OUTLIER -74.48 121.86 22.14 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.563 -176.769 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.25 -6.5 34.36 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.354 -174.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -86.17 168.74 13.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.101 0.477 . . . . 0.0 111.629 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.431 ' HD2' ' N ' ' A' ' 11' ' ' CYS . 2.3 tmm_? -88.52 127.85 35.54 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.161 177.647 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.431 ' N ' ' HD2' ' A' ' 10' ' ' ARG . 25.7 p -113.37 151.03 44.04 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-O 120.636 0.255 . . . . 0.0 111.315 -174.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.34 146.99 64.53 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.591 2.194 . . . . 0.0 110.87 173.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 51.6 t-20 -50.39 120.07 11.88 Favored Pre-proline 0 C--O 1.231 0.129 0 O-C-N 123.708 0.63 . . . . 0.0 110.112 -177.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.535 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 14.5 Cg_endo -56.44 -21.0 35.4 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 123.308 2.672 . . . . 0.0 113.589 -174.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.18 -18.0 63.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.846 0.355 . . . . 0.0 110.303 177.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -101.08 -4.68 26.91 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.566 178.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 106.63 107.72 3.23 Favored Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.159 -177.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -109.87 146.77 34.54 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.04 0.448 . . . . 0.0 110.39 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 2.1 m-90 -108.73 33.82 4.01 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 177.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.577 ' C ' ' H ' ' A' ' 22' ' ' HIS . 0.0 OUTLIER -78.41 -9.29 59.23 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 114.015 1.117 . . . . 0.0 114.015 -169.379 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 27.7 p -19.29 29.93 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 118.231 2.678 . . . . 0.0 118.231 -140.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.577 ' H ' ' C ' ' A' ' 20' ' ' CYS . 66.7 m80 -103.03 -87.6 0.42 Allowed 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 161.395 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.413 ' HE3' ' N ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -155.39 117.7 4.18 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 167.96 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.535 ' SG ' ' HD3' ' A' ' 14' ' ' PRO . 45.5 t -82.76 93.37 7.41 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 169.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.1 p -112.62 137.9 21.86 Favored Pre-proline 0 C--N 1.313 -1.013 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.336 -166.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -66.7 119.27 6.28 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.254 1.969 . . . . 0.0 111.91 178.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -116.72 76.91 1.06 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.36 -0.837 . . . . 0.0 108.863 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.56 -111.7 3.46 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.105 -1.045 . . . . 0.0 111.598 -175.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 21.7 pttm -99.59 -12.0 20.49 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -176.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -120.84 175.16 6.18 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.01 0.434 . . . . 0.0 111.123 -179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -113.33 137.19 51.87 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.51 173.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -133.67 152.32 51.86 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.057 0.456 . . . . 0.0 109.871 179.25 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -83.28 101.66 11.43 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.301 -178.466 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 28.9 mmt180 -114.87 160.46 19.47 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.316 -177.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -109.67 88.68 2.8 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.07 0.462 . . . . 0.0 110.266 178.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.399 -0.81 . . . . 0.0 109.293 176.473 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.647 0 N-CA-C 111.765 -0.534 . . . . 0.0 111.765 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.9 t -169.26 151.52 4.64 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -85.85 73.37 10.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.167 0.508 . . . . 0.0 109.923 -179.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.662 ' HA ' ' O ' ' A' ' 19' ' ' TRP . 33.3 m 68.66 132.85 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 114.779 -1.101 . . . . 0.0 111.55 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 86.6 mt -72.56 137.97 22.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.111 -0.95 . . . . 0.0 110.347 -176.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -55.28 138.48 45.2 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.231 177.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.463 ' HA ' HD22 ' A' ' 7' ' ' LEU . 1.3 tm? -70.06 121.96 18.47 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.16 -173.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 111.25 -16.19 27.37 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.134 -176.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.401 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 18.1 mm-40 -78.71 168.71 19.34 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.903 0.382 . . . . 0.0 110.898 -179.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.401 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -74.73 151.71 39.16 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 176.047 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.57 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 11.7 t -140.04 139.99 22.79 Favored Pre-proline 0 C--N 1.314 -0.942 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.24 -174.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -71.93 158.79 51.97 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.532 2.155 . . . . 0.0 110.86 176.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -53.22 115.73 8.13 Favored Pre-proline 0 C--N 1.331 -0.225 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.44 -24.95 46.11 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 123.454 2.769 . . . . 0.0 113.621 -172.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 17.4 ptt180 -71.22 -17.83 62.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.837 0.351 . . . . 0.0 110.405 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.1 mm-40 -98.9 -0.59 41.99 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.575 179.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 135.16 93.93 0.44 Allowed Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 120.959 -0.638 . . . . 0.0 111.971 -177.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -81.54 124.79 29.8 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.603 0.239 . . . . 0.0 110.649 -179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.662 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 20.5 m95 -118.89 12.23 12.81 Favored 'General case' 0 C--O 1.216 -0.701 0 CA-C-O 120.988 0.423 . . . . 0.0 109.938 174.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.583 ' C ' ' H ' ' A' ' 22' ' ' HIS . 38.8 t -73.65 -6.49 47.05 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -170.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.7 m -15.88 31.85 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 117.566 2.432 . . . . 0.0 117.566 -138.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.583 ' H ' ' C ' ' A' ' 20' ' ' CYS . 72.8 m80 -108.37 -88.07 0.48 Allowed 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 163.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.7 tttm -156.49 119.65 4.19 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 110.005 -0.368 . . . . 0.0 110.005 165.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 35.2 t -86.03 107.95 18.02 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 17.1 m -120.79 149.65 51.09 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-O 121.001 0.429 . . . . 0.0 111.553 -173.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -70.74 122.88 9.27 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.601 2.201 . . . . 0.0 112.397 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.465 ' HG3' ' HB2' ' A' ' 32' ' ' TYR . 6.9 mm-40 -119.26 75.71 1.07 Allowed 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.182 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 81.76 -111.16 3.28 Favored Glycine 0 N--CA 1.445 -0.726 0 C-N-CA 120.348 -0.93 . . . . 0.0 112.189 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -83.05 -29.93 28.44 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.979 0.363 . . . . 0.0 111.979 -177.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -126.46 171.65 10.86 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.045 0.45 . . . . 0.0 111.016 -174.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.57 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 87.4 m-85 -98.02 148.87 23.06 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.369 176.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.465 ' HB2' ' HG3' ' A' ' 27' ' ' GLU . 11.7 m-85 -133.18 156.28 47.77 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 -179.085 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 4.6 t -88.34 103.38 15.76 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 -179.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.441 ' HB3' HE22 ' A' ' 36' ' ' GLN . 30.5 mmt180 -116.55 163.39 16.15 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.751 -176.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -104.76 88.31 2.88 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.231 0.538 . . . . 0.0 111.551 -178.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.441 HE22 ' HB3' ' A' ' 34' ' ' ARG . 2.5 mp0 . . . . . 0 C--O 1.252 1.193 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.558 172.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.563 0 N-CA-C 112.055 -0.418 . . . . 0.0 112.055 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.4 ' CG2' ' HA ' ' A' ' 6' ' ' GLU . 8.4 t -136.07 60.54 1.67 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.449 0.642 . . . . 0.0 109.98 178.119 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 72.07 -48.36 0.68 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.896 -175.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.617 ' HB3' ' O ' ' A' ' 19' ' ' TRP . 71.4 m -142.57 -156.87 0.72 Allowed 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 175.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 81.2 mt -58.52 135.01 23.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.397 0 CA-C-O 121.209 0.528 . . . . 0.0 111.099 -178.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.456 ' HB2' ' HG3' ' A' ' 9' ' ' GLU . 11.4 mp0 -60.43 152.89 24.42 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.89 -177.105 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.522 HD23 ' CG ' ' A' ' 22' ' ' HIS . 1.2 tm? -74.32 117.66 16.38 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.939 -177.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 110.9 -14.5 29.04 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.806 -0.633 . . . . 0.0 112.013 -176.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.471 ' HA ' ' NH1' ' A' ' 10' ' ' ARG . 12.7 mm-40 -78.72 167.32 21.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.041 0.448 . . . . 0.0 110.619 179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.471 ' NH1' ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -82.21 145.16 30.2 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.372 177.222 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.556 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 15.1 p -125.34 147.29 57.14 Favored Pre-proline 0 C--N 1.313 -0.992 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.244 177.249 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . 0.541 ' HG3' ' CZ3' ' A' ' 19' ' ' TRP . 56.0 Cg_endo -68.98 159.42 54.03 Favored 'Trans proline' 0 N--CA 1.462 -0.329 0 C-N-CA 122.398 2.065 . . . . 0.0 110.29 174.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -52.54 115.62 7.39 Favored Pre-proline 0 C--N 1.328 -0.353 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -54.67 -22.33 28.36 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 123.303 2.668 . . . . 0.0 113.79 -171.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -70.13 -20.27 63.18 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 121.076 -0.25 . . . . 0.0 110.982 179.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -97.57 -1.76 43.18 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.601 0.239 . . . . 0.0 111.059 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 135.93 118.72 1.82 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.797 -178.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -102.0 107.27 18.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.984 0.421 . . . . 0.0 111.141 -177.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.617 ' O ' ' HB3' ' A' ' 4' ' ' CYS . 1.7 m0 -106.95 21.39 17.63 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 173.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.533 ' O ' ' N ' ' A' ' 22' ' ' HIS . 3.8 t -81.41 -8.54 59.75 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.412 -1.267 . . . . 0.0 111.803 -170.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 20.3 m -21.93 31.13 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 118.591 2.811 . . . . 0.0 118.591 -142.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.533 ' N ' ' O ' ' A' ' 20' ' ' CYS . 77.4 m80 -104.43 -88.29 0.43 Allowed 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 161.624 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -156.32 118.79 4.06 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 163.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.412 ' HB2' ' CB ' ' A' ' 20' ' ' CYS . 48.9 t -83.92 97.56 9.3 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.415 ' HA ' ' HD3' ' A' ' 26' ' ' PRO . 18.2 m -109.07 145.6 32.09 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.1 -176.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 25' ' ' VAL . 3.5 Cg_exo -71.46 119.8 6.51 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.465 2.11 . . . . 0.0 111.492 176.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -110.79 76.81 1.0 Allowed 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 176.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.12 -111.68 3.43 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.475 -0.869 . . . . 0.0 111.088 -173.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -99.82 -13.62 19.14 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.182 0.515 . . . . 0.0 110.648 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -106.56 176.1 5.28 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.942 -177.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.556 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 87.7 m-85 -126.96 141.66 51.74 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 176.362 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -137.71 148.4 45.63 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.002 0.43 . . . . 0.0 111.189 -178.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.439 ' O ' HD22 ' A' ' 7' ' ' LEU . 55.6 m -79.37 101.4 8.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.684 174.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -107.89 154.67 21.25 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.215 -178.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -89.87 88.84 7.49 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.512 177.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 . . . . . 0 C--O 1.245 0.855 0 CA-C-O 118.192 -0.909 . . . . 0.0 110.029 -178.331 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.576 0 N-CA-C 112.222 -0.351 . . . . 0.0 112.222 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.1 t -153.83 40.04 0.49 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.846 0.832 . . . . 0.0 109.265 178.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 81.3 t80 72.6 -52.19 0.7 Allowed 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 114.48 -1.236 . . . . 0.0 110.755 -174.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 19' ' ' TRP . 63.2 m -96.68 144.57 26.58 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 177.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.456 HG13 ' HB2' ' A' ' 19' ' ' TRP . 79.8 mt -81.34 133.61 28.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 -178.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.427 ' HG2' ' CG ' ' A' ' 9' ' ' GLU . 1.5 pm0 -70.16 157.26 37.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.797 0.808 . . . . 0.0 111.648 -174.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.544 HD23 ' ND1' ' A' ' 22' ' ' HIS . 0.4 OUTLIER -67.06 123.71 20.99 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.52 -1.218 . . . . 0.0 110.913 -172.94 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.68 -9.51 34.88 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.524 179.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.454 ' HB2' HG22 ' A' ' 5' ' ' ILE . 32.2 mm-40 -84.32 170.84 13.23 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.986 0.422 . . . . 0.0 111.12 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.578 ' HD2' ' N ' ' A' ' 10' ' ' ARG . 5.3 mpt_? -89.92 137.9 31.95 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.498 -0.773 . . . . 0.0 109.55 -179.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.577 ' O ' ' HB2' ' A' ' 31' ' ' PHE . 17.2 p -124.72 149.21 61.67 Favored Pre-proline 0 C--N 1.318 -0.794 0 CA-C-O 120.564 0.221 . . . . 0.0 110.865 -179.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -71.05 151.58 61.85 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.132 1.888 . . . . 0.0 110.127 170.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -49.54 124.27 14.97 Favored Pre-proline 0 C--N 1.332 -0.192 0 O-C-N 123.63 0.581 . . . . 0.0 109.638 -179.02 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.478 ' HD3' ' SG ' ' A' ' 24' ' ' CYS . 9.2 Cg_endo -51.71 -22.3 13.01 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 123.739 2.959 . . . . 0.0 113.757 -174.469 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 11.4 ptm180 -68.55 -20.03 64.52 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.8 0.333 . . . . 0.0 110.551 177.051 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -92.24 -7.78 47.2 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.629 175.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 104.64 96.49 2.42 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.264 -178.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -94.22 147.71 22.91 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.818 0.342 . . . . 0.0 110.175 179.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.489 ' O ' ' HA ' ' A' ' 4' ' ' CYS . 20.6 m95 -111.48 21.35 16.28 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 175.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.567 ' C ' ' H ' ' A' ' 22' ' ' HIS . 4.7 m -56.75 -5.81 0.26 Allowed 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 115.592 1.701 . . . . 0.0 115.592 -174.46 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 18.1 m -17.21 30.33 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 118.181 2.66 . . . . 0.0 118.181 -140.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . 0.567 ' H ' ' C ' ' A' ' 20' ' ' CYS . 24.6 m80 -109.55 -85.37 0.54 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 158.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.6 tttm -156.64 131.14 8.73 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 121.353 -0.139 . . . . 0.0 110.7 167.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.524 ' HB2' ' SG ' ' A' ' 20' ' ' CYS . 50.4 t -90.44 105.69 17.98 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 176.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 31.6 m -116.5 147.38 39.55 Favored Pre-proline 0 C--N 1.321 -0.642 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.462 -173.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -73.78 119.65 6.0 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.527 2.151 . . . . 0.0 112.415 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -115.19 75.76 0.96 Allowed 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.209 177.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.22 -111.28 3.81 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.235 -178.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 8.4 ptpp? -71.17 -32.73 69.27 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -175.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -127.27 -179.57 4.94 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.924 0.392 . . . . 0.0 110.998 -172.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.577 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 62.4 m-85 -111.93 147.24 36.28 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 175.117 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.429 ' CZ ' ' HG3' ' A' ' 10' ' ' ARG . 30.5 m-85 -136.42 144.03 44.26 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 120.799 0.333 . . . . 0.0 110.797 -178.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.438 ' SG ' ' HB3' ' A' ' 11' ' ' CYS . 73.0 m -76.5 103.9 6.73 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.521 176.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -119.02 163.63 16.68 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.488 -178.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -104.8 88.95 3.03 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.23 0.538 . . . . 0.0 110.507 -179.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.237 -0.887 . . . . 0.0 109.787 178.238 . . . . . . . . 0 0 . 1 stop_ save_