data_4aog_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 4aog _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 ' 14' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.463 0.18 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 80.0 p -95.08 115.83 27.93 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.07 -154.63 22.02 Favored Glycine 0 N--CA 1.436 -1.314 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.733 -177.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.447 HD11 ' O ' ' A' ' 17' ' ' LEU . 1.5 tm? -65.58 -40.49 92.78 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.327 -0.436 . . . . 0.0 110.783 177.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 1.625 ' HE1' ' CE2' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -76.54 -36.96 57.38 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.442 0.639 . . . . 0.0 111.595 -178.804 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.64 -8.92 0.02 OUTLIER Glycine 0 CA--C 1.525 0.671 0 CA-C-N 114.763 -1.108 . . . . 0.0 114.794 177.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.459 ' H ' ' C ' ' A' ' 18' ' ' TYR . 7.6 m -112.61 154.59 25.79 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 118.174 0.987 . . . . 0.0 111.929 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.88 107.57 12.86 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.256 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.501 ' HA ' ' HG3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -137.71 -169.86 2.63 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -179.195 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.489 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 60.1 m -134.28 119.84 19.22 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.501 -179.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.455 ' HB3' ' HD3' ' A' ' 61' ' ' ARG . 1.1 t -128.43 -179.8 5.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.958 0.408 . . . . 0.0 110.927 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.454 ' HB1' ' HB2' ' A' ' 34' ' ' LEU . . . -115.2 164.71 13.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.873 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.7 t -130.46 157.68 41.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.512 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.469 ' HB3' ' HB1' ' A' ' 32' ' ' ALA . 0.8 OUTLIER -80.56 -170.67 2.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.545 -179.194 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.46 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.7 m -62.63 -47.0 95.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.721 -179.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.46 ' HG ' HG22 ' A' ' 28' ' ' VAL . 32.5 mt -76.2 -19.68 58.18 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.39 -13.39 33.31 Favored Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.702 -0.761 . . . . 0.0 113.451 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.558 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 7.6 p -100.36 108.18 22.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 117.156 0.478 . . . . 0.0 111.103 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.558 ' HB1' ' O ' ' A' ' 31' ' ' VAL . . . 172.58 161.27 0.12 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.637 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -131.24 63.07 1.61 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.632 179.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.454 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 3.8 mt -82.59 135.54 35.04 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.83 -178.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.1 t70 50.37 81.62 0.06 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.679 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -109.34 129.56 55.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.461 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -166.25 172.64 10.93 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.102 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -66.52 145.2 98.93 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.444 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.501 ' HG3' ' HA ' ' A' ' 22' ' ' GLN . 57.1 Cg_endo -91.19 121.37 0.69 Allowed 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.864 2.376 . . . . 0.0 112.657 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -90.7 112.11 0.4 Allowed 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 121.684 1.589 . . . . 0.0 112.025 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.405 ' HB1' HG21 ' A' ' 52' ' ' THR . . . -176.63 -175.83 0.67 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.748 179.349 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 36.5 m -109.05 88.27 2.69 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -64.35 123.98 20.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.555 -178.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.6 -33.35 3.84 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.955 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -163.86 -179.5 6.35 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.099 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.59 -58.46 6.27 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -179.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.4 m -60.3 -35.79 76.39 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.804 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -62.43 -34.5 76.9 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.981 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -70.15 -35.96 74.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.394 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -67.01 -31.23 71.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.063 0.458 . . . . 0.0 110.138 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.8 t -76.59 -17.74 59.03 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.389 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.405 HG21 ' HB1' ' A' ' 41' ' ' ALA . 60.0 m -73.35 -42.5 62.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.988 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.4 m -80.79 -26.77 36.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.223 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.22 -20.1 55.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.437 0.637 . . . . 0.0 110.302 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.88 -36.08 80.23 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.923 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.4 pt -108.96 11.42 8.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 84.3 41.6 7.87 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.489 -0.862 . . . . 0.0 113.393 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -140.95 177.93 7.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.855 0.327 . . . . 0.0 110.878 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -117.2 162.95 17.04 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.878 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -85.98 118.42 25.45 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.746 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.569 HH21 ' HB3' ' A' ' 74' ' ' CYS . 12.9 ptm180 -147.55 125.74 12.2 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.164 0.507 . . . . 0.0 110.211 179.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.441 ' HB2' ' CD2' ' A' ' 18' ' ' TYR . 5.5 m -85.88 106.22 16.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.261 -178.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.4 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 65.2 m -98.0 142.61 29.51 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.229 0.538 . . . . 0.0 111.904 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.724 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -93.83 144.3 9.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.444 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.443 ' N ' HG21 ' A' ' 64' ' ' VAL . 10.5 mt -49.43 137.14 16.59 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.535 -178.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 37.9 Cg_exo -61.42 138.13 74.38 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.71 2.273 . . . . 0.0 112.617 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 51.3 mm -130.3 108.17 15.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.375 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.65 109.36 0.31 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.12 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.68 -13.68 5.84 Favored Glycine 0 C--N 1.333 0.38 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.773 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -135.16 168.48 19.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.451 0.643 . . . . 0.0 111.161 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -81.29 169.3 17.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.294 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 20.2 tt -84.09 132.27 31.94 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-O 120.813 0.34 . . . . 0.0 110.876 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.542 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.5 mm? -109.82 132.15 54.41 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.789 0.328 . . . . 0.0 110.622 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.569 ' HB3' HH21 ' A' ' 61' ' ' ARG . 0.5 OUTLIER -160.14 135.39 8.05 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.339 179.406 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -153.11 163.13 40.43 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.63 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.489 HG21 ' HD2' ' A' ' 77' ' ' PRO . 54.4 m -96.38 139.47 21.72 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.654 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . 0.489 ' HD2' HG21 ' A' ' 76' ' ' THR . 64.1 Cg_endo -75.49 125.22 8.86 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.28 1.987 . . . . 0.0 113.144 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 57.19 23.83 9.09 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.801 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 63.62 33.76 88.12 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.559 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.6 tp . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.282 -179.552 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.39 0 CA-C-O 120.987 0.422 . . . . 0.0 110.675 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 75.3 p -98.29 117.13 31.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.532 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 173.77 -155.22 21.56 Favored Glycine 0 N--CA 1.434 -1.47 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.744 -178.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.452 HD11 ' O ' ' A' ' 17' ' ' LEU . 1.4 tm? -66.75 -38.64 87.02 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.216 -0.492 . . . . 0.0 110.966 178.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.713 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -79.07 -39.24 34.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.833 -178.252 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.79 -11.5 0.01 OUTLIER Glycine 0 CA--C 1.528 0.855 0 CA-C-N 114.97 -1.014 . . . . 0.0 115.285 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.487 ' H ' ' C ' ' A' ' 18' ' ' TYR . 6.6 m -105.94 131.14 53.61 Favored 'General case' 0 N--CA 1.46 0.074 0 CA-C-N 118.383 1.091 . . . . 0.0 112.372 -178.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -100.98 99.53 10.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.544 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.1 mm-40 -126.31 -174.57 3.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.88 0.371 . . . . 0.0 111.003 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.554 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 58.3 m -135.51 107.76 7.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.298 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.14 151.56 51.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.886 0.374 . . . . 0.0 111.143 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.41 169.65 16.72 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.593 -178.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.4 t -126.35 158.13 36.67 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.635 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -76.87 -169.86 1.43 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.451 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.472 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.6 m -65.74 -46.04 90.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.699 -179.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.472 ' HG ' HG22 ' A' ' 28' ' ' VAL . 30.6 mt -75.46 -19.8 59.22 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -178.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.82 -18.33 29.29 Favored Glycine 0 CA--C 1.521 0.464 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.765 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 46.8 t -101.51 107.81 22.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 117.603 0.702 . . . . 0.0 111.033 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 175.94 172.74 0.35 Allowed 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.049 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -141.38 84.23 1.9 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.91 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.7 mt -104.38 134.95 46.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.682 -178.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 51.53 84.14 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.006 178.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.5 t -122.76 137.77 54.82 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.826 0.346 . . . . 0.0 111.005 179.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -159.76 -178.4 7.04 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -65.85 124.62 88.07 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.825 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.554 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 93.7 Cg_endo -85.84 122.17 2.23 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.506 2.137 . . . . 0.0 112.087 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -91.25 113.73 0.39 Allowed 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.113 1.875 . . . . 0.0 112.508 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.53 179.12 1.5 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 179.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 32.1 m -106.89 88.07 2.66 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.5 mt -63.36 121.2 13.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.411 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.403 ' HB2' ' ND1' ' A' ' 48' ' ' HIS . . . -120.62 -34.46 3.59 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.71 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -162.77 -179.18 6.64 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.238 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.88 -59.84 3.7 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.937 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.6 m -60.27 -36.33 77.57 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.745 -179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.403 ' ND1' ' HB2' ' A' ' 44' ' ' ALA . 1.7 t60 -62.78 -32.44 73.61 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.947 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 1.642 ' HD2' ' CD1' ' A' ' 49' ' ' PHE . 13.8 t80 -71.34 -38.65 71.64 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.103 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.08 -31.86 73.1 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 121.058 0.456 . . . . 0.0 110.149 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.3 t -75.51 -13.38 60.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.958 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 74.2 m -78.06 -44.04 27.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.077 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.5 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 36.2 m -82.95 -26.94 30.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.986 -179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.49 -20.18 58.92 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.501 0.667 . . . . 0.0 110.186 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.81 -37.24 86.95 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.744 -1.117 . . . . 0.0 112.077 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.0 pt -106.01 11.29 8.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.42 40.36 6.07 Favored Glycine 0 CA--C 1.522 0.492 0 C-N-CA 120.493 -0.861 . . . . 0.0 114.235 178.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -148.44 -178.1 6.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 117.263 0.531 . . . . 0.0 111.059 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -122.98 154.81 37.93 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.168 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.5 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -69.57 119.91 14.55 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.689 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -139.6 125.3 19.44 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.563 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.595 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 15.4 t -98.72 99.54 10.66 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.485 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 3.8 m -109.1 141.37 41.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.257 0.551 . . . . 0.0 112.33 -177.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.713 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.3 OUTLIER -87.48 144.12 9.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.457 179.873 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.4 mt -49.52 136.43 17.62 Favored Pre-proline 0 N--CA 1.462 0.165 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.359 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -61.1 133.92 49.81 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.497 2.132 . . . . 0.0 112.531 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.4 mm -128.17 106.14 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.6 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.18 110.98 0.38 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.18 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.49 -13.97 5.87 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.464 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -138.18 166.86 23.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.41 0.624 . . . . 0.0 111.144 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -80.46 164.63 22.89 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.288 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.5 tt -83.43 125.2 40.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.05 0.452 . . . . 0.0 110.952 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.572 ' O ' HG13 ' A' ' 64' ' ' VAL . 4.0 mm? -100.66 115.73 30.92 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.9 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 42.2 t -161.27 140.45 10.18 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.251 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.428 ' HG2' ' HH ' ' A' ' 18' ' ' TYR . 18.2 pt20 -160.7 168.24 25.26 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.384 -179.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 72.9 m -100.69 124.65 41.54 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.325 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . 0.412 ' C ' ' H ' ' A' ' 79' ' ' GLY . 57.0 Cg_endo -69.45 141.2 45.85 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.403 2.069 . . . . 0.0 112.72 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.47 -0.85 0.64 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.246 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.412 ' H ' ' C ' ' A' ' 77' ' ' PRO . . . 70.9 36.84 65.39 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.397 179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 28.6 mt . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.191 -0.909 . . . . 0.0 111.193 179.849 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.1 t . . . . . 0 C--O 1.232 0.158 0 CA-C-O 121.148 0.499 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.624 ' O ' ' O ' ' A' ' 16' ' ' GLY . 87.6 p -134.18 -156.99 0.77 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.392 -179.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.624 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -18.52 -147.71 0.0 OUTLIER Glycine 0 CA--C 1.532 1.146 0 N-CA-C 118.251 2.06 . . . . 0.0 118.251 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.439 HD11 ' O ' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -22.85 -42.07 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 115.402 1.63 . . . . 0.0 115.402 -177.675 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.547 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 5.7 m-85 -69.37 -36.46 76.84 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.275 -0.57 . . . . 0.0 112.264 -177.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.69 -14.43 0.01 OUTLIER Glycine 0 CA--C 1.531 1.034 0 N-CA-C 115.708 1.043 . . . . 0.0 115.708 177.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.474 ' H ' ' C ' ' A' ' 18' ' ' TYR . 23.3 m -129.54 153.92 47.55 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 118.576 1.188 . . . . 0.0 112.175 -178.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -115.31 114.97 25.88 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.976 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -132.63 -169.88 2.33 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.128 0.489 . . . . 0.0 111.646 -178.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.441 ' HB2' ' HB3' ' A' ' 39' ' ' PRO . 5.6 t -147.27 131.11 17.05 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.115 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.519 ' HB2' ' HD2' ' A' ' 61' ' ' ARG . 36.7 m -147.34 165.83 28.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.967 0.413 . . . . 0.0 111.498 -179.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.35 168.77 10.86 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.385 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.422 ' HB ' HH21 ' A' ' 59' ' ' ARG . 5.7 t -122.98 156.82 33.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.72 -179.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -85.0 -169.61 2.73 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.234 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.519 HG22 ' HG ' ' A' ' 29' ' ' LEU . 8.2 m -60.93 -46.29 96.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.571 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.519 ' HG ' HG22 ' A' ' 28' ' ' VAL . 24.8 mt -80.21 -20.4 44.77 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 111.636 0.235 . . . . 0.0 111.636 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.32 -16.38 32.2 Favored Glycine 0 CA--C 1.522 0.509 0 C-N-CA 120.716 -0.754 . . . . 0.0 113.52 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 61.0 t -101.4 108.38 23.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 117.192 0.496 . . . . 0.0 111.178 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.35 167.41 0.81 Allowed 'General case' 0 N--CA 1.461 0.119 0 CA-C-O 120.967 0.413 . . . . 0.0 111.336 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -130.36 76.29 1.71 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.834 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 mt -102.95 143.21 32.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.976 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 30.3 t70 45.52 83.48 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.946 178.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 52.0 m -109.66 130.28 55.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.211 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -156.99 -176.18 5.84 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.053 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -79.33 133.32 60.46 Favored Pre-proline 0 CA--C 1.533 0.304 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.685 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.441 ' HB3' ' HB2' ' A' ' 23' ' ' CYS . 93.5 Cg_endo -89.07 119.97 1.03 Allowed 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.72 2.28 . . . . 0.0 111.931 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -91.27 114.34 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.32 2.013 . . . . 0.0 113.105 -179.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.58 179.98 1.34 Allowed 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.939 178.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.6 m -106.72 88.47 2.76 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.2 mt -62.47 121.56 13.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.277 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.428 ' HB2' ' ND1' ' A' ' 48' ' ' HIS . . . -120.55 -34.44 3.61 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.553 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -162.89 -177.91 5.79 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.103 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.88 -61.25 2.33 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.245 -0.434 . . . . 0.0 112.011 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.7 m -59.55 -36.42 76.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.846 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.428 ' ND1' ' HB2' ' A' ' 44' ' ' ALA . 1.2 t60 -63.03 -33.33 75.19 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -67.73 -34.85 77.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.741 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -67.78 -42.3 81.87 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.055 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 57.0 m -63.26 -18.07 63.18 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.297 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 48.5 m -70.85 -40.68 72.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.486 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 32.6 m -86.66 -31.47 21.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.791 -179.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.53 -19.71 63.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.657 0.741 . . . . 0.0 109.542 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.49 -39.86 88.97 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.417 -1.265 . . . . 0.0 112.117 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 16.1 pt -101.41 1.25 10.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.43 40.66 5.34 Favored Glycine 0 CA--C 1.522 0.511 0 C-N-CA 120.282 -0.961 . . . . 0.0 113.289 179.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -143.41 -172.12 3.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.782 0.291 . . . . 0.0 110.826 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.422 HH21 ' HB ' ' A' ' 26' ' ' THR . 50.6 mtm180 -119.96 152.15 37.87 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.743 0.306 . . . . 0.0 111.119 -179.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -82.72 122.76 28.58 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.763 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.519 ' HD2' ' HB2' ' A' ' 24' ' ' CYS . 4.2 ptm180 -140.19 140.26 35.86 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-O 120.627 0.251 . . . . 0.0 110.564 -179.538 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -106.39 119.57 39.6 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 55.5 m -110.21 149.21 30.45 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 121.424 0.63 . . . . 0.0 112.254 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.547 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -101.39 149.3 6.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.543 179.725 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.2 mt -49.6 137.46 17.41 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.364 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -60.63 134.97 57.51 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.604 2.203 . . . . 0.0 112.801 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.442 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.8 mm -130.57 106.19 12.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.51 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.2 119.79 4.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.982 0.42 . . . . 0.0 111.278 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 118.94 -8.13 12.76 Favored Glycine 0 CA--C 1.518 0.229 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.826 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.9 pt20 -139.24 168.5 19.69 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.477 0.656 . . . . 0.0 111.218 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -82.99 168.9 16.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.311 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.417 HG12 ' SG ' ' A' ' 74' ' ' CYS . 16.3 tt -83.4 124.81 39.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-O 120.922 0.391 . . . . 0.0 110.932 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.497 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.1 mm? -96.61 109.01 21.7 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.031 -179.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.417 ' SG ' HG12 ' A' ' 72' ' ' ILE . 64.2 m -144.76 131.96 20.57 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.122 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -160.27 167.51 27.38 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.766 0.317 . . . . 0.0 110.941 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 49.4 m -82.86 137.47 43.73 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.87 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -83.67 136.22 7.23 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.378 2.052 . . . . 0.0 112.684 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 64.34 3.48 1.85 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.811 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.63 40.02 54.56 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.436 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.2 mt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.285 -0.864 . . . . 0.0 111.061 179.971 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.1 t . . . . . 0 CA--C 1.52 -0.187 0 CA-C-O 121.408 0.623 . . . . 0.0 111.664 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.596 ' O ' ' O ' ' A' ' 16' ' ' GLY . 10.6 m -129.11 -156.08 0.74 Allowed 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.136 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.596 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -17.2 -147.7 0.0 OUTLIER Glycine 0 CA--C 1.533 1.182 0 N-CA-C 118.655 2.222 . . . . 0.0 118.655 -179.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.415 HD11 ' O ' ' A' ' 17' ' ' LEU . 0.7 OUTLIER -22.15 -45.96 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -176.846 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 1.636 ' HD1' ' CD2' ' A' ' 18' ' ' TYR . 6.4 m-85 -69.26 -37.23 77.81 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.927 -0.709 . . . . 0.0 112.031 -177.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.92 -12.26 0.01 OUTLIER Glycine 0 CA--C 1.529 0.952 0 N-CA-C 116.545 1.378 . . . . 0.0 116.545 176.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.473 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 52.6 m -138.16 138.11 38.29 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.139 1.469 . . . . 0.0 112.839 -177.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -106.18 125.87 51.52 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.407 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.526 ' HA ' ' HG3' ' A' ' 39' ' ' PRO . 67.1 mm-40 -147.56 176.31 10.16 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.78 0.324 . . . . 0.0 111.525 -178.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.42 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 75.7 m -122.82 116.41 23.64 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.999 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.636 ' HB2' ' HD2' ' A' ' 61' ' ' ARG . 60.2 m -132.44 159.95 37.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.016 0.436 . . . . 0.0 111.431 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.428 ' HB1' ' HB2' ' A' ' 34' ' ' LEU . . . -83.47 167.57 17.32 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.893 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.4 t -123.78 156.67 35.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.597 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -87.73 -170.59 3.07 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.339 -179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.495 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.5 m -60.61 -44.88 97.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.428 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.495 ' HG ' HG22 ' A' ' 28' ' ' VAL . 24.0 mt -80.55 -20.47 43.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.701 0.286 . . . . 0.0 111.279 -179.278 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.69 -18.97 31.54 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 120.827 -0.701 . . . . 0.0 113.792 178.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.4 t -101.81 108.49 23.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 117.286 0.543 . . . . 0.0 111.255 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -179.68 168.34 1.37 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.048 0.451 . . . . 0.0 111.377 179.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -128.97 82.79 2.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.756 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.428 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 2.0 mt -110.48 137.35 48.3 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.017 -178.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 48.02 84.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.874 178.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 51.4 m -109.6 129.94 55.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.631 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -151.55 163.86 38.1 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.413 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -57.92 133.12 83.42 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.473 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.526 ' HG3' ' HA ' ' A' ' 22' ' ' GLN . 97.5 Cg_endo -90.67 113.45 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.87 2.38 . . . . 0.0 112.302 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -90.5 113.3 0.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 121.919 1.746 . . . . 0.0 112.495 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.404 ' HB1' HG21 ' A' ' 52' ' ' THR . . . -175.79 -178.42 1.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.632 178.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.6 m -110.17 88.37 2.74 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 177.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.8 mt -64.79 119.77 11.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.432 -178.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -116.55 -40.69 3.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.761 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -152.82 -168.69 3.11 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.723 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.78 -39.37 94.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.993 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 46.6 m -71.04 -47.98 55.47 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.863 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -57.22 -31.22 65.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.081 0.467 . . . . 0.0 109.753 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 1.668 ' HE1' ' CE2' ' A' ' 49' ' ' PHE . 28.6 t80 -70.48 -39.56 74.15 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.077 179.016 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -62.99 -38.58 91.72 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 121.244 0.545 . . . . 0.0 109.912 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 56.9 m -68.29 -16.06 63.81 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.291 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.404 HG21 ' HB1' ' A' ' 41' ' ' ALA . 94.2 m -75.74 -43.31 47.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.549 -179.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.45 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 68.5 m -85.88 -23.46 27.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.346 -179.372 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.83 -20.0 43.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.259 0.552 . . . . 0.0 110.467 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.22 -39.93 93.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.158 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.1 pt -100.4 9.39 8.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.54 42.95 5.65 Favored Glycine 0 CA--C 1.522 0.477 0 C-N-CA 120.415 -0.898 . . . . 0.0 114.108 178.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -146.21 -177.42 5.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.362 0.581 . . . . 0.0 111.081 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 49.1 mtm180 -116.99 151.56 36.48 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.991 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.45 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -80.99 122.24 27.05 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.665 -179.374 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.636 ' HD2' ' HB2' ' A' ' 24' ' ' CYS . 9.5 ptp180 -145.72 125.58 13.52 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.948 0.404 . . . . 0.0 110.135 179.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.557 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.0 t -92.41 107.36 19.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.785 -179.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 93.0 m -98.21 150.88 21.03 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 121.281 0.563 . . . . 0.0 111.842 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.604 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -98.27 150.14 4.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.876 179.833 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.4 mt -49.32 138.07 15.18 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.371 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -62.13 132.98 41.53 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 122.537 2.158 . . . . 0.0 112.581 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.48 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 49.8 mm -131.74 104.71 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.739 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.71 121.08 5.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.266 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 118.51 -11.19 12.57 Favored Glycine 0 CA--C 1.517 0.182 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.77 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 3.0 pt20 -135.33 167.41 21.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.484 0.659 . . . . 0.0 111.347 -179.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -81.65 167.64 18.98 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.493 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.4 tt -83.79 124.5 39.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.045 0.45 . . . . 0.0 110.927 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.53 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.5 mm? -101.2 128.47 47.3 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.293 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -160.72 132.57 5.88 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.28 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -151.61 166.11 32.22 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.847 0.356 . . . . 0.0 110.685 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.42 HG21 ' HD2' ' A' ' 77' ' ' PRO . 54.0 m -95.28 138.04 22.0 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.498 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . 0.42 ' HD2' HG21 ' A' ' 76' ' ' THR . 85.3 Cg_endo -81.73 137.61 10.15 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.23 1.953 . . . . 0.0 112.756 -179.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.04 2.53 1.05 Allowed 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.928 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.47 38.64 61.99 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.285 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 28.6 mt . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.201 -0.904 . . . . 0.0 111.187 -179.919 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.1 m -94.42 116.7 29.1 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.2 -167.25 40.19 Favored Glycine 0 N--CA 1.439 -1.115 0 C-N-CA 120.565 -0.826 . . . . 0.0 113.244 -177.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.481 ' O ' HD12 ' A' ' 17' ' ' LEU . 1.9 tm? -57.91 -37.08 73.38 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.571 -0.815 . . . . 0.0 110.656 178.079 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 1.662 ' HE1' ' CE2' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -82.93 -37.14 24.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.249 -177.978 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.28 -13.15 0.02 OUTLIER Glycine 0 CA--C 1.528 0.902 0 N-CA-C 115.558 0.983 . . . . 0.0 115.558 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.466 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 20.7 m -107.29 124.36 49.67 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 118.589 1.194 . . . . 0.0 112.202 -178.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -89.35 105.22 17.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.026 -179.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -130.12 -179.18 5.08 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.082 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.558 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 83.6 m -129.85 117.44 20.2 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.03 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -135.48 160.38 38.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.084 0.468 . . . . 0.0 111.415 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.539 ' HB2' ' HB2' ' A' ' 34' ' ' LEU . . . -85.22 167.0 16.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.732 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.8 t -131.88 157.49 43.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.765 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -80.14 -170.37 2.46 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.059 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.532 HG22 ' HG ' ' A' ' 29' ' ' LEU . 7.9 m -63.58 -44.39 98.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.516 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.532 ' HG ' HG22 ' A' ' 28' ' ' VAL . 25.4 mt -79.53 -20.11 47.95 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -178.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.43 -17.56 31.0 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 120.636 -0.792 . . . . 0.0 113.873 179.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 40.1 t -101.4 108.07 22.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 117.493 0.647 . . . . 0.0 111.028 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 177.14 172.0 0.51 Allowed 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.248 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -135.82 96.78 3.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.834 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.539 ' HB2' ' HB2' ' A' ' 25' ' ' ALA . 2.1 mt -124.78 134.6 52.73 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.644 -178.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.7 t70 51.55 83.93 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.515 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.5 m -109.12 129.98 55.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.481 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -153.76 177.4 11.03 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.809 0.338 . . . . 0.0 111.357 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -74.98 137.47 72.87 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.45 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.558 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 65.4 Cg_endo -89.64 112.34 0.52 Allowed 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.83 2.354 . . . . 0.0 112.402 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -90.48 113.53 0.46 Allowed 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 121.897 1.731 . . . . 0.0 112.218 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.52 -177.7 1.03 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.812 179.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 34.7 m -108.0 88.04 2.64 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 177.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.5 mt -64.88 126.71 28.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.653 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.37 -40.34 2.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.864 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -150.27 -167.72 2.9 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.008 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.33 -41.69 76.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.24 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 42.3 m -69.74 -40.17 76.34 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.707 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -60.15 -33.68 72.51 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -67.65 -39.07 84.61 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.61 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -60.24 -38.77 84.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.297 0.57 . . . . 0.0 109.489 178.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 66.3 m -69.83 -22.39 63.29 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.167 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 70.9 m -67.99 -44.51 76.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.45 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.553 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 57.8 m -79.49 -26.25 41.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.296 -179.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.63 -20.37 56.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.454 0.645 . . . . 0.0 110.084 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.64 -37.71 88.52 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 114.881 -1.054 . . . . 0.0 112.097 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.2 pt -102.76 2.44 10.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.92 41.62 3.76 Favored Glycine 0 CA--C 1.523 0.532 0 C-N-CA 120.288 -0.958 . . . . 0.0 113.903 178.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -148.52 -178.31 6.26 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 117.219 0.509 . . . . 0.0 111.08 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -119.03 152.68 35.99 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.115 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.553 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -65.43 117.25 7.67 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.523 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 14.1 mtp180 -134.16 113.25 11.84 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.005 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.626 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 13.9 t -90.85 107.48 19.21 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.524 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 55.5 m -103.41 148.94 25.29 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -178.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.741 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -103.67 145.71 12.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.656 -179.784 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.8 mt -50.14 138.54 19.6 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.352 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.4 ' O ' HD11 ' A' ' 67' ' ' ILE . 32.2 Cg_exo -62.04 138.06 70.7 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.622 2.215 . . . . 0.0 112.483 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.443 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.4 mm -131.37 107.69 13.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.628 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -48.96 120.0 3.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.002 0.43 . . . . 0.0 111.273 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 117.88 -12.42 13.24 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.852 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.7 pt20 -134.93 167.35 21.07 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.606 0.717 . . . . 0.0 111.547 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -82.12 170.2 15.76 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.638 -1.164 . . . . 0.0 110.348 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.0 tt -82.81 127.56 39.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.941 0.401 . . . . 0.0 110.735 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.521 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.8 mm? -101.87 112.7 25.41 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 120.894 0.378 . . . . 0.0 111.259 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 77.8 m -147.22 129.08 15.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.859 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.38 169.86 22.22 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.788 0.327 . . . . 0.0 110.749 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 57.6 m -92.07 136.75 25.59 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.718 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -84.94 141.28 8.32 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.518 2.145 . . . . 0.0 113.077 -179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.75 3.02 1.06 Allowed 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.883 179.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.62 38.4 67.93 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.357 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 38.6 mt . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.112 179.921 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 25.6 p . . . . . 0 N--CA 1.467 0.383 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.3 m -95.22 117.67 30.66 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.29 -166.38 39.16 Favored Glycine 0 N--CA 1.44 -1.066 0 C-N-CA 120.549 -0.834 . . . . 0.0 113.326 -177.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.461 ' O ' HD12 ' A' ' 17' ' ' LEU . 1.8 tm? -56.23 -37.39 69.65 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.523 -0.839 . . . . 0.0 110.714 178.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 1.667 ' HE1' ' CE2' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -82.65 -39.2 22.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.894 -178.204 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.76 -9.47 0.01 OUTLIER Glycine 0 CA--C 1.528 0.864 0 CA-C-N 115.072 -0.967 . . . . 0.0 115.469 176.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.464 ' H ' ' C ' ' A' ' 18' ' ' TYR . 24.7 m -109.81 123.0 48.79 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 118.382 1.091 . . . . 0.0 112.491 -178.216 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -86.85 102.51 14.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.793 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -125.27 -170.01 2.09 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.819 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.5 t -144.08 121.14 11.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.792 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.09 159.82 41.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.932 0.396 . . . . 0.0 111.206 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -88.64 166.89 13.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.9 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.419 ' HB ' ' NH2' ' A' ' 59' ' ' ARG . 10.3 t -124.94 157.49 35.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.791 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -81.73 -169.78 2.51 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.184 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.511 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.4 m -63.43 -45.32 98.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.653 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.511 ' HG ' HG22 ' A' ' 28' ' ' VAL . 26.8 mt -77.79 -20.1 53.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.583 0.23 . . . . 0.0 111.474 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.87 -17.66 32.39 Favored Glycine 0 CA--C 1.522 0.53 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.567 179.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.407 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 43.9 t -101.99 107.99 22.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 117.301 0.55 . . . . 0.0 111.092 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' A' ' 31' ' ' VAL . . . 176.11 171.77 0.39 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.01 0.434 . . . . 0.0 111.326 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -136.16 86.45 2.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.53 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -110.59 136.4 49.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.873 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.4 t70 51.71 86.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.35 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -108.74 133.76 52.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.87 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -157.55 -178.51 7.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.927 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -82.89 138.75 43.08 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.965 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -88.89 113.1 0.64 Allowed 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.656 2.237 . . . . 0.0 111.991 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -90.59 114.15 0.46 Allowed 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 122.21 1.94 . . . . 0.0 112.639 -179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.4 -178.22 1.11 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.721 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.9 m -108.05 88.72 2.8 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 177.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mt -63.61 123.0 17.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.358 -178.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.35 -33.86 3.78 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.739 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.419 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.2 p30 -163.04 -178.97 6.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.979 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.15 -59.63 3.98 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.943 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 44.5 m -60.84 -37.42 82.02 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.834 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.419 ' HB3' ' H ' ' A' ' 45' ' ' ASN . 1.8 t60 -61.86 -31.29 71.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.054 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 1.657 ' HD2' ' CD1' ' A' ' 49' ' ' PHE . 17.8 t80 -72.07 -40.81 68.03 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.099 179.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -62.12 -27.19 68.76 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.051 0.453 . . . . 0.0 110.0 178.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 31.2 t -76.43 -23.77 53.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.47 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 66.5 m -67.31 -38.38 84.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.889 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 3.9 m -85.04 -30.87 23.77 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.317 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.56 -19.7 61.45 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.517 0.675 . . . . 0.0 109.795 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.97 -38.01 89.55 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 114.702 -1.136 . . . . 0.0 112.1 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pt -106.87 6.72 9.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 112.627 0.602 . . . . 0.0 112.627 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.36 44.47 5.28 Favored Glycine 0 CA--C 1.523 0.59 0 C-N-CA 120.385 -0.912 . . . . 0.0 113.864 178.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -147.56 -177.93 5.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 117.346 0.573 . . . . 0.0 111.082 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.419 ' NH2' ' HB ' ' A' ' 26' ' ' THR . 30.6 mtm180 -117.83 155.8 29.48 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.276 -179.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.41 118.72 14.58 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.848 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.0 mmt180 -138.17 114.89 10.62 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.039 0.447 . . . . 0.0 111.859 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.604 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 28.7 t -89.82 111.11 22.03 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.566 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 63.6 m -107.92 149.3 28.5 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.758 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -101.64 143.09 15.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 114.937 -1.029 . . . . 0.0 110.475 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.7 mt -50.38 137.04 23.03 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.351 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -61.24 137.39 70.47 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.485 2.123 . . . . 0.0 112.415 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.457 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 47.8 mm -131.94 109.94 16.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.421 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.463 ' N ' HD21 ' A' ' 68' ' ' LEU . 2.1 pt? -48.18 117.21 1.83 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.292 0.567 . . . . 0.0 110.883 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 120.12 -10.66 10.9 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.487 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.457 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.4 pt20 -138.83 168.44 19.81 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.527 0.679 . . . . 0.0 111.219 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -88.03 168.95 12.38 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.822 -1.081 . . . . 0.0 110.306 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.2 tt -83.22 125.25 40.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.919 0.39 . . . . 0.0 110.701 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.565 ' HB2' HG12 ' A' ' 64' ' ' VAL . 3.9 mm? -97.82 111.39 23.7 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.321 -179.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 77.0 m -139.39 129.34 24.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.708 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -155.84 164.75 38.13 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.807 0.337 . . . . 0.0 110.926 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.402 ' CG2' ' HB2' ' A' ' 80' ' ' LEU . 92.7 m -100.4 121.98 51.44 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.84 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.99 127.36 23.02 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.413 2.075 . . . . 0.0 111.849 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.26 -115.1 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.099 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -141.26 37.3 1.65 Allowed Glycine 0 N--CA 1.438 -1.188 0 C-N-CA 120.852 -0.69 . . . . 0.0 113.739 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.402 ' HB2' ' CG2' ' A' ' 76' ' ' THR . 20.3 mt . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.291 -0.862 . . . . 0.0 110.708 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.495 ' SG ' ' HA ' ' A' ' 21' ' ' ALA . 1.1 m . . . . . 0 CA--C 1.52 -0.208 0 CA-C-O 120.967 0.413 . . . . 0.0 111.164 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.593 ' O ' ' O ' ' A' ' 16' ' ' GLY . 95.5 p -119.47 -159.07 0.76 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.113 0.782 . . . . 0.0 113.113 -178.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.593 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -20.93 -149.8 0.0 OUTLIER Glycine 0 CA--C 1.529 0.95 0 N-CA-C 118.825 2.29 . . . . 0.0 118.825 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.513 ' O ' HD12 ' A' ' 17' ' ' LEU . 1.7 tm? -23.27 -38.18 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 115.417 1.636 . . . . 0.0 115.417 -178.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 1.62 ' HD1' ' CD2' ' A' ' 18' ' ' TYR . 1.7 m-85 -67.97 -36.6 80.33 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.121 -0.631 . . . . 0.0 112.078 -177.113 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.36 -17.73 0.01 OUTLIER Glycine 0 CA--C 1.53 0.988 0 N-CA-C 115.416 0.927 . . . . 0.0 115.416 177.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.509 ' H ' ' C ' ' A' ' 18' ' ' TYR . 41.3 m -116.79 151.5 36.34 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 118.388 1.094 . . . . 0.0 112.0 -178.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.495 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . . . -116.63 111.43 19.85 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.773 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -135.11 -179.61 5.73 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.53 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.543 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 61.8 m -131.33 108.29 9.55 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.028 179.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.474 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 3.3 m -116.61 157.77 24.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.125 -179.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.477 ' HB1' ' HB2' ' A' ' 34' ' ' LEU . . . -88.06 165.46 15.14 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.2 t -128.54 157.05 42.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.926 0.393 . . . . 0.0 111.973 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -86.53 -170.22 2.99 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.026 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.508 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.3 m -61.09 -45.13 99.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.357 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.508 ' HG ' HG22 ' A' ' 28' ' ' VAL . 30.2 mt -77.81 -20.35 53.39 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 -179.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.38 -14.36 33.07 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 120.541 -0.838 . . . . 0.0 113.643 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.5 t -101.95 108.14 23.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 117.249 0.524 . . . . 0.0 111.033 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.91 152.1 0.34 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.958 0.409 . . . . 0.0 111.539 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -120.76 60.89 0.89 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.261 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.477 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 2.6 mt -88.57 138.25 31.59 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.364 -0.834 . . . . 0.0 112.433 -178.199 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.6 t70 39.64 81.22 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.552 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.474 ' HB2' ' HB3' ' A' ' 24' ' ' CYS . 37.0 t -128.89 152.17 48.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.056 0.455 . . . . 0.0 111.055 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -170.17 -172.94 1.4 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.05 -179.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -65.12 136.31 96.59 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.557 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.543 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.7 Cg_endo -90.39 114.69 0.5 Allowed 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.882 2.388 . . . . 0.0 112.483 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -91.35 113.76 0.38 Allowed 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.097 1.865 . . . . 0.0 112.255 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.422 ' HB1' HG21 ' A' ' 52' ' ' THR . . . -175.65 -175.55 0.79 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.004 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.1 m -109.68 88.51 2.76 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.8 mt -64.95 123.5 19.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.115 -178.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.34 -31.36 4.38 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.419 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.7 p30 -164.68 -177.36 4.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.627 0.251 . . . . 0.0 111.137 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.435 ' HB2' HD23 ' A' ' 80' ' ' LEU . . . -52.72 -58.66 6.14 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.868 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 23.7 m -62.25 -37.1 84.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.894 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.419 ' HB3' ' H ' ' A' ' 45' ' ' ASN . 1.9 t60 -61.52 -33.1 73.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.859 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 1.663 ' HD2' ' CD1' ' A' ' 49' ' ' PHE . 22.0 t80 -70.82 -40.04 72.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.165 179.24 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -64.03 -32.19 73.65 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.09 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.4 m -71.76 -24.29 61.74 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.21 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.422 HG21 ' HB1' ' A' ' 41' ' ' ALA . 52.2 m -66.86 -43.43 83.58 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.391 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.494 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 60.8 m -79.19 -26.78 42.6 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.477 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.62 -20.06 54.48 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.448 0.642 . . . . 0.0 110.372 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.09 -37.82 88.84 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.153 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.3 pt -104.5 4.97 10.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.18 42.08 4.12 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.381 -0.914 . . . . 0.0 113.953 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -148.81 -178.12 6.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 117.309 0.555 . . . . 0.0 111.278 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 77.0 mtp180 -118.46 162.5 18.24 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.056 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.494 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -76.27 119.35 20.04 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.129 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -138.36 110.18 7.17 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.947 0.403 . . . . 0.0 111.468 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 48.9 m -79.07 99.91 7.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.558 179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 42.6 m -96.61 138.76 33.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.496 0.665 . . . . 0.0 111.874 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.721 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -96.88 146.92 6.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.497 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.421 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.7 mt -49.42 136.31 16.99 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.382 -179.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 33.2 Cg_exo -60.34 136.8 70.43 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.543 2.162 . . . . 0.0 112.929 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.469 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.9 mm -129.07 104.79 11.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.271 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.25 120.1 2.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.005 0.431 . . . . 0.0 111.235 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 117.01 -10.25 15.4 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.622 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.5 pt20 -137.85 168.36 19.86 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.585 0.707 . . . . 0.0 111.41 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -84.58 170.0 13.84 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.277 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.43 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.5 tt -82.99 126.32 40.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.965 0.412 . . . . 0.0 110.729 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.526 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.0 mm? -97.46 110.81 23.29 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.177 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.43 ' SG ' HG12 ' A' ' 72' ' ' ILE . 50.0 m -146.02 130.82 18.06 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.123 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -160.61 165.67 30.29 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.784 0.325 . . . . 0.0 110.754 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 50.4 m -81.01 136.55 50.38 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.961 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -87.37 137.6 4.35 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.619 2.212 . . . . 0.0 112.887 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.29 2.71 0.89 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.904 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.05 41.84 53.28 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.375 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.435 HD23 ' HB2' ' A' ' 46' ' ' ALA . 36.2 mt . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.24 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.463 0.18 0 CA-C-O 122.018 0.913 . . . . 0.0 112.86 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.582 ' O ' ' O ' ' A' ' 16' ' ' GLY . 1.8 m -101.13 -154.02 0.47 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.738 -1.119 . . . . 0.0 112.914 -176.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.582 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -13.32 -145.34 0.0 OUTLIER Glycine 0 CA--C 1.529 0.941 0 N-CA-C 118.355 2.102 . . . . 0.0 118.355 -179.097 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -20.0 -47.62 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 -176.179 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 1.591 ' HD1' ' CD2' ' A' ' 18' ' ' TYR . 2.6 m-85 -69.85 -38.62 76.51 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.016 0.825 . . . . 0.0 111.369 -178.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 16' ' ' GLY . . . 56.23 -12.52 0.01 OUTLIER Glycine 0 CA--C 1.527 0.831 0 N-CA-C 116.092 1.197 . . . . 0.0 116.092 176.437 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.457 ' H ' ' C ' ' A' ' 18' ' ' TYR . 21.2 m -135.31 155.41 50.67 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.849 1.325 . . . . 0.0 112.852 -177.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.33 103.66 10.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.346 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -124.86 -169.51 2.0 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.872 0.368 . . . . 0.0 111.279 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.9 t -142.14 139.08 32.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.246 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -155.8 171.08 20.64 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.975 0.417 . . . . 0.0 111.181 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.36 168.59 10.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.802 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.1 t -133.9 157.79 45.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.79 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -81.91 -169.86 2.57 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.282 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.5 HG22 ' HG ' ' A' ' 29' ' ' LEU . 7.2 m -63.04 -45.08 99.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.737 -179.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.5 ' HG ' HG22 ' A' ' 28' ' ' VAL . 26.5 mt -78.38 -20.4 51.32 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.598 0.222 . . . . 0.0 111.598 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.27 -15.82 32.69 Favored Glycine 0 CA--C 1.522 0.491 0 C-N-CA 120.636 -0.793 . . . . 0.0 113.558 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.3 t -101.42 107.56 21.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 117.26 0.53 . . . . 0.0 110.932 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.99 166.62 0.93 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.069 0.462 . . . . 0.0 111.429 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -133.51 89.09 2.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.558 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -119.82 135.83 54.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.696 -178.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.7 t70 51.51 83.83 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.364 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.6 m -108.86 133.01 53.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.7 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -159.47 -179.03 7.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.141 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -78.49 140.3 59.89 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.005 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -90.69 113.86 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 122.906 2.404 . . . . 0.0 111.904 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -90.22 113.51 0.49 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 121.893 1.728 . . . . 0.0 112.845 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -176.16 -177.59 0.91 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.936 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.2 m -108.72 88.88 2.83 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 177.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.3 mt -64.2 124.93 22.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.678 -178.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.417 ' HB2' ' ND1' ' A' ' 48' ' ' HIS . . . -120.97 -33.01 3.83 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.862 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.402 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.5 p30 -163.5 -177.28 5.16 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.113 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.01 -59.23 4.59 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.929 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 23.0 m -61.82 -38.43 88.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.871 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.417 ' ND1' ' HB2' ' A' ' 44' ' ' ALA . 1.7 t60 -61.17 -32.26 71.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.03 0.443 . . . . 0.0 109.845 179.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 1.639 ' HD2' ' CD1' ' A' ' 49' ' ' PHE . 17.7 t80 -69.94 -37.03 75.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.12 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.66 -32.85 74.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.286 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.2 t -70.55 -20.54 62.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.508 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 54.4 m -68.45 -44.02 75.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.118 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 19.0 m -81.11 -28.44 35.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.493 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.85 -19.58 62.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.554 0.693 . . . . 0.0 109.717 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.49 -38.85 90.97 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 114.653 -1.158 . . . . 0.0 112.17 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.8 pt -105.27 8.39 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -179.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.63 38.78 10.24 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 120.438 -0.886 . . . . 0.0 113.452 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -139.21 -175.93 4.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.719 0.26 . . . . 0.0 110.866 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 77.3 mtp180 -120.46 155.36 33.7 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 121.008 0.433 . . . . 0.0 111.903 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -84.97 124.96 32.28 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.022 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.487 ' HE ' ' HB3' ' A' ' 74' ' ' CYS . 13.8 ptm180 -149.49 125.16 10.41 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.131 0.491 . . . . 0.0 110.909 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 31.8 m -85.26 99.61 11.24 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.719 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 59.9 m -90.94 143.21 26.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.331 0.586 . . . . 0.0 111.265 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.519 ' CG1' ' HB2' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -99.77 146.38 8.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.662 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.506 ' N ' HG21 ' A' ' 64' ' ' VAL . 7.0 mt -49.43 133.09 18.2 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.502 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -64.27 139.76 67.45 Favored 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 122.615 2.21 . . . . 0.0 112.596 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 51.0 mm -129.08 109.55 18.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.231 179.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.26 109.16 0.17 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.827 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.46 -13.49 6.22 Favored Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.611 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -133.51 167.71 19.96 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.524 0.678 . . . . 0.0 111.227 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -83.22 169.61 15.57 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.654 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.8 tt -83.19 126.89 40.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.719 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.519 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.1 mm? -101.96 112.21 24.76 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.965 0.412 . . . . 0.0 111.284 -179.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.487 ' HB3' ' HE ' ' A' ' 61' ' ' ARG . 63.4 m -143.99 135.09 25.51 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.703 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -158.26 171.24 20.55 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.947 0.403 . . . . 0.0 111.013 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.5 m -99.08 137.01 20.38 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.696 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -87.67 142.16 5.76 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.545 2.163 . . . . 0.0 112.821 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.58 6.5 2.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.782 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.92 36.09 73.16 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.26 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 38.5 mt . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.008 179.902 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.4 t . . . . . 0 CA--C 1.52 -0.211 0 CA-C-O 121.147 0.498 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.592 ' O ' ' O ' ' A' ' 16' ' ' GLY . 87.5 p -120.25 -156.35 0.66 Allowed 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.529 -178.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.592 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -17.01 -146.92 0.0 OUTLIER Glycine 0 CA--C 1.53 0.981 0 N-CA-C 118.349 2.1 . . . . 0.0 118.349 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.449 ' O ' HD12 ' A' ' 17' ' ' LEU . 1.1 tm? -22.03 -41.41 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 115.19 1.552 . . . . 0.0 115.19 -177.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.575 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 2.0 m-85 -69.13 -36.91 78.0 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.093 -0.643 . . . . 0.0 111.947 -177.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.87 -14.09 0.02 OUTLIER Glycine 0 CA--C 1.528 0.853 0 N-CA-C 115.495 0.958 . . . . 0.0 115.495 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.487 ' H ' ' C ' ' A' ' 18' ' ' TYR . 28.2 m -140.26 144.89 36.7 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 118.471 1.135 . . . . 0.0 112.215 -178.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -108.59 112.56 24.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.707 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.434 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 16.8 mm-40 -131.32 -175.91 3.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.0 0.429 . . . . 0.0 111.216 -179.388 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.547 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 71.0 m -127.56 109.97 12.25 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.032 179.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.524 ' HB2' ' HD3' ' A' ' 61' ' ' ARG . 59.2 m -127.59 155.92 43.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.094 0.474 . . . . 0.0 111.416 -179.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -86.42 165.41 16.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.584 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.7 t -126.43 157.22 39.16 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.478 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -80.78 -170.34 2.61 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.106 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.512 HG22 ' HG ' ' A' ' 29' ' ' LEU . 7.0 m -62.93 -45.53 98.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -179.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.512 ' HG ' HG22 ' A' ' 28' ' ' VAL . 28.0 mt -78.46 -20.17 51.53 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.647 0.261 . . . . 0.0 111.615 -178.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.29 -16.11 32.45 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.631 -0.795 . . . . 0.0 113.784 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.3 t -101.49 108.11 22.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 117.163 0.481 . . . . 0.0 111.191 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.21 167.17 0.78 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 121.106 0.479 . . . . 0.0 111.492 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -133.04 85.94 2.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.464 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -114.2 141.9 46.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.983 -178.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 46.8 82.1 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.863 178.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 34.2 m -110.0 129.64 55.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.929 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -153.18 -178.07 6.71 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.056 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -78.28 134.86 62.28 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.553 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.547 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.1 Cg_endo -89.61 114.61 0.6 Allowed 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.832 2.355 . . . . 0.0 112.053 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -90.7 112.87 0.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 121.885 1.724 . . . . 0.0 112.342 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -176.0 -176.55 0.83 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.756 179.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 42.6 m -111.22 88.58 2.82 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.3 mt -61.44 122.03 14.17 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.397 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.4 -32.84 4.0 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.94 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -165.41 -178.92 5.21 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 120.756 0.312 . . . . 0.0 111.307 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.14 -60.14 3.25 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 112.007 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 32.0 m -60.97 -36.57 79.76 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.857 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -62.76 -31.73 72.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.77 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 1.656 ' HD2' ' CD1' ' A' ' 49' ' ' PHE . 13.2 t80 -70.17 -38.66 75.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.958 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -64.55 -34.67 78.8 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.426 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.2 t -72.92 -13.06 61.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.061 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 87.1 m -80.3 -40.83 26.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.232 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.459 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 72.8 m -85.93 -25.43 26.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.261 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.4 -19.91 52.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.363 0.602 . . . . 0.0 110.357 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.7 -37.72 88.56 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.051 -0.977 . . . . 0.0 112.278 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.1 pt -103.28 7.33 9.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.58 40.97 5.22 Favored Glycine 0 CA--C 1.522 0.493 0 C-N-CA 120.408 -0.901 . . . . 0.0 114.041 178.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -146.77 -179.03 6.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.344 0.572 . . . . 0.0 111.142 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 44.0 mtp180 -116.81 153.55 32.27 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.111 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.459 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -77.32 121.22 23.42 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.569 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.525 HH21 ' HB2' ' A' ' 74' ' ' CYS . 13.4 ptm180 -155.6 115.58 3.71 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 121.23 0.538 . . . . 0.0 110.551 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 20' ' ' THR . 33.5 m -79.11 103.21 8.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.745 -179.062 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 23.4 m -94.12 123.94 37.82 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 121.435 0.636 . . . . 0.0 111.572 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.575 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 1.5 p -72.85 148.05 9.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.182 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.411 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 7.9 mt -51.88 137.32 35.5 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.931 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 31.2 Cg_exo -60.37 124.78 15.84 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.386 2.057 . . . . 0.0 112.369 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.465 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.0 mm -124.85 101.67 9.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.565 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -48.33 120.21 3.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.14 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.2 -12.18 11.41 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.63 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.8 pt20 -135.27 168.45 19.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.396 0.617 . . . . 0.0 111.137 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -84.35 166.25 17.56 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.252 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.456 HG12 ' SG ' ' A' ' 74' ' ' CYS . 15.9 tt -83.31 126.91 40.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.807 0.337 . . . . 0.0 110.575 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.535 ' HB2' HG12 ' A' ' 64' ' ' VAL . 4.0 mm? -99.55 102.22 13.68 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.589 -179.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.525 ' HB2' HH21 ' A' ' 61' ' ' ARG . 44.3 m -137.81 131.63 31.44 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.803 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -160.32 163.44 33.32 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.745 0.307 . . . . 0.0 111.218 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.6 m -99.99 116.79 64.31 Favored Pre-proline 0 CA--C 1.532 0.274 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.11 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.21 136.73 61.84 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.663 2.242 . . . . 0.0 112.722 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.25 1.67 0.74 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.05 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.83 38.79 65.65 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.252 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 36.0 mt . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.155 -0.926 . . . . 0.0 111.104 179.934 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.3 t . . . . . 0 N--CA 1.472 0.662 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.8 p -95.42 115.32 27.26 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 171.31 -165.72 38.77 Favored Glycine 0 N--CA 1.44 -1.074 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.272 -177.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.459 ' O ' HD12 ' A' ' 17' ' ' LEU . 1.7 tm? -61.67 -36.37 80.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.631 -0.784 . . . . 0.0 110.337 177.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 1.668 ' HE2' ' CE1' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -81.58 -36.01 29.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.256 -178.167 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.79 -11.56 0.02 OUTLIER Glycine 0 CA--C 1.529 0.919 0 N-CA-C 115.859 1.104 . . . . 0.0 115.859 177.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.45 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 16.3 m -111.3 126.96 55.46 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 118.792 1.296 . . . . 0.0 112.613 -178.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -96.55 101.35 12.95 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.816 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.411 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 28.1 mm-40 -128.52 -174.74 3.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.935 0.397 . . . . 0.0 111.145 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.588 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 64.3 m -134.8 114.75 12.93 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.123 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.82 161.42 32.98 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.983 0.421 . . . . 0.0 111.164 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.498 ' HB1' ' HB2' ' A' ' 34' ' ' LEU . . . -87.94 166.34 14.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.675 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.0 t -131.05 157.64 42.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.814 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.465 ' HB3' ' HB1' ' A' ' 32' ' ' ALA . 0.8 OUTLIER -82.11 -169.59 2.47 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.103 -179.503 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.485 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.9 m -62.0 -47.14 94.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.747 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.485 ' HG ' HG22 ' A' ' 28' ' ' VAL . 33.2 mt -76.91 -19.99 56.74 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -178.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.98 -12.23 31.88 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.353 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.525 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 7.4 p -100.64 108.72 23.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 117.137 0.469 . . . . 0.0 111.255 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.525 ' HB1' ' O ' ' A' ' 31' ' ' VAL . . . 172.72 153.72 0.08 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.881 -179.571 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -123.88 67.26 1.03 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.632 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.498 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 2.0 mt -90.3 135.76 33.48 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.466 -178.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 52.23 83.44 0.06 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.39 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.7 m -108.91 134.0 52.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.537 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -160.62 -178.28 6.77 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.838 0.351 . . . . 0.0 111.319 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 -81.33 136.82 49.08 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.725 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.588 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 68.4 Cg_endo -90.51 117.08 0.59 Allowed 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 123.034 2.489 . . . . 0.0 112.746 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -91.31 113.41 0.37 Allowed 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.052 1.835 . . . . 0.0 112.227 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.89 -178.57 1.06 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.833 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.9 m -109.27 88.09 2.65 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 177.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.0 mt -63.08 124.4 21.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.408 -178.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -117.8 -40.33 3.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.981 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -151.08 -168.41 3.09 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.985 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.89 -44.32 81.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.2 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.5 m -68.35 -39.22 81.94 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.552 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -60.25 -34.99 74.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.787 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 1.64 ' HD2' ' CD1' ' A' ' 49' ' ' PHE . 21.4 t80 -68.42 -39.07 81.73 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.932 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -61.78 -39.57 92.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.23 0.538 . . . . 0.0 109.746 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.1 m -68.09 -24.33 65.04 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.171 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 90.4 m -68.56 -43.52 76.45 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.304 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.535 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 59.0 m -78.74 -26.13 44.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.102 -179.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.63 -19.93 54.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.4 0.619 . . . . 0.0 110.139 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.05 -37.29 86.89 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.983 -1.008 . . . . 0.0 112.043 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.3 pt -105.39 8.74 9.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 -178.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.67 42.72 5.67 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 120.413 -0.899 . . . . 0.0 114.015 178.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -147.83 -178.55 6.33 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 117.336 0.568 . . . . 0.0 111.192 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -120.31 153.15 36.82 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.338 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.535 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -67.99 117.67 10.16 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.704 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.3 mmm180 -136.02 115.24 12.48 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.988 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.691 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 23.0 t -93.29 109.28 20.81 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.53 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 76.7 m -104.67 148.67 26.31 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.22 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.764 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -99.02 148.32 6.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.761 179.861 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.2 mt -49.48 140.74 13.38 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.395 -179.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.407 ' O ' HD11 ' A' ' 67' ' ' ILE . 33.0 Cg_exo -59.52 137.98 81.03 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.674 2.249 . . . . 0.0 112.495 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.407 HD11 ' O ' ' A' ' 66' ' ' PRO . 31.1 mm -131.97 108.56 14.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.308 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.72 121.46 7.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.001 0.429 . . . . 0.0 111.406 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 114.76 -4.58 22.76 Favored Glycine 0 C--N 1.33 0.212 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.682 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -148.67 165.4 31.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.324 0.583 . . . . 0.0 111.189 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -81.37 169.9 16.66 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.648 -179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.3 tt -82.74 123.65 38.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.116 0.484 . . . . 0.0 110.502 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.518 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.1 mm? -90.52 110.93 22.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.254 -179.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 67.2 m -138.15 132.33 31.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.143 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.81 168.64 26.83 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.815 0.34 . . . . 0.0 110.611 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.425 HG21 ' HD2' ' A' ' 77' ' ' PRO . 86.0 m -96.73 137.25 21.42 Favored Pre-proline 0 CA--C 1.532 0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.761 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . 0.425 ' HD2' HG21 ' A' ' 76' ' ' THR . 86.2 Cg_endo -83.48 139.49 9.07 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.418 2.079 . . . . 0.0 112.958 -179.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.06 3.37 1.25 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.038 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.35 38.51 87.3 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.249 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 31.5 mt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.235 179.965 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.6 t . . . . . 0 CA--C 1.52 -0.192 0 CA-C-O 121.24 0.543 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.599 ' O ' ' O ' ' A' ' 16' ' ' GLY . 88.7 p -115.16 -156.4 0.6 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.588 -178.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.599 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -17.58 -148.35 0.0 OUTLIER Glycine 0 CA--C 1.529 0.933 0 N-CA-C 118.701 2.241 . . . . 0.0 118.701 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.401 HD12 ' O ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -23.23 -41.41 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -177.232 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.562 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 5.3 m-85 -68.3 -36.74 79.8 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 119.895 -0.722 . . . . 0.0 111.497 -177.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.2 -12.13 0.01 OUTLIER Glycine 0 CA--C 1.526 0.742 0 N-CA-C 115.644 1.018 . . . . 0.0 115.644 176.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.467 ' H ' ' C ' ' A' ' 18' ' ' TYR . 26.9 m -137.91 143.34 40.77 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 118.631 1.216 . . . . 0.0 112.451 -178.143 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -110.6 106.39 15.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.554 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.452 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 20.0 mm-40 -126.18 -176.55 3.68 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.834 0.35 . . . . 0.0 111.309 -179.21 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.474 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 72.6 m -124.64 111.8 16.04 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.159 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.566 ' HB2' ' HD3' ' A' ' 61' ' ' ARG . 63.6 m -128.61 153.84 46.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.208 0.527 . . . . 0.0 111.566 -179.265 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.451 ' HB2' ' HB2' ' A' ' 34' ' ' LEU . . . -84.88 166.81 16.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.667 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.5 t -133.96 158.23 44.03 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.742 -179.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -77.99 -169.93 1.74 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.369 -179.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.481 HG22 ' HG ' ' A' ' 29' ' ' LEU . 7.3 m -64.25 -46.61 92.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.722 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.481 ' HG ' HG22 ' A' ' 28' ' ' VAL . 30.7 mt -75.91 -19.94 58.41 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -178.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.75 -15.29 31.76 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 120.589 -0.815 . . . . 0.0 113.625 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 40.4 t -101.49 107.83 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 117.28 0.54 . . . . 0.0 111.006 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 176.17 158.46 0.27 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.315 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -127.48 89.92 3.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.78 179.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.451 ' HB2' ' HB2' ' A' ' 25' ' ' ALA . 2.9 mt -116.73 141.91 47.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.798 -178.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.6 t70 48.9 83.3 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.679 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 35.8 m -112.78 131.1 55.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.018 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -161.66 -179.51 7.33 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.878 0.37 . . . . 0.0 111.099 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -73.26 133.16 81.28 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.271 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.474 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 63.7 Cg_endo -90.14 124.11 1.14 Allowed 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.807 2.338 . . . . 0.0 112.14 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -90.85 113.32 0.41 Allowed 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 121.88 1.72 . . . . 0.0 112.34 -179.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.75 -179.69 1.24 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.615 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 48.3 m -109.66 88.03 2.65 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 177.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.4 mt -61.84 120.73 11.29 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.201 -178.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.424 ' HB2' ' ND1' ' A' ' 48' ' ' HIS . . . -120.33 -33.39 3.89 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.904 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -165.14 -178.76 5.27 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.738 0.304 . . . . 0.0 111.288 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.22 -60.71 2.57 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.213 -0.449 . . . . 0.0 112.1 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 22.0 m -60.1 -37.25 79.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.825 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.424 ' ND1' ' HB2' ' A' ' 44' ' ' ALA . 1.6 t60 -62.02 -32.63 73.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.929 179.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.418 ' CE2' ' HB2' ' A' ' 60' ' ' ALA . 11.0 t80 -69.51 -39.19 77.7 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.881 178.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -63.53 -38.39 90.96 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.009 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.9 m -67.16 -15.48 63.74 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.377 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 91.5 m -79.34 -41.4 27.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.517 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.464 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 74.8 m -86.04 -22.99 26.94 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.251 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.93 -20.02 42.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.388 0.613 . . . . 0.0 110.361 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.1 -37.78 88.68 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.054 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.6 pt -104.42 11.17 8.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.21 43.75 6.51 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.5 -0.857 . . . . 0.0 114.185 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -144.34 179.89 6.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 117.399 0.599 . . . . 0.0 111.136 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -115.32 145.6 42.33 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.195 -179.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.464 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -72.25 123.69 23.49 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.344 -179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.566 ' HD3' ' HB2' ' A' ' 24' ' ' CYS . 13.9 ptm180 -155.86 126.29 6.74 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.929 0.395 . . . . 0.0 110.507 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.408 ' HB3' ' O ' ' A' ' 20' ' ' THR . 25.5 m -90.45 100.74 13.53 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.961 -179.017 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.576 ' HA ' ' HB2' ' A' ' 74' ' ' CYS . 9.2 m -98.32 115.34 28.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.247 0.546 . . . . 0.0 112.234 -178.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.562 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -65.64 146.25 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.466 179.212 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.5 mt -49.81 135.31 20.24 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.261 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -62.43 136.96 62.16 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.506 2.138 . . . . 0.0 112.574 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.477 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 51.2 mm -129.12 104.54 11.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.482 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.59 119.5 2.46 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.035 0.445 . . . . 0.0 111.16 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.43 -12.14 11.22 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.553 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.7 pt20 -135.21 168.46 19.11 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.486 0.66 . . . . 0.0 111.207 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -82.24 166.12 19.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.308 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.3 tt -83.53 124.65 39.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-O 120.951 0.405 . . . . 0.0 111.072 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.496 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.7 mm? -101.19 109.42 21.3 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.849 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.576 ' HB2' ' HA ' ' A' ' 63' ' ' CYS . 51.3 t -161.78 133.65 5.59 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.515 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -160.95 171.88 17.91 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.099 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 74.4 m -77.7 136.97 62.88 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.665 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -84.09 134.41 6.04 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.398 2.066 . . . . 0.0 112.887 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.37 2.29 1.13 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.024 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 73.5 42.17 41.77 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.463 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 28.2 mt . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.148 179.907 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.481 1.124 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -93.73 116.95 29.46 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.0 -166.18 39.02 Favored Glycine 0 N--CA 1.439 -1.128 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.996 -177.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.482 HD11 ' O ' ' A' ' 17' ' ' LEU . 1.7 tm? -59.05 -36.73 75.53 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.596 -0.802 . . . . 0.0 110.686 178.07 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 1.669 ' HD2' ' CD1' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -82.29 -37.58 25.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.141 -178.106 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.07 -12.34 0.02 OUTLIER Glycine 0 CA--C 1.529 0.911 0 N-CA-C 115.586 0.994 . . . . 0.0 115.586 177.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.472 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 17.9 m -109.1 123.87 49.88 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 118.625 1.212 . . . . 0.0 112.194 -178.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.2 102.29 14.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.931 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.2 mm-40 -128.41 -174.22 3.17 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.051 0.453 . . . . 0.0 111.249 -179.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.548 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 70.9 m -128.03 116.14 19.56 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.031 179.327 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.53 ' HB2' ' HD3' ' A' ' 61' ' ' ARG . 78.2 m -129.77 158.49 39.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.068 0.461 . . . . 0.0 111.407 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.32 165.71 12.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.569 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.2 t -125.55 157.39 37.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.78 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -81.48 -170.1 2.62 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.224 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.476 HG22 ' HG ' ' A' ' 29' ' ' LEU . 7.3 m -62.65 -47.1 94.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.476 ' HG ' HG22 ' A' ' 28' ' ' VAL . 29.1 mt -77.65 -20.28 54.04 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.587 0.232 . . . . 0.0 111.531 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.21 -17.47 31.65 Favored Glycine 0 CA--C 1.522 0.483 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.696 179.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.402 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 49.0 t -101.61 108.07 22.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 117.276 0.538 . . . . 0.0 111.142 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 31' ' ' VAL . . . 175.45 170.9 0.32 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.058 0.456 . . . . 0.0 111.328 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -133.28 95.05 3.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.58 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mt -120.53 140.52 51.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.892 -178.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.6 t70 48.1 82.53 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.795 178.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 47.1 m -113.13 129.79 56.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.821 179.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.76 -178.28 7.14 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.979 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -73.92 136.94 76.4 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.496 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.548 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.1 Cg_endo -89.47 117.17 0.75 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.826 2.35 . . . . 0.0 112.276 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -90.52 112.74 0.43 Allowed 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 121.765 1.643 . . . . 0.0 112.561 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -176.28 -176.35 0.77 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.647 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.6 m -110.84 88.54 2.8 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -63.09 124.32 20.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.382 -178.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.73 -33.72 3.73 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.75 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.41 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.8 p30 -163.2 -178.6 6.08 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.157 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.13 -59.68 3.92 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.333 -0.394 . . . . 0.0 112.005 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 35.0 m -61.54 -36.1 79.64 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.975 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.41 ' HB3' ' H ' ' A' ' 45' ' ' ASN . 1.9 t60 -62.44 -32.95 73.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.824 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 1.658 ' HD2' ' CD1' ' A' ' 49' ' ' PHE . 18.3 t80 -70.34 -39.56 74.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.944 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -60.63 -36.85 79.66 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.27 0.557 . . . . 0.0 109.773 178.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 51.1 m -67.34 -22.73 65.58 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.479 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 75.6 m -70.07 -43.77 70.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.551 -179.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.539 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 81.0 m -83.02 -24.94 32.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.189 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.96 -19.92 56.75 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.414 0.626 . . . . 0.0 110.115 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.97 -38.86 92.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.891 -1.049 . . . . 0.0 112.137 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.8 pt -101.76 9.91 8.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.41 39.47 6.33 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.554 -0.831 . . . . 0.0 114.225 178.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -146.41 -177.47 5.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 117.161 0.481 . . . . 0.0 111.131 179.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 58.3 mtt180 -119.97 154.96 33.73 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.682 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.539 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -65.9 119.61 11.62 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.364 -179.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.53 ' HD3' ' HB2' ' A' ' 24' ' ' CYS . 39.6 mtp180 -135.93 118.29 15.7 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.161 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.651 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 14.2 t -96.19 107.04 19.32 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.535 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 54.3 m -102.8 146.94 27.5 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.365 0.602 . . . . 0.0 112.548 -178.393 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.73 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -97.76 143.85 12.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.55 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.9 mt -49.66 139.55 15.64 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.212 -179.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 31.5 Cg_exo -59.28 132.8 48.71 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.54 2.16 . . . . 0.0 112.5 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.451 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 51.1 mm -129.55 106.94 14.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.763 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.21 120.47 5.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.301 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.07 -12.53 11.46 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.635 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.9 pt20 -135.44 167.25 21.42 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.504 0.668 . . . . 0.0 111.299 -179.771 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -81.84 169.87 16.36 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.218 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.1 tt -82.8 125.71 40.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.895 0.378 . . . . 0.0 110.928 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.544 ' HB2' HG12 ' A' ' 64' ' ' VAL . 3.8 mm? -101.61 113.01 25.76 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.01 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 72.5 m -146.45 129.12 16.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.048 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -160.87 170.13 21.28 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 120.867 0.365 . . . . 0.0 110.986 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 85.4 m -92.61 136.41 25.24 Favored Pre-proline 0 CA--C 1.532 0.28 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.001 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -86.89 144.36 7.3 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.685 2.257 . . . . 0.0 112.599 -179.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 68.36 -0.94 2.02 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.759 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.11 35.7 64.26 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.578 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 42.1 mt . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.253 -0.879 . . . . 0.0 111.172 179.934 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 14.6 p . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.876 0.369 . . . . 0.0 111.541 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.6 p -97.59 116.89 30.68 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 173.35 -155.17 21.92 Favored Glycine 0 N--CA 1.435 -1.387 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.57 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.44 ' O ' HD12 ' A' ' 17' ' ' LEU . 1.8 tm? -62.96 -42.45 99.83 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.762 0.425 . . . . 0.0 111.225 178.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.769 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -78.1 -38.15 44.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.179 0.514 . . . . 0.0 112.028 -178.222 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.9 -8.92 0.02 OUTLIER Glycine 0 CA--C 1.527 0.785 0 CA-C-N 115.148 -0.933 . . . . 0.0 115.288 176.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.441 ' H ' ' C ' ' A' ' 18' ' ' TYR . 89.9 m -112.54 123.05 49.44 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 118.491 1.145 . . . . 0.0 112.546 -178.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.1 118.49 27.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.081 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -146.52 167.79 22.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.858 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.487 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 60.8 m -117.45 113.29 21.83 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.09 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.09 156.35 49.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.018 0.437 . . . . 0.0 111.269 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.529 ' HB1' ' HB2' ' A' ' 34' ' ' LEU . . . -80.56 166.35 21.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.747 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.4 t -131.02 157.68 42.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.927 -179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -82.17 -169.6 2.48 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.237 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.507 HG22 ' HG ' ' A' ' 29' ' ' LEU . 8.5 m -62.65 -46.16 97.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.612 -179.438 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.507 ' HG ' HG22 ' A' ' 28' ' ' VAL . 29.3 mt -78.42 -20.12 51.77 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 -178.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.43 -15.36 32.56 Favored Glycine 0 CA--C 1.52 0.402 0 C-N-CA 120.633 -0.794 . . . . 0.0 113.575 179.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.5 t -101.53 108.13 22.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 117.244 0.522 . . . . 0.0 111.181 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 177.68 168.39 0.68 Allowed 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.264 179.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -134.42 90.38 2.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.731 179.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.529 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 2.1 mt -118.6 135.91 54.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.605 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 51.9 84.08 0.05 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.349 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -109.29 134.96 51.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.863 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.7 164.24 36.09 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.182 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -60.92 136.01 93.24 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.914 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.487 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.7 Cg_endo -90.16 109.66 0.4 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.825 2.35 . . . . 0.0 112.3 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -91.21 113.88 0.39 Allowed 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.124 1.883 . . . . 0.0 112.741 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.403 ' HB1' HG21 ' A' ' 52' ' ' THR . . . -175.47 -177.44 1.0 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.788 178.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.3 m -109.09 88.65 2.78 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.0 mt -65.61 120.16 12.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.352 -178.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -117.32 -40.58 3.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.791 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -151.99 -169.09 3.26 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.969 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.46 -48.48 77.53 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.423 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 27.8 m -66.75 -42.05 86.83 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.679 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -60.04 -32.82 71.27 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 1.671 ' HD2' ' CD1' ' A' ' 49' ' ' PHE . 13.9 t80 -68.54 -38.88 81.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.866 178.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -62.45 -37.39 85.7 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.143 0.497 . . . . 0.0 109.769 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.0 m -69.6 -13.37 62.28 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.616 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.403 HG21 ' HB1' ' A' ' 41' ' ' ALA . 49.8 m -75.08 -44.89 44.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.436 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.506 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 60.4 m -84.99 -25.52 27.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.974 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.3 -20.16 59.27 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.519 0.676 . . . . 0.0 109.921 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.46 -38.57 90.22 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.733 -1.121 . . . . 0.0 112.145 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.1 pt -100.98 -0.93 10.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.98 39.69 2.83 Favored Glycine 0 CA--C 1.521 0.446 0 C-N-CA 120.284 -0.96 . . . . 0.0 113.963 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -149.8 -177.21 5.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 117.057 0.428 . . . . 0.0 110.906 179.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 53.5 mtt180 -118.76 154.82 32.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.843 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.506 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -70.37 116.62 10.92 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.256 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.8 mmm180 -133.56 118.42 18.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.038 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.66 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 34.7 t -94.32 108.62 20.5 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.42 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.547 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 65.5 m -105.82 146.01 30.45 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.399 0.619 . . . . 0.0 112.551 -178.312 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.769 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -95.18 146.95 6.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.39 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.422 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.4 mt -49.49 135.64 17.78 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.369 -179.184 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 30.8 Cg_exo -62.32 136.47 59.85 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.571 2.18 . . . . 0.0 112.452 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.5 mm -129.92 109.02 17.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.417 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.54 109.29 0.29 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.058 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.97 -11.62 6.19 Favored Glycine 0 C--N 1.333 0.384 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.882 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -135.8 167.87 20.36 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.484 0.659 . . . . 0.0 111.41 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -81.39 166.95 19.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.301 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.9 tt -83.3 124.32 39.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 121.037 0.446 . . . . 0.0 110.803 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.521 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.0 mm? -97.68 110.39 22.96 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.224 -179.425 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 68.2 m -141.15 130.83 24.11 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.595 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -154.78 161.18 41.6 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.781 0.324 . . . . 0.0 110.874 -179.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 71.4 m -100.56 123.52 45.79 Favored Pre-proline 0 CA--C 1.533 0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.127 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -67.21 140.79 54.77 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.563 2.175 . . . . 0.0 112.714 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.11 2.32 1.04 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.061 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.68 35.07 73.41 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.408 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.3 mt . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.996 179.897 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.464 0.275 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.8 p -96.27 115.57 27.64 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.12 -155.08 22.94 Favored Glycine 0 N--CA 1.436 -1.31 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.397 -177.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.426 HD11 ' O ' ' A' ' 17' ' ' LEU . 1.5 tm? -67.16 -40.13 86.6 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.899 0.381 . . . . 0.0 110.717 177.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.711 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.2 OUTLIER -75.23 -37.97 60.84 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.268 0.556 . . . . 0.0 111.422 -178.8 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.75 -9.44 0.02 OUTLIER Glycine 0 CA--C 1.524 0.651 0 CA-C-N 114.922 -1.035 . . . . 0.0 114.945 177.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.468 ' H ' ' C ' ' A' ' 18' ' ' TYR . 6.0 m -109.56 142.36 40.76 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 118.16 0.98 . . . . 0.0 112.212 -178.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -113.74 100.64 8.61 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.484 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.56 ' NE2' ' HA ' ' A' ' 38' ' ' ASN . 6.1 mm-40 -134.23 -177.74 4.72 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.919 0.39 . . . . 0.0 111.349 -178.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.479 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 56.9 m -126.34 106.82 9.78 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 178.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.433 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 2.0 m -109.08 154.46 22.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.604 -178.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -91.0 166.97 12.73 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.699 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.3 t -131.86 158.25 41.82 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -179.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.93 -169.63 2.09 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.198 -179.608 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.477 HG22 ' HG ' ' A' ' 29' ' ' LEU . 7.1 m -63.56 -46.34 95.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.676 -179.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.477 ' HG ' HG22 ' A' ' 28' ' ' VAL . 34.3 mt -76.25 -19.65 58.13 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -178.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.97 -13.29 31.81 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.566 -0.826 . . . . 0.0 113.497 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 61.1 t -101.45 108.05 22.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 117.132 0.466 . . . . 0.0 111.108 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 176.13 163.4 0.37 Allowed 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.406 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -134.56 65.95 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.431 179.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 mt -93.15 138.38 31.62 Favored 'General case' 0 C--O 1.226 -0.159 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.567 -178.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 43.95 83.42 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.769 177.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.433 ' HB2' ' HB3' ' A' ' 24' ' ' CYS . 21.0 t -133.33 136.38 45.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.91 0.386 . . . . 0.0 110.66 179.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -164.1 -174.87 3.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.503 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.56 ' HA ' ' NE2' ' A' ' 22' ' ' GLN . 6.3 p30 -58.43 126.35 78.67 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.702 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.479 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 68.4 Cg_endo -90.57 134.37 1.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 122.751 2.301 . . . . 0.0 112.293 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -91.66 113.76 0.36 Allowed 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.207 1.938 . . . . 0.0 112.839 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.63 -178.63 1.12 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.021 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.0 m -110.33 88.47 2.77 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 177.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.9 mt -64.56 120.15 11.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.41 -178.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -115.36 -40.94 3.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.78 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -152.01 -169.02 3.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.806 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.11 -41.56 94.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.221 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.1 m -70.61 -44.47 67.17 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.759 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -58.56 -34.88 71.53 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 1.661 ' HE1' ' CE2' ' A' ' 49' ' ' PHE . 13.5 t80 -67.32 -38.33 84.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.581 178.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -60.66 -40.51 92.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.222 0.535 . . . . 0.0 109.761 178.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.6 m -66.3 -23.85 66.45 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.442 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 66.4 m -63.97 -45.93 86.9 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.501 -179.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 61.1 m -80.11 -28.75 38.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.25 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.92 -20.08 61.82 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.579 0.704 . . . . 0.0 109.948 -179.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.45 -36.61 84.72 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.876 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.3 pt -108.71 1.08 9.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -179.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.84 43.46 2.64 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 120.324 -0.941 . . . . 0.0 114.306 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -148.83 174.64 12.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 117.468 0.634 . . . . 0.0 110.923 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.426 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 11.7 ptm180 -119.01 142.18 48.04 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.766 0.317 . . . . 0.0 110.992 -179.682 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.51 125.77 24.92 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.167 -179.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.462 ' HB2' ' SG ' ' A' ' 74' ' ' CYS . 8.6 ptm180 -153.63 127.87 9.12 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.125 179.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 6.4 m -95.02 105.11 17.0 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.846 -178.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.438 ' HA ' ' HB2' ' A' ' 74' ' ' CYS . 3.9 m -105.58 136.24 45.52 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.12 0.486 . . . . 0.0 111.934 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.711 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -85.29 148.4 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.922 179.911 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.418 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.7 mt -49.5 137.7 16.59 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.126 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 37.2 Cg_exo -60.79 137.12 70.74 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 122.458 2.105 . . . . 0.0 112.464 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.447 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 51.1 mm -129.56 106.1 13.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.565 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -47.63 120.69 3.47 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.379 -179.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 116.21 -11.93 16.91 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.718 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.447 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.3 pt20 -138.6 169.51 17.67 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.492 0.663 . . . . 0.0 111.335 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -84.4 165.34 18.27 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.968 179.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.9 tt -83.66 122.97 38.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.206 0.527 . . . . 0.0 110.938 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.576 ' O ' HG13 ' A' ' 64' ' ' VAL . 4.1 mm? -92.53 115.33 28.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.571 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.462 ' SG ' ' HB2' ' A' ' 61' ' ' ARG . 51.7 t -161.03 137.63 8.59 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.572 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -160.34 167.39 27.54 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.199 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 84.1 m -87.79 137.11 31.95 Favored Pre-proline 0 CA--C 1.531 0.229 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.83 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -84.21 141.24 9.1 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 122.496 2.131 . . . . 0.0 112.902 -179.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.98 1.03 1.06 Allowed 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.05 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.02 37.92 64.07 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.32 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 37.1 mt . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.145 -179.951 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.463 0.219 0 CA-C-O 120.719 0.295 . . . . 0.0 111.738 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.6 p -95.34 115.5 27.52 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 178.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.46 -154.81 22.05 Favored Glycine 0 N--CA 1.436 -1.334 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.772 -177.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.439 HD11 ' O ' ' A' ' 17' ' ' LEU . 1.6 tm? -66.32 -40.8 90.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.169 -0.515 . . . . 0.0 110.896 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.743 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -76.04 -37.84 57.86 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.495 0.664 . . . . 0.0 111.117 -179.055 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.87 -8.23 0.02 OUTLIER Glycine 0 CA--C 1.525 0.665 0 CA-C-N 114.733 -1.121 . . . . 0.0 114.8 177.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.493 HG23 ' HG2' ' A' ' 22' ' ' GLN . 23.3 m -108.72 142.98 38.44 Favored 'General case' 0 N--CA 1.457 -0.087 0 CA-C-N 118.016 0.908 . . . . 0.0 112.194 -178.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.422 ' O ' ' HG3' ' A' ' 39' ' ' PRO . . . -107.9 101.72 10.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.038 179.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.493 ' HG2' HG23 ' A' ' 20' ' ' THR . 27.8 mm-40 -126.33 -179.28 4.67 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 121.137 0.494 . . . . 0.0 111.505 -179.12 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.57 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 77.4 m -133.86 117.44 16.82 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.84 179.347 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.08 -179.04 5.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.843 0.354 . . . . 0.0 111.083 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.475 ' HB1' ' HB2' ' A' ' 34' ' ' LEU . . . -111.32 165.66 11.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.815 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.1 t -129.77 157.08 43.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.8 -179.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.07 -170.18 2.9 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.092 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.494 HG22 ' HG ' ' A' ' 29' ' ' LEU . 7.4 m -61.76 -45.97 97.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.672 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.494 ' HG ' HG22 ' A' ' 28' ' ' VAL . 30.3 mt -77.5 -20.08 54.87 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.59 -13.22 32.82 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.561 -0.828 . . . . 0.0 113.424 179.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 22.5 t -101.16 107.83 22.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 117.255 0.527 . . . . 0.0 110.957 179.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 174.46 154.36 0.13 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.177 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -123.55 59.54 1.11 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.76 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.475 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 3.3 mt -81.46 135.64 35.63 Favored 'General case' 0 C--O 1.227 -0.108 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.849 -178.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.0 t70 51.0 83.23 0.05 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.78 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.6 m -109.28 132.09 54.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.379 179.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.07 -177.1 6.31 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.892 0.377 . . . . 0.0 111.647 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -77.7 138.14 62.54 Favored Pre-proline 0 CA--C 1.532 0.27 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.357 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.57 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 62.6 Cg_endo -90.72 110.75 0.37 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.021 2.481 . . . . 0.0 112.993 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -91.5 113.69 0.37 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.002 1.802 . . . . 0.0 112.032 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.14 -178.38 1.19 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.985 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.2 m -110.53 88.68 2.83 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.3 mt -63.52 122.08 15.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.274 -178.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.415 ' HB2' ' ND1' ' A' ' 48' ' ' HIS . . . -120.36 -33.4 3.88 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.753 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.414 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.1 p30 -162.88 -178.05 5.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.073 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.62 -61.51 2.15 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.102 -179.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 34.2 m -60.81 -35.93 77.75 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.956 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.415 ' ND1' ' HB2' ' A' ' 44' ' ' ALA . 1.7 t60 -62.19 -32.93 73.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.016 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -71.08 -39.97 71.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.142 179.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -61.39 -35.63 78.05 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.219 0.533 . . . . 0.0 109.735 178.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.2 m -67.71 -24.0 65.34 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.195 179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 51.6 m -65.03 -45.66 84.54 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.439 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.552 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 38.3 m -81.73 -26.17 34.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.14 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.27 -20.2 59.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.452 0.644 . . . . 0.0 110.151 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.59 -36.88 85.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.062 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.5 pt -107.48 14.2 8.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -179.064 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.34 41.9 8.22 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.421 -0.895 . . . . 0.0 113.546 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -143.71 -178.81 6.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 117.034 0.417 . . . . 0.0 111.074 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.419 ' HD3' HH21 ' A' ' 61' ' ' ARG . 99.2 mtt180 -122.99 151.59 41.7 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.406 -179.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.552 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -66.91 120.05 12.94 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.326 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HB3' ' SG ' ' A' ' 74' ' ' CYS . 13.9 mmt180 -138.9 125.74 20.96 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.964 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 22.4 m -100.03 99.94 10.74 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 4.0 m -104.07 141.11 36.79 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -177.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.743 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.4 OUTLIER -97.77 144.11 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.181 179.255 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.46 ' N ' HG21 ' A' ' 64' ' ' VAL . 8.1 mt -53.25 135.08 50.92 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.753 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -66.82 141.06 57.79 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.545 2.163 . . . . 0.0 112.74 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.443 ' O ' ' C ' ' A' ' 68' ' ' LEU . 1.8 mp -112.68 102.99 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.443 ' C ' ' O ' ' A' ' 67' ' ' ILE . 0.3 OUTLIER -30.32 108.67 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.928 0.394 . . . . 0.0 111.206 -179.675 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 121.78 -8.89 9.93 Favored Glycine 0 C--N 1.333 0.395 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.374 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -135.67 170.21 16.33 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.516 0.674 . . . . 0.0 111.339 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -85.9 169.9 12.85 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.33 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.3 tt -83.28 126.66 40.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.076 0.465 . . . . 0.0 111.024 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.554 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.9 mm? -98.43 119.78 37.72 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.113 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.421 ' SG ' ' HB3' ' A' ' 61' ' ' ARG . 41.8 t -161.56 137.81 8.11 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.47 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -160.81 170.74 20.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.82 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.9 m -89.88 137.25 28.4 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.826 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -86.8 142.77 6.84 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.693 2.262 . . . . 0.0 112.787 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 66.65 -1.32 1.34 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.92 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.18 36.52 63.85 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.452 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.1 mt . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.229 179.969 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.216 0 CA-C-O 120.887 0.375 . . . . 0.0 110.927 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.4 p -103.87 116.04 31.55 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 173.13 -154.89 21.59 Favored Glycine 0 N--CA 1.434 -1.443 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.743 -177.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.43 HD11 ' O ' ' A' ' 17' ' ' LEU . 1.5 tm? -65.56 -40.63 93.02 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.31 -0.445 . . . . 0.0 110.96 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 1.638 ' HE1' ' CE2' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -77.43 -39.04 48.29 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.233 0.539 . . . . 0.0 111.645 -178.347 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.4 -12.91 0.01 OUTLIER Glycine 0 CA--C 1.528 0.87 0 N-CA-C 115.919 1.128 . . . . 0.0 115.919 176.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.443 ' H ' ' C ' ' A' ' 18' ' ' TYR . 25.6 m -110.73 129.11 55.92 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 118.78 1.29 . . . . 0.0 112.683 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.38 115.99 28.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.431 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.476 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 18.9 mm-40 -135.53 -178.24 5.03 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.03 0.443 . . . . 0.0 111.366 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.522 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 98.1 m -138.02 100.42 4.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.837 179.192 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 4.5 t -118.89 177.88 4.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.903 -179.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.489 ' HB2' ' HB2' ' A' ' 34' ' ' LEU . . . -104.08 166.94 10.09 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.8 -179.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.2 t -129.19 157.8 40.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.674 -179.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -77.64 -170.02 1.68 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.051 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.485 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.8 m -65.19 -44.67 95.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.516 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.485 ' HG ' HG22 ' A' ' 28' ' ' VAL . 31.3 mt -76.6 -19.36 57.93 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.88 -16.86 30.46 Favored Glycine 0 CA--C 1.521 0.465 0 C-N-CA 120.541 -0.838 . . . . 0.0 113.79 179.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 66.2 t -101.48 107.68 21.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 117.464 0.632 . . . . 0.0 111.074 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 175.74 168.42 0.38 Allowed 'General case' 0 C--O 1.231 0.113 0 CA-C-O 121.091 0.472 . . . . 0.0 111.389 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -135.24 65.41 1.56 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.58 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.489 ' HB2' ' HB2' ' A' ' 25' ' ' ALA . 2.6 mt -87.57 132.23 34.13 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.119 -178.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.9 t70 51.17 84.75 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.562 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 86.8 m -108.12 129.72 55.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.121 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -148.17 -178.98 6.6 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.861 0.362 . . . . 0.0 111.433 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -73.79 137.94 76.76 Favored Pre-proline 0 CA--C 1.531 0.246 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.75 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.522 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 63.8 Cg_endo -90.88 109.73 0.34 Allowed 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 123.044 2.496 . . . . 0.0 112.609 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -91.01 113.73 0.4 Allowed 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 121.948 1.765 . . . . 0.0 112.387 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.27 177.27 1.9 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.887 178.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.1 m -106.99 88.11 2.66 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 177.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mt -61.8 122.71 16.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.252 -178.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.411 ' HB2' ' ND1' ' A' ' 48' ' ' HIS . . . -120.59 -31.72 4.22 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 116.232 -0.44 . . . . 0.0 112.074 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.4 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.0 p30 -166.24 -179.53 5.12 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.708 0.289 . . . . 0.0 111.337 -179.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.98 -59.17 4.14 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.026 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.6 m -60.26 -36.64 78.27 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.792 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.411 ' ND1' ' HB2' ' A' ' 44' ' ' ALA . 1.8 t60 -62.49 -33.81 75.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.861 179.295 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -69.05 -34.48 75.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.184 179.232 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -70.29 -24.06 62.97 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.626 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 29.5 t -85.43 -12.76 51.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.315 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 60.4 m -72.15 -44.17 63.52 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.756 0.312 . . . . 0.0 111.284 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.503 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 48.2 m -84.67 -25.48 28.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.069 -179.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.45 -20.06 57.42 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.471 0.653 . . . . 0.0 110.176 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.2 -36.53 82.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.946 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.5 pt -105.36 -4.5 9.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 112.951 0.722 . . . . 0.0 112.951 -178.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 103.98 39.59 2.46 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 120.272 -0.966 . . . . 0.0 114.133 178.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -143.94 -178.89 6.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 117.265 0.533 . . . . 0.0 111.069 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -114.95 149.77 36.79 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.327 -179.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.503 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -76.22 121.15 22.49 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.831 -179.24 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.454 HH21 ' HB2' ' A' ' 74' ' ' CYS . 11.9 ptm180 -146.08 125.62 13.26 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.692 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.638 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 10.6 t -88.95 118.16 28.47 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.539 -179.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.584 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 40.6 m -109.76 148.1 32.04 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -178.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.742 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -99.91 149.21 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 115.041 -0.982 . . . . 0.0 111.061 -179.556 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.1 mt -49.37 136.84 16.42 Favored Pre-proline 0 CA--C 1.531 0.228 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.422 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -63.18 133.36 40.42 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.562 2.175 . . . . 0.0 112.642 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.3 mm -129.38 106.8 14.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.664 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.45 ' O ' HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -50.86 110.83 0.46 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 121.563 0.696 . . . . 0.0 111.529 -179.763 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.27 -15.58 5.79 Favored Glycine 0 C--N 1.335 0.51 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.548 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -132.37 168.3 18.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.441 0.639 . . . . 0.0 111.176 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -84.27 167.1 16.93 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.258 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.414 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.0 tt -83.14 125.03 40.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.001 0.429 . . . . 0.0 110.919 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.553 ' HB2' HG12 ' A' ' 64' ' ' VAL . 3.9 mm? -96.28 110.73 22.99 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.164 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.454 ' HB2' HH21 ' A' ' 61' ' ' ARG . 57.4 m -145.93 135.98 23.65 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.226 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.542 ' HG2' ' HH ' ' A' ' 18' ' ' TYR . 2.2 pt20 -159.83 166.67 29.85 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.699 0.285 . . . . 0.0 110.851 179.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.2 m -91.89 135.99 26.75 Favored Pre-proline 0 CA--C 1.531 0.246 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.986 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -88.12 143.47 5.75 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.795 2.33 . . . . 0.0 112.817 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 64.94 4.05 2.32 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.853 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.35 33.69 68.51 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.351 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 47.4 mt . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.183 -0.913 . . . . 0.0 111.078 179.981 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.449 ' SG ' ' N ' ' A' ' 15' ' ' SER . 3.4 p . . . . . 0 CA--C 1.517 -0.302 0 CA-C-O 121.2 0.524 . . . . 0.0 111.101 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.583 ' O ' ' O ' ' A' ' 16' ' ' GLY . 4.2 m -113.3 -157.85 0.63 Allowed 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -178.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.583 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -19.49 -149.69 0.0 OUTLIER Glycine 0 CA--C 1.531 1.079 0 N-CA-C 119.086 2.394 . . . . 0.0 119.086 -179.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.43 ' O ' HD12 ' A' ' 17' ' ' LEU . 0.9 OUTLIER -22.79 -41.09 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 115.757 1.762 . . . . 0.0 115.757 -177.252 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 1.617 ' HD1' ' CD2' ' A' ' 18' ' ' TYR . 2.8 m-85 -68.59 -36.67 79.03 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 118.679 0.672 . . . . 0.0 111.485 -177.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.3 -20.33 0.01 OUTLIER Glycine 0 CA--C 1.533 1.204 0 N-CA-C 117.981 1.952 . . . . 0.0 117.981 175.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.481 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 76.9 m -130.04 120.58 24.93 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 120.064 1.932 . . . . 0.0 113.539 -177.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.13 120.58 15.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.291 -179.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.427 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 20.4 mm-40 -138.46 -175.39 4.11 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.89 0.376 . . . . 0.0 110.781 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.8 t -145.91 134.04 21.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.608 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.7 m -148.38 162.26 39.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.015 0.436 . . . . 0.0 111.392 -179.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -96.32 170.35 9.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.297 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.1 t -130.59 157.94 41.34 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.709 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -82.09 -169.96 2.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.212 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.506 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.6 m -63.02 -43.5 99.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.623 -179.472 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.506 ' HG ' HG22 ' A' ' 28' ' ' VAL . 29.4 mt -78.37 -19.92 52.37 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.77 -14.54 31.99 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.395 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.6 t -101.71 107.94 22.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 117.239 0.52 . . . . 0.0 111.127 179.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 176.4 145.38 0.09 Allowed 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.283 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -116.62 60.96 0.73 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.758 179.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.8 mt -84.91 153.23 22.99 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.577 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.1 t70 41.37 79.74 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.785 178.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 54.4 m -109.31 131.45 55.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.71 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -162.45 -174.8 4.18 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.931 0.395 . . . . 0.0 111.369 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.492 ' H ' HD21 ' A' ' 38' ' ' ASN . 0.1 OUTLIER -78.99 133.05 62.0 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.883 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 22' ' ' GLN . 92.5 Cg_endo -85.27 117.88 1.89 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.665 2.244 . . . . 0.0 111.78 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -91.1 114.34 0.41 Allowed 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 122.229 1.953 . . . . 0.0 113.036 -179.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.62 178.02 1.65 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.915 178.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 31.7 m -106.86 88.42 2.74 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mt -63.95 124.3 21.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.59 -178.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.1 -40.52 2.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.855 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -151.91 -167.34 2.75 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.997 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.16 -45.29 77.46 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.364 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 42.4 m -67.83 -40.98 83.69 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.497 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -61.15 -32.7 72.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.549 179.115 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -68.82 -37.32 79.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.167 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -67.1 -27.45 67.36 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.526 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.6 t -82.37 -13.85 56.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.936 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 42.8 m -69.91 -40.07 75.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.91 0.386 . . . . 0.0 111.176 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 12.2 m -88.58 -29.31 20.11 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.293 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.31 -19.95 62.26 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.706 0.765 . . . . 0.0 109.579 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.12 -38.02 89.34 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.884 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.7 pt -103.13 -1.35 9.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -179.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.4 44.1 3.3 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 120.331 -0.938 . . . . 0.0 113.519 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -146.03 -172.98 4.04 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 117.227 0.514 . . . . 0.0 111.089 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 19.3 ptt180 -119.37 141.89 48.65 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 -178.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -72.05 123.24 22.4 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.213 -179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.446 HH21 ' HB2' ' A' ' 74' ' ' CYS . 14.2 ptm180 -158.55 126.15 5.06 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.337 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.672 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 18.7 t -85.43 145.36 27.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.404 -179.268 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 21.6 m -125.5 147.38 49.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.327 0.584 . . . . 0.0 111.723 -179.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.62 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -101.52 147.4 8.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.251 179.79 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 7.9 mt -49.32 133.12 17.41 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.29 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 23.9 Cg_exo -63.65 139.05 67.56 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.622 2.214 . . . . 0.0 112.521 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 46.0 mm -131.6 110.42 17.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.394 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.81 109.49 0.29 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.878 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.84 -13.74 5.8 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.588 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -133.39 167.65 20.03 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.473 0.654 . . . . 0.0 111.31 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -83.53 168.56 16.32 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.77 -1.104 . . . . 0.0 110.181 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.437 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.8 tt -83.32 125.56 40.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.867 0.365 . . . . 0.0 110.615 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.51 ' HB2' HG12 ' A' ' 64' ' ' VAL . 3.9 mm? -98.28 105.85 18.05 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.83 0.348 . . . . 0.0 111.328 -179.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.446 ' HB2' HH21 ' A' ' 61' ' ' ARG . 48.5 m -146.89 133.63 20.0 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.099 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -161.03 166.76 27.66 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-O 120.823 0.344 . . . . 0.0 110.825 179.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.2 m -80.34 137.38 52.33 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.803 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -89.86 142.69 4.03 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.797 2.331 . . . . 0.0 112.757 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.23 4.47 1.64 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.613 179.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.46 36.7 58.99 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.537 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.6 mt . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.875 179.94 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.412 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 51.3 t . . . . . 0 N--CA 1.473 0.687 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.1 p -96.22 115.81 28.01 Favored 'General case' 0 C--O 1.232 0.147 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 170.94 -166.56 39.74 Favored Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 120.582 -0.818 . . . . 0.0 113.26 -177.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.457 ' O ' HD12 ' A' ' 17' ' ' LEU . 1.8 tm? -60.06 -37.51 80.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.823 -0.688 . . . . 0.0 110.27 177.554 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.734 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -79.43 -36.07 39.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.565 -178.653 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 59.02 -11.7 0.02 OUTLIER Glycine 0 CA--C 1.525 0.698 0 N-CA-C 115.507 0.963 . . . . 0.0 115.507 177.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.437 ' H ' ' C ' ' A' ' 18' ' ' TYR . 28.0 m -119.15 120.59 37.56 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 118.602 1.201 . . . . 0.0 112.38 -178.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.412 ' HB1' ' HB2' ' A' ' 14' ' ' CYS . . . -86.77 107.2 18.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.313 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -126.14 -169.45 2.02 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.092 0.472 . . . . 0.0 111.724 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 4.4 t -143.67 138.04 28.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.747 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.8 t -157.15 173.47 16.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.932 0.396 . . . . 0.0 111.215 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.98 166.23 11.54 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.691 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.6 t -125.67 156.99 38.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.681 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -84.76 -169.81 2.82 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.194 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.51 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.6 m -61.42 -44.81 99.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.557 -179.545 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.51 ' HG ' HG22 ' A' ' 28' ' ' VAL . 27.0 mt -79.74 -20.27 46.77 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.037 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.35 -15.42 32.72 Favored Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.596 -0.812 . . . . 0.0 113.485 179.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 31.0 t -101.77 108.1 22.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 117.241 0.52 . . . . 0.0 111.124 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 179.52 168.0 1.11 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.044 0.45 . . . . 0.0 111.451 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -132.84 64.21 1.62 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.609 179.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -91.51 131.33 37.03 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.526 -178.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 52.14 83.23 0.06 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.956 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 56.4 m -108.08 131.9 54.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.338 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -153.65 -178.03 6.76 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.879 0.371 . . . . 0.0 111.29 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -77.96 140.51 62.38 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.633 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -90.72 111.17 0.38 Allowed 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.953 2.436 . . . . 0.0 111.909 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -90.71 113.78 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 121.903 1.736 . . . . 0.0 112.866 -179.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.99 -178.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.651 178.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.8 m -107.01 88.28 2.7 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.4 mt -62.51 122.85 16.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.482 -178.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.405 ' HB2' ' ND1' ' A' ' 48' ' ' HIS . . . -120.77 -33.62 3.75 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.764 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -163.48 -179.16 6.3 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.134 -179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.08 -60.03 3.33 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.289 -0.414 . . . . 0.0 112.025 -179.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 23.2 m -60.11 -37.78 81.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.756 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . 0.405 ' ND1' ' HB2' ' A' ' 44' ' ' ALA . 1.6 t60 -61.27 -33.11 73.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.904 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -68.78 -33.6 74.14 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.042 179.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -69.29 -41.58 76.6 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.025 178.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.1 m -64.36 -17.47 63.75 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.237 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 50.8 m -71.37 -42.1 68.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.443 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 23.0 m -84.59 -30.43 25.01 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.657 -179.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.83 -19.71 63.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.635 0.731 . . . . 0.0 109.631 -179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -68.56 -39.72 80.92 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.286 -179.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 23.4 pt -100.57 1.41 10.51 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.24 39.56 5.67 Favored Glycine 0 CA--C 1.522 0.516 0 C-N-CA 120.294 -0.955 . . . . 0.0 113.443 179.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -145.96 -174.13 4.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.814 0.307 . . . . 0.0 110.807 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 23.9 mtm180 -119.73 156.45 30.53 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.89 0.376 . . . . 0.0 111.184 -179.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -85.49 122.87 30.25 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.645 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -144.14 129.67 19.04 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.947 0.404 . . . . 0.0 110.546 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.676 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.9 t -98.5 109.67 22.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.732 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.521 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 91.9 m -101.07 145.75 28.34 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.308 0.575 . . . . 0.0 112.493 -178.419 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.734 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -95.25 148.42 5.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.495 179.704 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 10.5 mt -49.24 140.64 12.38 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.398 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.444 ' O ' HD11 ' A' ' 67' ' ' ILE . 34.1 Cg_exo -59.79 139.65 89.47 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.734 2.289 . . . . 0.0 112.327 -179.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.444 HD11 ' O ' ' A' ' 66' ' ' PRO . 30.2 mm -131.95 110.12 16.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.476 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.48 111.89 0.8 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.092 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 122.65 -2.96 10.17 Favored Glycine 0 C--N 1.335 0.485 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.089 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -149.7 165.42 32.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.269 0.557 . . . . 0.0 111.163 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -78.87 169.85 17.59 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.577 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.408 ' O ' HG21 ' A' ' 72' ' ' ILE . 17.2 tt -82.85 121.69 36.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.152 0.501 . . . . 0.0 110.613 179.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.528 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.7 mm? -90.49 124.64 35.16 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.466 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -160.27 135.84 8.22 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.217 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -159.51 162.37 35.48 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.741 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 53.1 m -82.82 136.31 44.74 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.862 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -85.74 140.88 7.26 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.577 2.184 . . . . 0.0 112.653 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.12 3.69 1.36 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.664 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.94 38.04 60.31 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.485 179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 35.6 mt . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.232 -0.889 . . . . 0.0 111.049 179.992 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.1 p . . . . . 0 N--CA 1.466 0.33 0 CA-C-O 121.119 0.485 . . . . 0.0 112.241 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.0 p -95.32 117.96 31.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.27 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.25 -166.79 39.65 Favored Glycine 0 N--CA 1.441 -1.031 0 C-N-CA 120.551 -0.833 . . . . 0.0 113.161 -177.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.462 ' O ' HD12 ' A' ' 17' ' ' LEU . 1.7 tm? -56.86 -37.21 70.99 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.764 -0.718 . . . . 0.0 110.591 177.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.709 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -80.91 -38.9 27.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.404 0.621 . . . . 0.0 111.375 -178.551 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.72 -8.18 0.01 OUTLIER Glycine 0 CA--C 1.527 0.805 0 CA-C-N 114.671 -1.149 . . . . 0.0 115.739 176.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.417 ' H ' ' C ' ' A' ' 18' ' ' TYR . 18.1 m -115.69 126.12 53.7 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 118.658 1.229 . . . . 0.0 112.996 -178.024 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -87.43 104.89 16.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.087 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -128.25 -169.41 2.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.126 0.488 . . . . 0.0 111.69 -178.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.9 t -139.68 140.73 36.94 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.974 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -161.86 155.86 21.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.085 0.469 . . . . 0.0 111.285 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.492 ' HB1' ' HB2' ' A' ' 34' ' ' LEU . . . -79.5 166.46 21.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.594 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.0 t -134.74 158.21 44.72 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 0.431 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 1.6 p-10 -77.33 -168.89 1.23 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.007 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.52 HG22 ' HG ' ' A' ' 29' ' ' LEU . 11.0 m -65.24 -44.67 95.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.632 -179.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.52 ' HG ' HG22 ' A' ' 28' ' ' VAL . 29.1 mt -78.16 -19.29 54.28 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -178.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.77 -15.44 31.62 Favored Glycine 0 CA--C 1.521 0.416 0 C-N-CA 120.541 -0.838 . . . . 0.0 113.697 179.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.5 t -101.68 108.14 23.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 117.302 0.551 . . . . 0.0 111.181 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.431 ' HB3' ' HB3' ' A' ' 27' ' ' ASP . . . 179.51 171.33 1.0 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.124 0.488 . . . . 0.0 111.322 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -139.41 93.45 2.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.769 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.492 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 1.7 mt -125.08 134.67 52.41 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.548 -178.623 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.3 t70 52.94 86.24 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.198 179.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 m -108.46 133.93 51.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.964 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -156.32 -178.09 7.07 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.937 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -83.31 138.21 42.06 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.541 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -90.1 114.56 0.54 Allowed 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.814 2.343 . . . . 0.0 111.928 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -90.44 114.0 0.48 Allowed 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 121.982 1.788 . . . . 0.0 112.783 -179.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.482 ' HB2' ' HG1' ' A' ' 52' ' ' THR . . . -175.48 -179.28 1.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.532 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.6 m -108.2 88.12 2.66 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 177.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -61.41 123.18 17.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.284 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.64 -40.61 2.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.906 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -152.92 -168.36 3.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.045 179.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.473 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . . . -64.94 -44.05 90.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.257 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 41.3 m -70.4 -41.94 72.31 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.798 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -60.49 -33.85 73.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.118 0.485 . . . . 0.0 109.856 179.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -69.27 -35.76 76.41 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.975 179.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -67.02 -32.12 73.13 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.216 179.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.5 t -76.2 -12.89 60.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.776 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.482 ' HG1' ' HB2' ' A' ' 41' ' ' ALA . 52.4 m -73.81 -40.93 63.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.075 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 7.4 m -86.16 -31.95 21.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.51 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.8 -19.93 63.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.659 0.742 . . . . 0.0 109.825 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.03 -39.22 93.04 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.925 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.4 pt -103.34 0.79 10.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -179.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.18 43.13 3.09 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.318 -0.944 . . . . 0.0 113.58 178.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -150.63 -175.03 4.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 117.097 0.448 . . . . 0.0 110.995 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -120.66 153.99 36.12 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.976 0.417 . . . . 0.0 111.122 -179.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.59 126.2 30.56 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.241 -179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -149.64 155.41 40.2 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.044 0.45 . . . . 0.0 110.925 179.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.617 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 33.6 t -121.44 104.76 9.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.18 -179.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . 0.525 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 5.0 m -109.95 145.0 37.65 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.197 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.709 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.3 OUTLIER -90.81 146.02 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.742 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.426 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.5 mt -49.95 138.65 18.38 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.451 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 27.3 Cg_exo -62.65 138.53 70.29 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.589 2.193 . . . . 0.0 112.556 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.403 HD11 ' O ' ' A' ' 66' ' ' PRO . 50.3 mm -130.82 108.4 15.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.658 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.65 109.98 0.33 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.266 -179.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.14 -12.46 6.42 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.643 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -136.95 168.9 18.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.416 0.627 . . . . 0.0 111.25 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -82.22 166.82 19.26 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.113 179.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.403 HG21 ' O ' ' A' ' 72' ' ' ILE . 18.6 tt -83.44 124.49 39.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 121.065 0.459 . . . . 0.0 110.995 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.579 ' O ' HG13 ' A' ' 64' ' ' VAL . 4.0 mm? -98.94 113.7 25.98 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.705 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 43.6 t -161.55 138.67 8.65 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.623 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . 0.401 HE21 ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -159.93 163.3 34.34 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.95 179.793 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.3 m -90.2 126.62 56.29 Favored Pre-proline 0 CA--C 1.531 0.218 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.182 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -53.57 108.89 0.3 Allowed 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.679 2.252 . . . . 0.0 113.178 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.82 34.06 18.39 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.55 179.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 62.49 20.95 61.92 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.924 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.473 ' HG ' ' HB2' ' A' ' 46' ' ' ALA . 0.6 OUTLIER . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.775 -0.631 . . . . 0.0 111.063 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.517 -0.299 0 CA-C-O 121.318 0.58 . . . . 0.0 111.946 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.585 ' O ' ' O ' ' A' ' 16' ' ' GLY . 14.0 m -133.36 -157.57 0.82 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.711 -179.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . 0.585 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -19.42 -149.78 0.0 OUTLIER Glycine 0 CA--C 1.532 1.096 0 N-CA-C 119.084 2.394 . . . . 0.0 119.084 -179.368 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.474 HD11 ' O ' ' A' ' 17' ' ' LEU . 1.2 tm? -23.21 -43.13 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -177.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 1.632 ' HE2' ' CE1' ' A' ' 18' ' ' TYR . 3.7 m-85 -68.55 -35.92 78.08 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.207 -0.597 . . . . 0.0 112.208 -176.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.31 -10.98 0.01 OUTLIER Glycine 0 CA--C 1.527 0.816 0 N-CA-C 115.554 0.982 . . . . 0.0 115.554 176.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.457 ' H ' ' C ' ' A' ' 18' ' ' TYR . 32.5 m -125.13 145.9 49.73 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 118.591 1.196 . . . . 0.0 112.162 -178.163 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -111.73 109.15 18.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.794 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.576 HE21 ' HA ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -129.07 -172.03 2.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.153 0.501 . . . . 0.0 111.673 -178.787 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.1 t -135.93 105.59 6.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.79 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.477 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 2.3 m -126.76 151.8 47.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.964 0.411 . . . . 0.0 111.712 -178.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -89.32 166.37 13.8 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.046 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.9 t -121.76 157.21 31.51 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -179.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -86.18 -170.26 3.01 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.418 -179.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.522 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.4 m -61.1 -45.12 99.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.407 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.522 ' HG ' HG22 ' A' ' 28' ' ' VAL . 24.0 mt -79.9 -20.72 45.14 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.606 0.241 . . . . 0.0 111.446 -179.094 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.63 -18.07 32.65 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 120.674 -0.774 . . . . 0.0 113.7 179.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.439 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 39.5 t -101.96 107.72 22.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 117.497 0.649 . . . . 0.0 111.058 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 31' ' ' VAL . . . 174.81 171.16 0.25 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.029 0.442 . . . . 0.0 111.401 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -133.15 85.71 2.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.585 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 mt -109.03 137.01 47.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.043 -178.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.6 t70 41.63 81.23 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.075 178.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.477 ' HB2' ' HB3' ' A' ' 24' ' ' CYS . 49.1 t -128.03 139.76 52.36 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.342 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -155.71 -173.19 4.43 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.243 -179.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -64.93 133.1 95.66 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.85 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . 0.411 ' HD3' HE21 ' A' ' 22' ' ' GLN . 90.7 Cg_endo -90.46 110.04 0.38 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.89 2.393 . . . . 0.0 111.922 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -90.75 115.13 0.47 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.24 1.96 . . . . 0.0 112.887 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.05 -179.14 1.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.784 178.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 34.9 m -105.87 88.52 2.83 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 177.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.15 123.18 19.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.449 -178.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.9 -40.64 2.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.826 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -151.49 -168.23 3.03 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.037 179.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.64 -49.8 71.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.415 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.8 m -65.17 -40.81 94.8 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.806 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -60.65 -32.34 71.51 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.814 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -69.37 -37.95 77.83 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.938 178.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.0 -41.19 97.57 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.954 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.4 m -64.44 -20.06 65.93 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.416 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 51.8 m -69.52 -39.18 77.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.534 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 2.5 m -87.72 -32.6 19.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.816 -179.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.21 -19.37 63.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.674 0.749 . . . . 0.0 109.686 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.5 -39.11 88.51 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.399 -1.273 . . . . 0.0 112.446 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.9 pt -105.85 3.03 10.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.71 42.7 3.06 Favored Glycine 0 CA--C 1.523 0.563 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.784 178.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -151.32 -174.56 4.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 117.041 0.421 . . . . 0.0 110.717 179.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.2 mtp180 -125.47 153.79 43.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.798 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.66 118.83 11.46 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.005 -179.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -130.48 123.79 30.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.855 0.359 . . . . 0.0 110.52 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . 0.659 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 3.4 t -96.31 107.68 20.07 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 57.8 m -105.78 151.03 24.98 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.538 0.685 . . . . 0.0 112.635 -178.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.694 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -105.3 150.33 8.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.483 179.569 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.402 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 1.2 tp -50.35 122.76 15.83 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.137 -179.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 24.3 Cg_exo -65.31 139.53 60.28 Favored 'Trans proline' 0 C--N 1.355 0.921 0 C-N-CA 122.481 2.121 . . . . 0.0 112.516 -179.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.423 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 48.2 mm -131.38 112.63 21.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.486 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -46.93 108.91 0.16 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.792 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.94 -14.56 5.71 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.525 -179.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 3.2 pt20 -129.07 166.55 19.03 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.534 0.683 . . . . 0.0 111.265 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -82.49 162.21 22.13 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.225 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.418 ' O ' HG21 ' A' ' 72' ' ' ILE . 17.0 tt -83.35 121.02 35.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.138 0.494 . . . . 0.0 111.004 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.511 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.9 mm? -95.13 107.92 20.01 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.959 -179.581 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.408 ' SG ' HG12 ' A' ' 72' ' ' ILE . 69.7 m -144.79 130.35 18.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.11 -179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -160.37 161.91 33.24 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.879 0.371 . . . . 0.0 110.86 179.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.424 HG21 ' HD2' ' A' ' 77' ' ' PRO . 86.5 m -85.97 135.24 37.72 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.163 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' PRO . . . . . 0.424 ' HD2' HG21 ' A' ' 76' ' ' THR . 93.7 Cg_endo -86.04 142.42 7.59 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.736 2.29 . . . . 0.0 112.644 -179.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 65.17 1.54 1.58 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.842 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.14 36.57 64.0 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.405 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.7 mt . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.253 -0.879 . . . . 0.0 111.012 179.801 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.533 0.206 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.12 123.78 14.21 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.681 2.254 . . . . 0.0 112.407 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.579 ' HB3' ' HG2' ' A' ' 6' ' ' GLU . . . -88.63 82.11 6.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.857 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . 0.515 ' HA ' ' CZ ' ' A' ' 7' ' ' ARG . . . -118.83 -10.95 9.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.376 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.2 ttm -112.97 -24.17 9.66 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.673 0.749 . . . . 0.0 109.413 -179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.768 ' HG3' ' HG3' ' A' ' 7' ' ' ARG . 0.3 OUTLIER -55.11 -26.93 41.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.223 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.768 ' HG3' ' HG3' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -105.48 82.34 1.8 Allowed 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 122.1 0.952 . . . . 0.0 110.49 -179.437 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -55.63 150.28 12.64 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 113.547 -1.66 . . . . 0.0 110.768 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.526 HG23 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -93.55 154.0 41.23 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.96 -179.922 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.526 ' HD2' HG23 ' A' ' 9' ' ' VAL . 82.2 Cg_exo -43.95 129.26 7.59 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.944 2.43 . . . . 0.0 112.727 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 1.667 ' HE2' ' CE1' ' A' ' 11' ' ' TYR . 9.6 t80 -56.21 151.07 13.14 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.975 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.4 m -111.79 97.3 36.99 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.338 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.426 ' O ' ' C ' ' A' ' 14' ' ' CYS . 60.1 Cg_exo -53.29 177.02 0.07 OUTLIER 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.743 2.296 . . . . 0.0 112.963 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.426 ' C ' ' O ' ' A' ' 13' ' ' PRO . 0.5 OUTLIER -27.27 109.47 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.859 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 80.0 p -95.08 115.83 27.93 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.07 -154.63 22.02 Favored Glycine 0 N--CA 1.436 -1.314 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.733 -177.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.447 HD11 ' O ' ' A' ' 17' ' ' LEU . 1.5 tm? -65.58 -40.49 92.78 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.327 -0.436 . . . . 0.0 110.783 177.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 1.625 ' HE1' ' CE2' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -76.54 -36.96 57.38 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.442 0.639 . . . . 0.0 111.595 -178.804 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.64 -8.92 0.02 OUTLIER Glycine 0 CA--C 1.525 0.671 0 CA-C-N 114.763 -1.108 . . . . 0.0 114.794 177.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.459 ' H ' ' C ' ' A' ' 18' ' ' TYR . 7.6 m -112.61 154.59 25.79 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 118.174 0.987 . . . . 0.0 111.929 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.88 107.57 12.86 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.256 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.501 ' HA ' ' HG3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -137.71 -169.86 2.63 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -179.195 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.489 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 60.1 m -134.28 119.84 19.22 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.501 -179.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.455 ' HB3' ' HD3' ' A' ' 61' ' ' ARG . 1.1 t -128.43 -179.8 5.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.958 0.408 . . . . 0.0 110.927 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.454 ' HB1' ' HB2' ' A' ' 34' ' ' LEU . . . -115.2 164.71 13.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.873 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.7 t -130.46 157.68 41.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.512 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.469 ' HB3' ' HB1' ' A' ' 32' ' ' ALA . 0.8 OUTLIER -80.56 -170.67 2.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.545 -179.194 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.46 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.7 m -62.63 -47.0 95.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.721 -179.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.46 ' HG ' HG22 ' A' ' 28' ' ' VAL . 32.5 mt -76.2 -19.68 58.18 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.39 -13.39 33.31 Favored Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.702 -0.761 . . . . 0.0 113.451 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.558 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 7.6 p -100.36 108.18 22.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 117.156 0.478 . . . . 0.0 111.103 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.558 ' HB1' ' O ' ' A' ' 31' ' ' VAL . . . 172.58 161.27 0.12 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.637 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -131.24 63.07 1.61 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.632 179.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.454 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 3.8 mt -82.59 135.54 35.04 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.83 -178.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.1 t70 50.37 81.62 0.06 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.679 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -109.34 129.56 55.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.461 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -166.25 172.64 10.93 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.102 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -66.52 145.2 98.93 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.444 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.501 ' HG3' ' HA ' ' A' ' 22' ' ' GLN . 57.1 Cg_endo -91.19 121.37 0.69 Allowed 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.864 2.376 . . . . 0.0 112.657 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -90.7 112.11 0.4 Allowed 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 121.684 1.589 . . . . 0.0 112.025 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.405 ' HB1' HG21 ' A' ' 52' ' ' THR . . . -176.63 -175.83 0.67 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.748 179.349 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 36.5 m -109.05 88.27 2.69 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -64.35 123.98 20.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.555 -178.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.6 -33.35 3.84 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.955 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -163.86 -179.5 6.35 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.099 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.59 -58.46 6.27 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -179.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.4 m -60.3 -35.79 76.39 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.804 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -62.43 -34.5 76.9 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.981 179.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -70.15 -35.96 74.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.394 179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -67.01 -31.23 71.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.063 0.458 . . . . 0.0 110.138 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.8 t -76.59 -17.74 59.03 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.389 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.405 HG21 ' HB1' ' A' ' 41' ' ' ALA . 60.0 m -73.35 -42.5 62.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.988 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.4 m -80.79 -26.77 36.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.223 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.22 -20.1 55.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.437 0.637 . . . . 0.0 110.302 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.88 -36.08 80.23 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.923 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.4 pt -108.96 11.42 8.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 84.3 41.6 7.87 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.489 -0.862 . . . . 0.0 113.393 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -140.95 177.93 7.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.855 0.327 . . . . 0.0 110.878 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -117.2 162.95 17.04 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.878 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -85.98 118.42 25.45 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.746 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.569 HH21 ' HB3' ' A' ' 74' ' ' CYS . 12.9 ptm180 -147.55 125.74 12.2 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.164 0.507 . . . . 0.0 110.211 179.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.441 ' HB2' ' CD2' ' A' ' 18' ' ' TYR . 5.5 m -85.88 106.22 16.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.261 -178.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.4 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 65.2 m -98.0 142.61 29.51 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.229 0.538 . . . . 0.0 111.904 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.724 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -93.83 144.3 9.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.444 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.443 ' N ' HG21 ' A' ' 64' ' ' VAL . 10.5 mt -49.43 137.14 16.59 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.535 -178.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 37.9 Cg_exo -61.42 138.13 74.38 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.71 2.273 . . . . 0.0 112.617 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 51.3 mm -130.3 108.17 15.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.375 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.65 109.36 0.31 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.12 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.68 -13.68 5.84 Favored Glycine 0 C--N 1.333 0.38 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.773 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -135.16 168.48 19.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.451 0.643 . . . . 0.0 111.161 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -81.29 169.3 17.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.294 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 20.2 tt -84.09 132.27 31.94 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-O 120.813 0.34 . . . . 0.0 110.876 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.542 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.5 mm? -109.82 132.15 54.41 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.789 0.328 . . . . 0.0 110.622 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.569 ' HB3' HH21 ' A' ' 61' ' ' ARG . 0.5 OUTLIER -160.14 135.39 8.05 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.339 179.406 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -153.11 163.13 40.43 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.63 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.489 HG21 ' HD2' ' A' ' 77' ' ' PRO . 54.4 m -96.38 139.47 21.72 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.654 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.489 ' HD2' HG21 ' A' ' 76' ' ' THR . 64.1 Cg_endo -75.49 125.22 8.86 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.28 1.987 . . . . 0.0 113.144 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 57.19 23.83 9.09 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.801 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 63.62 33.76 88.12 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.559 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.6 tp . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.282 -179.552 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 77.9 p . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.583 0.23 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -56.45 108.4 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.682 2.255 . . . . 0.0 112.45 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.516 ' HB2' ' HB2' ' A' ' 6' ' ' GLU . . . -106.58 108.87 20.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.783 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -97.56 -50.6 4.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.587 -179.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 22.8 mmt -106.36 -1.76 22.96 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.399 -179.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.516 ' HB2' ' HB2' ' A' ' 3' ' ' ALA . 32.2 mt-10 -82.89 -71.29 0.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.737 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.96 120.24 10.88 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 120.99 0.424 . . . . 0.0 110.866 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -88.57 134.62 33.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.994 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.535 HG23 ' HD2' ' A' ' 10' ' ' PRO . 0.7 OUTLIER -92.87 154.42 41.97 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.951 -179.933 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.535 ' HD2' HG23 ' A' ' 9' ' ' VAL . 80.3 Cg_exo -46.38 128.67 12.62 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 123.01 2.473 . . . . 0.0 112.866 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 1.651 ' HD1' ' CD2' ' A' ' 11' ' ' TYR . 32.9 t80 -54.22 153.96 4.8 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.386 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 26.4 m -120.78 91.75 47.61 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.84 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.81 176.57 0.07 OUTLIER 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.744 2.296 . . . . 0.0 112.916 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -41.04 121.55 1.57 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.675 -179.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 75.3 p -98.29 117.13 31.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.532 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 173.77 -155.22 21.56 Favored Glycine 0 N--CA 1.434 -1.47 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.744 -178.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.452 HD11 ' O ' ' A' ' 17' ' ' LEU . 1.4 tm? -66.75 -38.64 87.02 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.216 -0.492 . . . . 0.0 110.966 178.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.713 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -79.07 -39.24 34.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.833 -178.252 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.79 -11.5 0.01 OUTLIER Glycine 0 CA--C 1.528 0.855 0 CA-C-N 114.97 -1.014 . . . . 0.0 115.285 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.487 ' H ' ' C ' ' A' ' 18' ' ' TYR . 6.6 m -105.94 131.14 53.61 Favored 'General case' 0 N--CA 1.46 0.074 0 CA-C-N 118.383 1.091 . . . . 0.0 112.372 -178.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -100.98 99.53 10.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.544 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.1 mm-40 -126.31 -174.57 3.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.88 0.371 . . . . 0.0 111.003 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.554 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 58.3 m -135.51 107.76 7.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.298 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.14 151.56 51.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.886 0.374 . . . . 0.0 111.143 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.41 169.65 16.72 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.593 -178.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.4 t -126.35 158.13 36.67 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.635 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -76.87 -169.86 1.43 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.451 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.472 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.6 m -65.74 -46.04 90.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.699 -179.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.472 ' HG ' HG22 ' A' ' 28' ' ' VAL . 30.6 mt -75.46 -19.8 59.22 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -178.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.82 -18.33 29.29 Favored Glycine 0 CA--C 1.521 0.464 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.765 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 46.8 t -101.51 107.81 22.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 117.603 0.702 . . . . 0.0 111.033 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 175.94 172.74 0.35 Allowed 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.049 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -141.38 84.23 1.9 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.91 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.7 mt -104.38 134.95 46.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.682 -178.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 51.53 84.14 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.006 178.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.5 t -122.76 137.77 54.82 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.826 0.346 . . . . 0.0 111.005 179.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -159.76 -178.4 7.04 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -65.85 124.62 88.07 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.825 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.554 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 93.7 Cg_endo -85.84 122.17 2.23 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.506 2.137 . . . . 0.0 112.087 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -91.25 113.73 0.39 Allowed 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.113 1.875 . . . . 0.0 112.508 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.53 179.12 1.5 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 179.001 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 32.1 m -106.89 88.07 2.66 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.5 mt -63.36 121.2 13.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.411 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.403 ' HB2' ' ND1' ' A' ' 48' ' ' HIS . . . -120.62 -34.46 3.59 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.71 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -162.77 -179.18 6.64 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.238 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.88 -59.84 3.7 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.937 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.6 m -60.27 -36.33 77.57 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.745 -179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.403 ' ND1' ' HB2' ' A' ' 44' ' ' ALA . 1.7 t60 -62.78 -32.44 73.61 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.947 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 1.642 ' HD2' ' CD1' ' A' ' 49' ' ' PHE . 13.8 t80 -71.34 -38.65 71.64 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.103 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.08 -31.86 73.1 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 121.058 0.456 . . . . 0.0 110.149 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.3 t -75.51 -13.38 60.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.958 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 74.2 m -78.06 -44.04 27.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.077 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.5 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 36.2 m -82.95 -26.94 30.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.986 -179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.49 -20.18 58.92 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.501 0.667 . . . . 0.0 110.186 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.81 -37.24 86.95 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.744 -1.117 . . . . 0.0 112.077 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.0 pt -106.01 11.29 8.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.42 40.36 6.07 Favored Glycine 0 CA--C 1.522 0.492 0 C-N-CA 120.493 -0.861 . . . . 0.0 114.235 178.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -148.44 -178.1 6.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 117.263 0.531 . . . . 0.0 111.059 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -122.98 154.81 37.93 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.168 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.5 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -69.57 119.91 14.55 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.689 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -139.6 125.3 19.44 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.563 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.595 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 15.4 t -98.72 99.54 10.66 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.485 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 3.8 m -109.1 141.37 41.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.257 0.551 . . . . 0.0 112.33 -177.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.713 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.3 OUTLIER -87.48 144.12 9.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.457 179.873 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.4 mt -49.52 136.43 17.62 Favored Pre-proline 0 N--CA 1.462 0.165 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.359 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -61.1 133.92 49.81 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.497 2.132 . . . . 0.0 112.531 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.4 mm -128.17 106.14 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.6 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.18 110.98 0.38 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.18 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.49 -13.97 5.87 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.464 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -138.18 166.86 23.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.41 0.624 . . . . 0.0 111.144 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -80.46 164.63 22.89 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.288 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.5 tt -83.43 125.2 40.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.05 0.452 . . . . 0.0 110.952 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.572 ' O ' HG13 ' A' ' 64' ' ' VAL . 4.0 mm? -100.66 115.73 30.92 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.9 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 42.2 t -161.27 140.45 10.18 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.251 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.428 ' HG2' ' HH ' ' A' ' 18' ' ' TYR . 18.2 pt20 -160.7 168.24 25.26 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.384 -179.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 72.9 m -100.69 124.65 41.54 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.325 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.412 ' C ' ' H ' ' A' ' 79' ' ' GLY . 57.0 Cg_endo -69.45 141.2 45.85 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.403 2.069 . . . . 0.0 112.72 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.47 -0.85 0.64 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.246 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.412 ' H ' ' C ' ' A' ' 77' ' ' PRO . . . 70.9 36.84 65.39 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.397 179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 28.6 mt . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.191 -0.909 . . . . 0.0 111.193 179.849 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 55.6 m . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.625 0.25 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.26 116.24 3.1 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.706 2.271 . . . . 0.0 112.364 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.476 ' HB2' ' HB2' ' A' ' 6' ' ' GLU . . . -74.5 143.02 44.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.072 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -110.22 -37.1 5.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.53 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 7.7 ptp -107.26 -36.28 6.58 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.927 0.394 . . . . 0.0 110.865 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.476 ' HB2' ' HB2' ' A' ' 3' ' ' ALA . 22.9 mt-10 -56.92 -70.7 0.11 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.865 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.67 116.96 7.92 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.071 0.462 . . . . 0.0 110.886 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -74.95 147.5 40.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.57 179.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.488 HG23 ' HD2' ' A' ' 10' ' ' PRO . 0.9 OUTLIER -90.19 152.79 46.33 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.984 -179.778 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.488 ' HD2' HG23 ' A' ' 9' ' ' VAL . 81.3 Cg_exo -42.89 133.42 5.68 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 123.003 2.469 . . . . 0.0 112.714 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -55.23 154.39 5.93 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.963 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 89.1 m -135.64 90.5 19.71 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.322 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -75.34 166.31 29.05 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.678 2.252 . . . . 0.0 111.962 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.1 t 51.32 -171.12 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.148 0.499 . . . . 0.0 111.173 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.624 ' O ' ' O ' ' A' ' 16' ' ' GLY . 87.6 p -134.18 -156.99 0.77 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.392 -179.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.624 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -18.52 -147.71 0.0 OUTLIER Glycine 0 CA--C 1.532 1.146 0 N-CA-C 118.251 2.06 . . . . 0.0 118.251 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.439 HD11 ' O ' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -22.85 -42.07 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 115.402 1.63 . . . . 0.0 115.402 -177.675 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.547 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 5.7 m-85 -69.37 -36.46 76.84 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.275 -0.57 . . . . 0.0 112.264 -177.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.69 -14.43 0.01 OUTLIER Glycine 0 CA--C 1.531 1.034 0 N-CA-C 115.708 1.043 . . . . 0.0 115.708 177.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.474 ' H ' ' C ' ' A' ' 18' ' ' TYR . 23.3 m -129.54 153.92 47.55 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 118.576 1.188 . . . . 0.0 112.175 -178.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -115.31 114.97 25.88 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.976 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -132.63 -169.88 2.33 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.128 0.489 . . . . 0.0 111.646 -178.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.441 ' HB2' ' HB3' ' A' ' 39' ' ' PRO . 5.6 t -147.27 131.11 17.05 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.115 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.519 ' HB2' ' HD2' ' A' ' 61' ' ' ARG . 36.7 m -147.34 165.83 28.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.967 0.413 . . . . 0.0 111.498 -179.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.35 168.77 10.86 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.385 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.422 ' HB ' HH21 ' A' ' 59' ' ' ARG . 5.7 t -122.98 156.82 33.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.72 -179.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -85.0 -169.61 2.73 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.234 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.519 HG22 ' HG ' ' A' ' 29' ' ' LEU . 8.2 m -60.93 -46.29 96.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.571 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.519 ' HG ' HG22 ' A' ' 28' ' ' VAL . 24.8 mt -80.21 -20.4 44.77 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 111.636 0.235 . . . . 0.0 111.636 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.32 -16.38 32.2 Favored Glycine 0 CA--C 1.522 0.509 0 C-N-CA 120.716 -0.754 . . . . 0.0 113.52 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 61.0 t -101.4 108.38 23.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 117.192 0.496 . . . . 0.0 111.178 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.35 167.41 0.81 Allowed 'General case' 0 N--CA 1.461 0.119 0 CA-C-O 120.967 0.413 . . . . 0.0 111.336 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -130.36 76.29 1.71 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.834 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 mt -102.95 143.21 32.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.976 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 30.3 t70 45.52 83.48 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.946 178.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 52.0 m -109.66 130.28 55.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.211 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -156.99 -176.18 5.84 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.053 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -79.33 133.32 60.46 Favored Pre-proline 0 CA--C 1.533 0.304 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.685 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.441 ' HB3' ' HB2' ' A' ' 23' ' ' CYS . 93.5 Cg_endo -89.07 119.97 1.03 Allowed 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.72 2.28 . . . . 0.0 111.931 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -91.27 114.34 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.32 2.013 . . . . 0.0 113.105 -179.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.58 179.98 1.34 Allowed 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.939 178.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.6 m -106.72 88.47 2.76 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.2 mt -62.47 121.56 13.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.277 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.428 ' HB2' ' ND1' ' A' ' 48' ' ' HIS . . . -120.55 -34.44 3.61 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.553 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.0 p30 -162.89 -177.91 5.79 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.103 -179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.88 -61.25 2.33 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.245 -0.434 . . . . 0.0 112.011 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.7 m -59.55 -36.42 76.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.846 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.428 ' ND1' ' HB2' ' A' ' 44' ' ' ALA . 1.2 t60 -63.03 -33.33 75.19 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -67.73 -34.85 77.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.741 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -67.78 -42.3 81.87 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.055 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 57.0 m -63.26 -18.07 63.18 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.297 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 48.5 m -70.85 -40.68 72.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.486 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 32.6 m -86.66 -31.47 21.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.791 -179.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.53 -19.71 63.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.657 0.741 . . . . 0.0 109.542 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.49 -39.86 88.97 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.417 -1.265 . . . . 0.0 112.117 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 16.1 pt -101.41 1.25 10.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.43 40.66 5.34 Favored Glycine 0 CA--C 1.522 0.511 0 C-N-CA 120.282 -0.961 . . . . 0.0 113.289 179.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -143.41 -172.12 3.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.782 0.291 . . . . 0.0 110.826 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.422 HH21 ' HB ' ' A' ' 26' ' ' THR . 50.6 mtm180 -119.96 152.15 37.87 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.743 0.306 . . . . 0.0 111.119 -179.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -82.72 122.76 28.58 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.763 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.519 ' HD2' ' HB2' ' A' ' 24' ' ' CYS . 4.2 ptm180 -140.19 140.26 35.86 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-O 120.627 0.251 . . . . 0.0 110.564 -179.538 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -106.39 119.57 39.6 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 55.5 m -110.21 149.21 30.45 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 121.424 0.63 . . . . 0.0 112.254 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.547 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -101.39 149.3 6.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.543 179.725 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.2 mt -49.6 137.46 17.41 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.364 -179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -60.63 134.97 57.51 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.604 2.203 . . . . 0.0 112.801 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.442 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.8 mm -130.57 106.19 12.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.51 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.2 119.79 4.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.982 0.42 . . . . 0.0 111.278 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 118.94 -8.13 12.76 Favored Glycine 0 CA--C 1.518 0.229 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.826 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.9 pt20 -139.24 168.5 19.69 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.477 0.656 . . . . 0.0 111.218 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -82.99 168.9 16.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.311 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.417 HG12 ' SG ' ' A' ' 74' ' ' CYS . 16.3 tt -83.4 124.81 39.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-O 120.922 0.391 . . . . 0.0 110.932 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.497 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.1 mm? -96.61 109.01 21.7 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.031 -179.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.417 ' SG ' HG12 ' A' ' 72' ' ' ILE . 64.2 m -144.76 131.96 20.57 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.122 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -160.27 167.51 27.38 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.766 0.317 . . . . 0.0 110.941 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 49.4 m -82.86 137.47 43.73 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.87 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -83.67 136.22 7.23 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.378 2.052 . . . . 0.0 112.684 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 64.34 3.48 1.85 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.811 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.63 40.02 54.56 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.436 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.2 mt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.285 -0.864 . . . . 0.0 111.061 179.971 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.484 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 60.5 m . . . . . 0 N--CA 1.486 1.37 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.484 ' HD2' ' N ' ' A' ' 1' ' ' SER . 17.2 Cg_endo -58.2 119.77 7.24 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 121.964 1.776 . . . . 0.0 112.386 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -129.71 91.7 3.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.945 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -94.62 -20.77 19.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.166 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 11.2 ptm -110.54 -35.42 6.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.14 0.495 . . . . 0.0 110.345 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -75.12 -164.87 0.34 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.842 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.643 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -49.82 119.75 3.77 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.002 0.43 . . . . 0.0 111.222 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.418 ' HA ' ' OE1' ' A' ' 8' ' ' GLN . 4.7 tp60 -57.2 150.14 18.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.877 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.495 HG23 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -101.76 154.5 37.26 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.267 -179.796 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.495 ' HD2' HG23 ' A' ' 9' ' ' VAL . 72.0 Cg_exo -46.57 130.02 14.46 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.902 2.401 . . . . 0.0 112.648 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 1.652 ' HE1' ' CE2' ' A' ' 11' ' ' TYR . 14.6 t80 -63.83 157.79 23.65 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.231 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 94.1 m -136.62 92.71 14.74 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.674 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -73.1 166.96 28.6 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.602 2.202 . . . . 0.0 112.248 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.1 t 47.92 -162.58 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.408 0.623 . . . . 0.0 111.664 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.596 ' O ' ' O ' ' A' ' 16' ' ' GLY . 10.6 m -129.11 -156.08 0.74 Allowed 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.136 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.596 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -17.2 -147.7 0.0 OUTLIER Glycine 0 CA--C 1.533 1.182 0 N-CA-C 118.655 2.222 . . . . 0.0 118.655 -179.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.415 HD11 ' O ' ' A' ' 17' ' ' LEU . 0.7 OUTLIER -22.15 -45.96 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -176.846 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 1.636 ' HD1' ' CD2' ' A' ' 18' ' ' TYR . 6.4 m-85 -69.26 -37.23 77.81 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.927 -0.709 . . . . 0.0 112.031 -177.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.92 -12.26 0.01 OUTLIER Glycine 0 CA--C 1.529 0.952 0 N-CA-C 116.545 1.378 . . . . 0.0 116.545 176.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.473 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 52.6 m -138.16 138.11 38.29 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.139 1.469 . . . . 0.0 112.839 -177.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -106.18 125.87 51.52 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.407 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.526 ' HA ' ' HG3' ' A' ' 39' ' ' PRO . 67.1 mm-40 -147.56 176.31 10.16 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.78 0.324 . . . . 0.0 111.525 -178.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.42 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 75.7 m -122.82 116.41 23.64 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.999 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.636 ' HB2' ' HD2' ' A' ' 61' ' ' ARG . 60.2 m -132.44 159.95 37.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.016 0.436 . . . . 0.0 111.431 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.428 ' HB1' ' HB2' ' A' ' 34' ' ' LEU . . . -83.47 167.57 17.32 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.893 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.4 t -123.78 156.67 35.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.597 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -87.73 -170.59 3.07 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.339 -179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.495 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.5 m -60.61 -44.88 97.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.428 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.495 ' HG ' HG22 ' A' ' 28' ' ' VAL . 24.0 mt -80.55 -20.47 43.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.701 0.286 . . . . 0.0 111.279 -179.278 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.69 -18.97 31.54 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 120.827 -0.701 . . . . 0.0 113.792 178.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.4 t -101.81 108.49 23.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 117.286 0.543 . . . . 0.0 111.255 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -179.68 168.34 1.37 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.048 0.451 . . . . 0.0 111.377 179.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -128.97 82.79 2.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.756 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.428 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 2.0 mt -110.48 137.35 48.3 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.017 -178.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 48.02 84.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.874 178.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 51.4 m -109.6 129.94 55.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.631 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -151.55 163.86 38.1 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.413 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -57.92 133.12 83.42 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.473 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.526 ' HG3' ' HA ' ' A' ' 22' ' ' GLN . 97.5 Cg_endo -90.67 113.45 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.87 2.38 . . . . 0.0 112.302 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -90.5 113.3 0.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 121.919 1.746 . . . . 0.0 112.495 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.404 ' HB1' HG21 ' A' ' 52' ' ' THR . . . -175.79 -178.42 1.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.632 178.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.6 m -110.17 88.37 2.74 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 177.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.8 mt -64.79 119.77 11.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.432 -178.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -116.55 -40.69 3.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.761 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -152.82 -168.69 3.11 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.723 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.78 -39.37 94.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.993 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 46.6 m -71.04 -47.98 55.47 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.863 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -57.22 -31.22 65.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.081 0.467 . . . . 0.0 109.753 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 1.668 ' HE1' ' CE2' ' A' ' 49' ' ' PHE . 28.6 t80 -70.48 -39.56 74.15 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.077 179.016 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -62.99 -38.58 91.72 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 121.244 0.545 . . . . 0.0 109.912 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 56.9 m -68.29 -16.06 63.81 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.291 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.404 HG21 ' HB1' ' A' ' 41' ' ' ALA . 94.2 m -75.74 -43.31 47.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.549 -179.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.45 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 68.5 m -85.88 -23.46 27.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.346 -179.372 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.83 -20.0 43.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.259 0.552 . . . . 0.0 110.467 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.22 -39.93 93.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.158 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.1 pt -100.4 9.39 8.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.54 42.95 5.65 Favored Glycine 0 CA--C 1.522 0.477 0 C-N-CA 120.415 -0.898 . . . . 0.0 114.108 178.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -146.21 -177.42 5.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.362 0.581 . . . . 0.0 111.081 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 49.1 mtm180 -116.99 151.56 36.48 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.991 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.45 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -80.99 122.24 27.05 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.665 -179.374 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.636 ' HD2' ' HB2' ' A' ' 24' ' ' CYS . 9.5 ptp180 -145.72 125.58 13.52 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.948 0.404 . . . . 0.0 110.135 179.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.557 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.0 t -92.41 107.36 19.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.785 -179.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 93.0 m -98.21 150.88 21.03 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 121.281 0.563 . . . . 0.0 111.842 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.604 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -98.27 150.14 4.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.876 179.833 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.4 mt -49.32 138.07 15.18 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.371 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_exo -62.13 132.98 41.53 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 122.537 2.158 . . . . 0.0 112.581 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.48 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 49.8 mm -131.74 104.71 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.739 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.71 121.08 5.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.266 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 118.51 -11.19 12.57 Favored Glycine 0 CA--C 1.517 0.182 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.77 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 3.0 pt20 -135.33 167.41 21.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.484 0.659 . . . . 0.0 111.347 -179.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -81.65 167.64 18.98 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.493 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.4 tt -83.79 124.5 39.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.045 0.45 . . . . 0.0 110.927 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.53 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.5 mm? -101.2 128.47 47.3 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.293 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -160.72 132.57 5.88 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.28 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -151.61 166.11 32.22 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.847 0.356 . . . . 0.0 110.685 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.42 HG21 ' HD2' ' A' ' 77' ' ' PRO . 54.0 m -95.28 138.04 22.0 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.498 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.42 ' HD2' HG21 ' A' ' 76' ' ' THR . 85.3 Cg_endo -81.73 137.61 10.15 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.23 1.953 . . . . 0.0 112.756 -179.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.04 2.53 1.05 Allowed 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.928 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.47 38.64 61.99 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.285 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 28.6 mt . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.201 -0.904 . . . . 0.0 111.187 -179.919 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.8 t . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.539 0.209 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -42.68 129.91 5.27 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.932 2.422 . . . . 0.0 112.714 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -111.36 82.6 1.63 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.921 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -106.29 -53.87 2.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.41 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 26.1 ttp -112.9 -8.59 13.69 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 122.091 0.948 . . . . 0.0 108.766 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.607 ' N ' ' CD ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -67.84 -156.81 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.908 -178.871 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.615 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.2 OUTLIER -46.41 121.63 3.54 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.106 0.479 . . . . 0.0 111.022 179.846 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -55.97 148.24 17.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.843 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.517 HG23 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -94.65 153.75 40.14 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.97 -179.645 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.517 ' HD2' HG23 ' A' ' 9' ' ' VAL . 86.4 Cg_exo -44.18 125.0 5.33 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.937 2.425 . . . . 0.0 112.906 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.401 ' HH ' HD13 ' A' ' 43' ' ' LEU . 6.1 t80 -57.01 136.93 56.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.91 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 84.9 m -160.06 97.45 1.5 Allowed Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.184 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.458 ' O ' ' C ' ' A' ' 14' ' ' CYS . 41.5 Cg_endo -80.59 163.91 21.25 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.805 2.337 . . . . 0.0 112.521 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.458 ' C ' ' O ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER 13.63 108.65 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.07 0 O-C-N 124.41 1.068 . . . . 0.0 112.507 -179.874 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.1 m -94.42 116.7 29.1 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.2 -167.25 40.19 Favored Glycine 0 N--CA 1.439 -1.115 0 C-N-CA 120.565 -0.826 . . . . 0.0 113.244 -177.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.481 ' O ' HD12 ' A' ' 17' ' ' LEU . 1.9 tm? -57.91 -37.08 73.38 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.571 -0.815 . . . . 0.0 110.656 178.079 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 1.662 ' HE1' ' CE2' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -82.93 -37.14 24.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.249 -177.978 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.28 -13.15 0.02 OUTLIER Glycine 0 CA--C 1.528 0.902 0 N-CA-C 115.558 0.983 . . . . 0.0 115.558 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.466 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 20.7 m -107.29 124.36 49.67 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 118.589 1.194 . . . . 0.0 112.202 -178.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -89.35 105.22 17.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.026 -179.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -130.12 -179.18 5.08 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.082 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.558 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 83.6 m -129.85 117.44 20.2 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.03 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -135.48 160.38 38.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.084 0.468 . . . . 0.0 111.415 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.539 ' HB2' ' HB2' ' A' ' 34' ' ' LEU . . . -85.22 167.0 16.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.732 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.8 t -131.88 157.49 43.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.765 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -80.14 -170.37 2.46 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.059 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.532 HG22 ' HG ' ' A' ' 29' ' ' LEU . 7.9 m -63.58 -44.39 98.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.516 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.532 ' HG ' HG22 ' A' ' 28' ' ' VAL . 25.4 mt -79.53 -20.11 47.95 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -178.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.43 -17.56 31.0 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 120.636 -0.792 . . . . 0.0 113.873 179.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 40.1 t -101.4 108.07 22.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 117.493 0.647 . . . . 0.0 111.028 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 177.14 172.0 0.51 Allowed 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.248 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -135.82 96.78 3.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.834 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.539 ' HB2' ' HB2' ' A' ' 25' ' ' ALA . 2.1 mt -124.78 134.6 52.73 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.644 -178.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.7 t70 51.55 83.93 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.515 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.5 m -109.12 129.98 55.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.481 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -153.76 177.4 11.03 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.809 0.338 . . . . 0.0 111.357 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -74.98 137.47 72.87 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.45 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.558 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 65.4 Cg_endo -89.64 112.34 0.52 Allowed 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.83 2.354 . . . . 0.0 112.402 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -90.48 113.53 0.46 Allowed 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 121.897 1.731 . . . . 0.0 112.218 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.52 -177.7 1.03 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.812 179.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 34.7 m -108.0 88.04 2.64 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 177.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.401 HD13 ' HH ' ' A' ' 11' ' ' TYR . 12.5 mt -64.88 126.71 28.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.653 -178.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.37 -40.34 2.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.864 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -150.27 -167.72 2.9 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.008 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.33 -41.69 76.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.24 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 42.3 m -69.74 -40.17 76.34 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.707 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -60.15 -33.68 72.51 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -67.65 -39.07 84.61 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.61 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -60.24 -38.77 84.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.297 0.57 . . . . 0.0 109.489 178.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 66.3 m -69.83 -22.39 63.29 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.167 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 70.9 m -67.99 -44.51 76.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.45 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.553 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 57.8 m -79.49 -26.25 41.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.296 -179.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.63 -20.37 56.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.454 0.645 . . . . 0.0 110.084 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.64 -37.71 88.52 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 114.881 -1.054 . . . . 0.0 112.097 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.2 pt -102.76 2.44 10.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.92 41.62 3.76 Favored Glycine 0 CA--C 1.523 0.532 0 C-N-CA 120.288 -0.958 . . . . 0.0 113.903 178.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -148.52 -178.31 6.26 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 117.219 0.509 . . . . 0.0 111.08 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -119.03 152.68 35.99 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.115 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.553 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -65.43 117.25 7.67 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.523 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 14.1 mtp180 -134.16 113.25 11.84 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.005 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.626 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 13.9 t -90.85 107.48 19.21 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.524 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 55.5 m -103.41 148.94 25.29 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -178.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.741 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -103.67 145.71 12.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.656 -179.784 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.8 mt -50.14 138.54 19.6 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.352 -179.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.4 ' O ' HD11 ' A' ' 67' ' ' ILE . 32.2 Cg_exo -62.04 138.06 70.7 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.622 2.215 . . . . 0.0 112.483 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.443 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.4 mm -131.37 107.69 13.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.628 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -48.96 120.0 3.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.002 0.43 . . . . 0.0 111.273 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 117.88 -12.42 13.24 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.852 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.7 pt20 -134.93 167.35 21.07 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.606 0.717 . . . . 0.0 111.547 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -82.12 170.2 15.76 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.638 -1.164 . . . . 0.0 110.348 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.0 tt -82.81 127.56 39.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.941 0.401 . . . . 0.0 110.735 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.521 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.8 mm? -101.87 112.7 25.41 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 120.894 0.378 . . . . 0.0 111.259 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 77.8 m -147.22 129.08 15.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.859 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.38 169.86 22.22 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.788 0.327 . . . . 0.0 110.749 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 57.6 m -92.07 136.75 25.59 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.718 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -84.94 141.28 8.32 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.518 2.145 . . . . 0.0 113.077 -179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.75 3.02 1.06 Allowed 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.883 179.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.62 38.4 67.93 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.357 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 38.6 mt . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.112 179.921 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.6 0.238 . . . . 0.0 110.915 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -57.17 101.57 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.703 2.268 . . . . 0.0 112.288 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.23 90.32 2.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.048 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -104.27 -27.83 11.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.194 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 23.7 mmt -107.63 -13.55 15.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.924 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -86.03 -159.41 0.46 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.539 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.661 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -48.23 116.94 1.72 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.144 0.497 . . . . 0.0 111.02 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -95.02 150.95 19.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.075 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.473 HG23 ' HD2' ' A' ' 10' ' ' PRO . 0.9 OUTLIER -101.58 154.26 37.37 Favored Pre-proline 0 CA--C 1.533 0.32 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.014 179.966 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.473 ' HD2' HG23 ' A' ' 9' ' ' VAL . 87.9 Cg_exo -44.61 130.37 9.46 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.891 2.394 . . . . 0.0 112.732 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 1.659 ' HE2' ' CE1' ' A' ' 11' ' ' TYR . 22.2 t80 -55.06 155.26 4.75 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.073 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 65.4 m -130.65 91.97 36.0 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.0 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.502 ' HB2' ' HB3' ' A' ' 21' ' ' ALA . 93.9 Cg_endo -70.48 177.35 6.17 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.772 2.315 . . . . 0.0 112.152 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.496 ' C ' ' O ' ' A' ' 13' ' ' PRO . 25.6 p -15.81 112.95 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.869 0.731 . . . . 0.0 112.318 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.3 m -95.22 117.67 30.66 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.29 -166.38 39.16 Favored Glycine 0 N--CA 1.44 -1.066 0 C-N-CA 120.549 -0.834 . . . . 0.0 113.326 -177.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.461 ' O ' HD12 ' A' ' 17' ' ' LEU . 1.8 tm? -56.23 -37.39 69.65 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.523 -0.839 . . . . 0.0 110.714 178.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 1.667 ' HE1' ' CE2' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -82.65 -39.2 22.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.894 -178.204 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.76 -9.47 0.01 OUTLIER Glycine 0 CA--C 1.528 0.864 0 CA-C-N 115.072 -0.967 . . . . 0.0 115.469 176.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.464 ' H ' ' C ' ' A' ' 18' ' ' TYR . 24.7 m -109.81 123.0 48.79 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 118.382 1.091 . . . . 0.0 112.491 -178.216 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.502 ' HB3' ' HB2' ' A' ' 13' ' ' PRO . . . -86.85 102.51 14.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.793 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -125.27 -170.01 2.09 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.819 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.5 t -144.08 121.14 11.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.792 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.09 159.82 41.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.932 0.396 . . . . 0.0 111.206 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -88.64 166.89 13.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.9 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.419 ' HB ' ' NH2' ' A' ' 59' ' ' ARG . 10.3 t -124.94 157.49 35.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.791 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -81.73 -169.78 2.51 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.184 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.511 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.4 m -63.43 -45.32 98.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.653 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.511 ' HG ' HG22 ' A' ' 28' ' ' VAL . 26.8 mt -77.79 -20.1 53.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.583 0.23 . . . . 0.0 111.474 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.87 -17.66 32.39 Favored Glycine 0 CA--C 1.522 0.53 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.567 179.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.407 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 43.9 t -101.99 107.99 22.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 117.301 0.55 . . . . 0.0 111.092 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' A' ' 31' ' ' VAL . . . 176.11 171.77 0.39 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.01 0.434 . . . . 0.0 111.326 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -136.16 86.45 2.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.53 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -110.59 136.4 49.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.873 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.4 t70 51.71 86.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.35 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -108.74 133.76 52.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.87 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -157.55 -178.51 7.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.927 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -82.89 138.75 43.08 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.965 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -88.89 113.1 0.64 Allowed 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.656 2.237 . . . . 0.0 111.991 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -90.59 114.15 0.46 Allowed 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 122.21 1.94 . . . . 0.0 112.639 -179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.4 -178.22 1.11 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.721 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.9 m -108.05 88.72 2.8 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 177.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mt -63.61 123.0 17.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.358 -178.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.35 -33.86 3.78 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.739 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.419 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.2 p30 -163.04 -178.97 6.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.979 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.15 -59.63 3.98 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.943 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 44.5 m -60.84 -37.42 82.02 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.834 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.419 ' HB3' ' H ' ' A' ' 45' ' ' ASN . 1.8 t60 -61.86 -31.29 71.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.054 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 1.657 ' HD2' ' CD1' ' A' ' 49' ' ' PHE . 17.8 t80 -72.07 -40.81 68.03 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.099 179.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -62.12 -27.19 68.76 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.051 0.453 . . . . 0.0 110.0 178.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 31.2 t -76.43 -23.77 53.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.47 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 66.5 m -67.31 -38.38 84.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.889 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 3.9 m -85.04 -30.87 23.77 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.317 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.56 -19.7 61.45 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.517 0.675 . . . . 0.0 109.795 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.97 -38.01 89.55 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 114.702 -1.136 . . . . 0.0 112.1 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pt -106.87 6.72 9.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 112.627 0.602 . . . . 0.0 112.627 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.36 44.47 5.28 Favored Glycine 0 CA--C 1.523 0.59 0 C-N-CA 120.385 -0.912 . . . . 0.0 113.864 178.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -147.56 -177.93 5.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 117.346 0.573 . . . . 0.0 111.082 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.419 ' NH2' ' HB ' ' A' ' 26' ' ' THR . 30.6 mtm180 -117.83 155.8 29.48 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.276 -179.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -71.41 118.72 14.58 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.848 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.0 mmt180 -138.17 114.89 10.62 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.039 0.447 . . . . 0.0 111.859 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.604 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 28.7 t -89.82 111.11 22.03 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.566 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 63.6 m -107.92 149.3 28.5 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.758 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -101.64 143.09 15.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 114.937 -1.029 . . . . 0.0 110.475 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.7 mt -50.38 137.04 23.03 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.351 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -61.24 137.39 70.47 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.485 2.123 . . . . 0.0 112.415 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.457 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 47.8 mm -131.94 109.94 16.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.421 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.463 ' N ' HD21 ' A' ' 68' ' ' LEU . 2.1 pt? -48.18 117.21 1.83 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.292 0.567 . . . . 0.0 110.883 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 120.12 -10.66 10.9 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.487 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.457 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.4 pt20 -138.83 168.44 19.81 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.527 0.679 . . . . 0.0 111.219 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -88.03 168.95 12.38 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.822 -1.081 . . . . 0.0 110.306 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.2 tt -83.22 125.25 40.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.919 0.39 . . . . 0.0 110.701 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.565 ' HB2' HG12 ' A' ' 64' ' ' VAL . 3.9 mm? -97.82 111.39 23.7 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.321 -179.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 77.0 m -139.39 129.34 24.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.708 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -155.84 164.75 38.13 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.807 0.337 . . . . 0.0 110.926 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.402 ' CG2' ' HB2' ' A' ' 80' ' ' LEU . 92.7 m -100.4 121.98 51.44 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.84 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.99 127.36 23.02 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.413 2.075 . . . . 0.0 111.849 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.26 -115.1 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.099 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -141.26 37.3 1.65 Allowed Glycine 0 N--CA 1.438 -1.188 0 C-N-CA 120.852 -0.69 . . . . 0.0 113.739 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.402 ' HB2' ' CG2' ' A' ' 76' ' ' THR . 20.3 mt . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.291 -0.862 . . . . 0.0 110.708 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.563 0.22 . . . . 0.0 110.976 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -57.83 97.05 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.619 2.213 . . . . 0.0 112.082 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -76.77 84.17 3.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.275 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -97.9 -41.21 8.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.706 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 14.4 ptm -104.42 -34.28 8.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.275 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -52.92 -75.59 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.872 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.01 113.12 7.16 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.076 0.465 . . . . 0.0 111.162 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -82.83 -30.33 28.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.789 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.545 HG23 ' HD2' ' A' ' 10' ' ' PRO . 0.7 OUTLIER -92.41 154.66 42.76 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.804 -179.947 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.545 ' HD2' HG23 ' A' ' 9' ' ' VAL . 86.7 Cg_exo -45.4 130.88 11.81 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.912 2.408 . . . . 0.0 112.61 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 30.2 t80 -51.45 142.98 12.69 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.212 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 86.1 m -139.14 94.54 9.76 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.159 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -74.74 166.77 28.58 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.635 2.223 . . . . 0.0 111.911 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.495 ' SG ' ' HA ' ' A' ' 21' ' ' ALA . 1.1 m 46.02 -160.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.967 0.413 . . . . 0.0 111.164 -179.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.593 ' O ' ' O ' ' A' ' 16' ' ' GLY . 95.5 p -119.47 -159.07 0.76 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.113 0.782 . . . . 0.0 113.113 -178.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.593 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -20.93 -149.8 0.0 OUTLIER Glycine 0 CA--C 1.529 0.95 0 N-CA-C 118.825 2.29 . . . . 0.0 118.825 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.513 ' O ' HD12 ' A' ' 17' ' ' LEU . 1.7 tm? -23.27 -38.18 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 115.417 1.636 . . . . 0.0 115.417 -178.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 1.62 ' HD1' ' CD2' ' A' ' 18' ' ' TYR . 1.7 m-85 -67.97 -36.6 80.33 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.121 -0.631 . . . . 0.0 112.078 -177.113 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.36 -17.73 0.01 OUTLIER Glycine 0 CA--C 1.53 0.988 0 N-CA-C 115.416 0.927 . . . . 0.0 115.416 177.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.509 ' H ' ' C ' ' A' ' 18' ' ' TYR . 41.3 m -116.79 151.5 36.34 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 118.388 1.094 . . . . 0.0 112.0 -178.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.495 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . . . -116.63 111.43 19.85 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.773 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -135.11 -179.61 5.73 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.53 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.543 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 61.8 m -131.33 108.29 9.55 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.028 179.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.474 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 3.3 m -116.61 157.77 24.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.125 -179.007 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.477 ' HB1' ' HB2' ' A' ' 34' ' ' LEU . . . -88.06 165.46 15.14 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.2 t -128.54 157.05 42.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.926 0.393 . . . . 0.0 111.973 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -86.53 -170.22 2.99 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.026 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.508 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.3 m -61.09 -45.13 99.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.357 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.508 ' HG ' HG22 ' A' ' 28' ' ' VAL . 30.2 mt -77.81 -20.35 53.39 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 -179.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.38 -14.36 33.07 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 120.541 -0.838 . . . . 0.0 113.643 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.5 t -101.95 108.14 23.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 117.249 0.524 . . . . 0.0 111.033 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.91 152.1 0.34 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.958 0.409 . . . . 0.0 111.539 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -120.76 60.89 0.89 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.261 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.477 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 2.6 mt -88.57 138.25 31.59 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.364 -0.834 . . . . 0.0 112.433 -178.199 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.6 t70 39.64 81.22 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.552 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.474 ' HB2' ' HB3' ' A' ' 24' ' ' CYS . 37.0 t -128.89 152.17 48.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.056 0.455 . . . . 0.0 111.055 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -170.17 -172.94 1.4 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.05 -179.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -65.12 136.31 96.59 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.557 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.543 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.7 Cg_endo -90.39 114.69 0.5 Allowed 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.882 2.388 . . . . 0.0 112.483 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -91.35 113.76 0.38 Allowed 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.097 1.865 . . . . 0.0 112.255 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.422 ' HB1' HG21 ' A' ' 52' ' ' THR . . . -175.65 -175.55 0.79 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.004 179.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.1 m -109.68 88.51 2.76 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.8 mt -64.95 123.5 19.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.115 -178.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.34 -31.36 4.38 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.419 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.7 p30 -164.68 -177.36 4.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.627 0.251 . . . . 0.0 111.137 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.435 ' HB2' HD23 ' A' ' 80' ' ' LEU . . . -52.72 -58.66 6.14 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.868 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 23.7 m -62.25 -37.1 84.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.894 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.419 ' HB3' ' H ' ' A' ' 45' ' ' ASN . 1.9 t60 -61.52 -33.1 73.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.859 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 1.663 ' HD2' ' CD1' ' A' ' 49' ' ' PHE . 22.0 t80 -70.82 -40.04 72.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.165 179.24 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -64.03 -32.19 73.65 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.09 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.4 m -71.76 -24.29 61.74 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.21 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.422 HG21 ' HB1' ' A' ' 41' ' ' ALA . 52.2 m -66.86 -43.43 83.58 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.391 -179.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.494 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 60.8 m -79.19 -26.78 42.6 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.477 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.62 -20.06 54.48 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.448 0.642 . . . . 0.0 110.372 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.09 -37.82 88.84 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.153 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.3 pt -104.5 4.97 10.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.18 42.08 4.12 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.381 -0.914 . . . . 0.0 113.953 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -148.81 -178.12 6.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 117.309 0.555 . . . . 0.0 111.278 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 77.0 mtp180 -118.46 162.5 18.24 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.056 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.494 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -76.27 119.35 20.04 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.129 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -138.36 110.18 7.17 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.947 0.403 . . . . 0.0 111.468 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 48.9 m -79.07 99.91 7.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.558 179.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 42.6 m -96.61 138.76 33.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.496 0.665 . . . . 0.0 111.874 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.721 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -96.88 146.92 6.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.497 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.421 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.7 mt -49.42 136.31 16.99 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.382 -179.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 33.2 Cg_exo -60.34 136.8 70.43 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.543 2.162 . . . . 0.0 112.929 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.469 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.9 mm -129.07 104.79 11.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.271 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.25 120.1 2.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.005 0.431 . . . . 0.0 111.235 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 117.01 -10.25 15.4 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.622 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.5 pt20 -137.85 168.36 19.86 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.585 0.707 . . . . 0.0 111.41 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -84.58 170.0 13.84 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.277 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.43 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.5 tt -82.99 126.32 40.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.965 0.412 . . . . 0.0 110.729 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.526 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.0 mm? -97.46 110.81 23.29 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.177 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.43 ' SG ' HG12 ' A' ' 72' ' ' ILE . 50.0 m -146.02 130.82 18.06 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.123 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -160.61 165.67 30.29 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.784 0.325 . . . . 0.0 110.754 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 50.4 m -81.01 136.55 50.38 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.961 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -87.37 137.6 4.35 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.619 2.212 . . . . 0.0 112.887 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.29 2.71 0.89 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.904 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.05 41.84 53.28 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.375 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.435 HD23 ' HB2' ' A' ' 46' ' ' ALA . 36.2 mt . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.24 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 65.9 p . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.545 0.212 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -57.3 132.91 53.91 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.667 2.244 . . . . 0.0 112.296 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.576 ' HB2' ' HB2' ' A' ' 6' ' ' GLU . . . -107.88 95.11 5.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.845 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -100.23 -27.87 13.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.434 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -110.03 -31.86 7.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.232 0.539 . . . . 0.0 110.585 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.576 ' HB2' ' HB2' ' A' ' 3' ' ' ALA . 27.6 mt-10 -51.12 -49.26 61.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.259 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -133.65 58.95 1.75 Allowed 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 122.301 1.048 . . . . 0.0 110.731 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -53.17 141.36 23.51 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 113.514 -1.675 . . . . 0.0 110.979 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.526 HG23 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -94.96 153.77 39.83 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.915 -179.85 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.526 ' HD2' HG23 ' A' ' 9' ' ' VAL . 85.5 Cg_exo -44.42 122.16 3.66 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.922 2.415 . . . . 0.0 112.752 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -54.51 147.96 13.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.063 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 29.8 m -86.7 113.99 55.77 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.037 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.434 ' O ' ' O ' ' A' ' 14' ' ' CYS . 72.9 Cg_exo -52.61 -179.52 0.03 OUTLIER 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.967 2.444 . . . . 0.0 113.356 179.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.434 ' O ' ' O ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER -37.32 170.83 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 122.018 0.913 . . . . 0.0 112.86 -178.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.582 ' O ' ' O ' ' A' ' 16' ' ' GLY . 1.8 m -101.13 -154.02 0.47 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.738 -1.119 . . . . 0.0 112.914 -176.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.582 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -13.32 -145.34 0.0 OUTLIER Glycine 0 CA--C 1.529 0.941 0 N-CA-C 118.355 2.102 . . . . 0.0 118.355 -179.097 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -20.0 -47.62 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 -176.179 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 1.591 ' HD1' ' CD2' ' A' ' 18' ' ' TYR . 2.6 m-85 -69.85 -38.62 76.51 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.016 0.825 . . . . 0.0 111.369 -178.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 16' ' ' GLY . . . 56.23 -12.52 0.01 OUTLIER Glycine 0 CA--C 1.527 0.831 0 N-CA-C 116.092 1.197 . . . . 0.0 116.092 176.437 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.457 ' H ' ' C ' ' A' ' 18' ' ' TYR . 21.2 m -135.31 155.41 50.67 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.849 1.325 . . . . 0.0 112.852 -177.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -116.33 103.66 10.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.346 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -124.86 -169.51 2.0 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.872 0.368 . . . . 0.0 111.279 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.9 t -142.14 139.08 32.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.246 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -155.8 171.08 20.64 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.975 0.417 . . . . 0.0 111.181 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.36 168.59 10.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.802 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.1 t -133.9 157.79 45.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.79 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -81.91 -169.86 2.57 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.282 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.5 HG22 ' HG ' ' A' ' 29' ' ' LEU . 7.2 m -63.04 -45.08 99.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.737 -179.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.5 ' HG ' HG22 ' A' ' 28' ' ' VAL . 26.5 mt -78.38 -20.4 51.32 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.598 0.222 . . . . 0.0 111.598 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.27 -15.82 32.69 Favored Glycine 0 CA--C 1.522 0.491 0 C-N-CA 120.636 -0.793 . . . . 0.0 113.558 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.3 t -101.42 107.56 21.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 117.26 0.53 . . . . 0.0 110.932 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.99 166.62 0.93 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.069 0.462 . . . . 0.0 111.429 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -133.51 89.09 2.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.558 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -119.82 135.83 54.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.696 -178.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.7 t70 51.51 83.83 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.364 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.6 m -108.86 133.01 53.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.7 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -159.47 -179.03 7.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.141 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -78.49 140.3 59.89 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.005 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -90.69 113.86 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 122.906 2.404 . . . . 0.0 111.904 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -90.22 113.51 0.49 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 121.893 1.728 . . . . 0.0 112.845 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -176.16 -177.59 0.91 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.936 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.2 m -108.72 88.88 2.83 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 177.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.3 mt -64.2 124.93 22.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.678 -178.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.417 ' HB2' ' ND1' ' A' ' 48' ' ' HIS . . . -120.97 -33.01 3.83 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.862 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.402 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.5 p30 -163.5 -177.28 5.16 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.113 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.01 -59.23 4.59 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.929 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 23.0 m -61.82 -38.43 88.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.871 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.417 ' ND1' ' HB2' ' A' ' 44' ' ' ALA . 1.7 t60 -61.17 -32.26 71.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.03 0.443 . . . . 0.0 109.845 179.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 1.639 ' HD2' ' CD1' ' A' ' 49' ' ' PHE . 17.7 t80 -69.94 -37.03 75.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.12 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.66 -32.85 74.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.286 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.2 t -70.55 -20.54 62.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.508 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 54.4 m -68.45 -44.02 75.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.118 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 19.0 m -81.11 -28.44 35.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.493 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.85 -19.58 62.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.554 0.693 . . . . 0.0 109.717 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.49 -38.85 90.97 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 114.653 -1.158 . . . . 0.0 112.17 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.8 pt -105.27 8.39 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -179.076 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.63 38.78 10.24 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 120.438 -0.886 . . . . 0.0 113.452 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -139.21 -175.93 4.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.719 0.26 . . . . 0.0 110.866 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 77.3 mtp180 -120.46 155.36 33.7 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 121.008 0.433 . . . . 0.0 111.903 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -84.97 124.96 32.28 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.022 -179.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.487 ' HE ' ' HB3' ' A' ' 74' ' ' CYS . 13.8 ptm180 -149.49 125.16 10.41 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.131 0.491 . . . . 0.0 110.909 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 31.8 m -85.26 99.61 11.24 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.719 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 59.9 m -90.94 143.21 26.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.331 0.586 . . . . 0.0 111.265 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.519 ' CG1' ' HB2' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -99.77 146.38 8.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.662 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.506 ' N ' HG21 ' A' ' 64' ' ' VAL . 7.0 mt -49.43 133.09 18.2 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.502 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -64.27 139.76 67.45 Favored 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 122.615 2.21 . . . . 0.0 112.596 -179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 51.0 mm -129.08 109.55 18.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.231 179.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.26 109.16 0.17 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.827 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.46 -13.49 6.22 Favored Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.611 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -133.51 167.71 19.96 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.524 0.678 . . . . 0.0 111.227 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -83.22 169.61 15.57 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.654 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.8 tt -83.19 126.89 40.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.719 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.519 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.1 mm? -101.96 112.21 24.76 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.965 0.412 . . . . 0.0 111.284 -179.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.487 ' HB3' ' HE ' ' A' ' 61' ' ' ARG . 63.4 m -143.99 135.09 25.51 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.703 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -158.26 171.24 20.55 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.947 0.403 . . . . 0.0 111.013 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.5 m -99.08 137.01 20.38 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.696 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -87.67 142.16 5.76 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.545 2.163 . . . . 0.0 112.821 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.58 6.5 2.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.782 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.92 36.09 73.16 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.26 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 38.5 mt . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.008 179.902 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 71.6 p . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.625 0.25 . . . . 0.0 111.001 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -58.07 114.24 1.88 Allowed 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.566 2.177 . . . . 0.0 112.152 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.424 ' HB3' ' HB2' ' A' ' 6' ' ' GLU . . . -84.43 85.44 7.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.113 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -85.63 -25.77 26.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.013 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.0 ttt -111.49 -30.0 7.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.381 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.424 ' HB2' ' HB3' ' A' ' 3' ' ' ALA . 17.5 mt-10 -82.56 -164.62 0.87 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.877 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.627 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.2 OUTLIER -48.12 121.55 4.39 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.119 0.485 . . . . 0.0 111.183 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.427 ' CG ' ' N ' ' A' ' 9' ' ' VAL . 7.6 pt20 -50.05 -48.92 52.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.515 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.58 HG23 ' HD2' ' A' ' 10' ' ' PRO . 0.5 OUTLIER -64.11 154.82 81.22 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.899 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.58 ' HD2' HG23 ' A' ' 9' ' ' VAL . 81.0 Cg_exo -44.25 133.57 9.07 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.926 2.417 . . . . 0.0 112.767 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 1.634 ' HD1' ' CD2' ' A' ' 11' ' ' TYR . 20.6 t80 -56.09 145.87 24.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.131 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 81.8 m -133.72 93.11 21.59 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.003 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.552 ' HG2' ' HA ' ' A' ' 20' ' ' THR . 74.0 Cg_endo -67.95 170.33 14.49 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.255 1.97 . . . . 0.0 111.69 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.4 t 49.27 -161.25 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.147 0.498 . . . . 0.0 110.778 -178.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.592 ' O ' ' O ' ' A' ' 16' ' ' GLY . 87.5 p -120.25 -156.35 0.66 Allowed 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.529 -178.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.592 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -17.01 -146.92 0.0 OUTLIER Glycine 0 CA--C 1.53 0.981 0 N-CA-C 118.349 2.1 . . . . 0.0 118.349 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.449 ' O ' HD12 ' A' ' 17' ' ' LEU . 1.1 tm? -22.03 -41.41 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 115.19 1.552 . . . . 0.0 115.19 -177.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.575 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 2.0 m-85 -69.13 -36.91 78.0 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.093 -0.643 . . . . 0.0 111.947 -177.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.87 -14.09 0.02 OUTLIER Glycine 0 CA--C 1.528 0.853 0 N-CA-C 115.495 0.958 . . . . 0.0 115.495 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.552 ' HA ' ' HG2' ' A' ' 13' ' ' PRO . 28.2 m -140.26 144.89 36.7 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 118.471 1.135 . . . . 0.0 112.215 -178.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -108.59 112.56 24.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.707 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.434 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 16.8 mm-40 -131.32 -175.91 3.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.0 0.429 . . . . 0.0 111.216 -179.388 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.547 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 71.0 m -127.56 109.97 12.25 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.032 179.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.524 ' HB2' ' HD3' ' A' ' 61' ' ' ARG . 59.2 m -127.59 155.92 43.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.094 0.474 . . . . 0.0 111.416 -179.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -86.42 165.41 16.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.584 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.7 t -126.43 157.22 39.16 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.478 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -80.78 -170.34 2.61 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.106 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.512 HG22 ' HG ' ' A' ' 29' ' ' LEU . 7.0 m -62.93 -45.53 98.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -179.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.512 ' HG ' HG22 ' A' ' 28' ' ' VAL . 28.0 mt -78.46 -20.17 51.53 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.647 0.261 . . . . 0.0 111.615 -178.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.29 -16.11 32.45 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.631 -0.795 . . . . 0.0 113.784 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.3 t -101.49 108.11 22.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 117.163 0.481 . . . . 0.0 111.191 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.21 167.17 0.78 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 121.106 0.479 . . . . 0.0 111.492 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -133.04 85.94 2.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.464 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -114.2 141.9 46.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.983 -178.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 46.8 82.1 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.863 178.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 34.2 m -110.0 129.64 55.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.929 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -153.18 -178.07 6.71 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.056 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -78.28 134.86 62.28 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.553 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.547 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.1 Cg_endo -89.61 114.61 0.6 Allowed 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.832 2.355 . . . . 0.0 112.053 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -90.7 112.87 0.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 121.885 1.724 . . . . 0.0 112.342 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -176.0 -176.55 0.83 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.756 179.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 42.6 m -111.22 88.58 2.82 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.3 mt -61.44 122.03 14.17 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.397 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.4 -32.84 4.0 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.94 -179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -165.41 -178.92 5.21 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 120.756 0.312 . . . . 0.0 111.307 -179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.14 -60.14 3.25 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 112.007 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 32.0 m -60.97 -36.57 79.76 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.857 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -62.76 -31.73 72.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.77 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 1.656 ' HD2' ' CD1' ' A' ' 49' ' ' PHE . 13.2 t80 -70.17 -38.66 75.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.958 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -64.55 -34.67 78.8 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.426 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.2 t -72.92 -13.06 61.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.061 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 87.1 m -80.3 -40.83 26.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.232 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.459 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 72.8 m -85.93 -25.43 26.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.261 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.4 -19.91 52.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.363 0.602 . . . . 0.0 110.357 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.7 -37.72 88.56 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.051 -0.977 . . . . 0.0 112.278 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.1 pt -103.28 7.33 9.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.58 40.97 5.22 Favored Glycine 0 CA--C 1.522 0.493 0 C-N-CA 120.408 -0.901 . . . . 0.0 114.041 178.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -146.77 -179.03 6.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.344 0.572 . . . . 0.0 111.142 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 44.0 mtp180 -116.81 153.55 32.27 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.111 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.459 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -77.32 121.22 23.42 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.569 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.525 HH21 ' HB2' ' A' ' 74' ' ' CYS . 13.4 ptm180 -155.6 115.58 3.71 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 121.23 0.538 . . . . 0.0 110.551 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 20' ' ' THR . 33.5 m -79.11 103.21 8.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.745 -179.062 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 23.4 m -94.12 123.94 37.82 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 121.435 0.636 . . . . 0.0 111.572 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.575 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 1.5 p -72.85 148.05 9.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.182 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.411 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 7.9 mt -51.88 137.32 35.5 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.931 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 31.2 Cg_exo -60.37 124.78 15.84 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.386 2.057 . . . . 0.0 112.369 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.465 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.0 mm -124.85 101.67 9.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.565 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -48.33 120.21 3.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.14 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.2 -12.18 11.41 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.63 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.8 pt20 -135.27 168.45 19.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.396 0.617 . . . . 0.0 111.137 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -84.35 166.25 17.56 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.252 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.456 HG12 ' SG ' ' A' ' 74' ' ' CYS . 15.9 tt -83.31 126.91 40.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.807 0.337 . . . . 0.0 110.575 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.535 ' HB2' HG12 ' A' ' 64' ' ' VAL . 4.0 mm? -99.55 102.22 13.68 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.589 -179.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.525 ' HB2' HH21 ' A' ' 61' ' ' ARG . 44.3 m -137.81 131.63 31.44 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.803 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -160.32 163.44 33.32 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.745 0.307 . . . . 0.0 111.218 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.6 m -99.99 116.79 64.31 Favored Pre-proline 0 CA--C 1.532 0.274 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.11 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.21 136.73 61.84 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.663 2.242 . . . . 0.0 112.722 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.25 1.67 0.74 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.05 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.83 38.79 65.65 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.252 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 36.0 mt . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.155 -0.926 . . . . 0.0 111.104 179.934 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 62.6 p . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.613 0.244 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -57.6 97.32 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.705 2.27 . . . . 0.0 112.336 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -102.82 82.84 2.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.212 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.9 -32.22 14.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.906 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.0 ptt? -106.16 -32.59 8.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.207 0.527 . . . . 0.0 110.043 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -76.05 -165.23 0.45 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.683 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.466 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -55.41 119.56 5.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.972 0.415 . . . . 0.0 110.773 179.658 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 10.2 pm0 -57.69 145.68 33.49 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.967 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.523 HG23 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -91.97 153.82 43.46 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.81 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.523 ' HD2' HG23 ' A' ' 9' ' ' VAL . 84.9 Cg_exo -44.16 125.77 5.87 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.829 2.352 . . . . 0.0 112.521 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -54.5 147.04 14.81 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.084 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 51.4 m -128.99 91.35 42.93 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.226 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.461 ' O ' ' O ' ' A' ' 14' ' ' CYS . 50.1 Cg_exo -51.41 168.06 0.32 Allowed 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.435 2.09 . . . . 0.0 112.643 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.461 ' O ' ' O ' ' A' ' 13' ' ' PRO . 42.3 t 35.42 108.53 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.317 -0.856 . . . . 0.0 113.161 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.8 p -95.42 115.32 27.26 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 171.31 -165.72 38.77 Favored Glycine 0 N--CA 1.44 -1.074 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.272 -177.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.459 ' O ' HD12 ' A' ' 17' ' ' LEU . 1.7 tm? -61.67 -36.37 80.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.631 -0.784 . . . . 0.0 110.337 177.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 1.668 ' HE2' ' CE1' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -81.58 -36.01 29.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.256 -178.167 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.79 -11.56 0.02 OUTLIER Glycine 0 CA--C 1.529 0.919 0 N-CA-C 115.859 1.104 . . . . 0.0 115.859 177.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.45 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 16.3 m -111.3 126.96 55.46 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 118.792 1.296 . . . . 0.0 112.613 -178.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -96.55 101.35 12.95 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.816 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.411 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 28.1 mm-40 -128.52 -174.74 3.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.935 0.397 . . . . 0.0 111.145 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.588 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 64.3 m -134.8 114.75 12.93 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.123 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.82 161.42 32.98 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.983 0.421 . . . . 0.0 111.164 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.498 ' HB1' ' HB2' ' A' ' 34' ' ' LEU . . . -87.94 166.34 14.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.675 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.0 t -131.05 157.64 42.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.814 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.465 ' HB3' ' HB1' ' A' ' 32' ' ' ALA . 0.8 OUTLIER -82.11 -169.59 2.47 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.103 -179.503 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.485 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.9 m -62.0 -47.14 94.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.747 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.485 ' HG ' HG22 ' A' ' 28' ' ' VAL . 33.2 mt -76.91 -19.99 56.74 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -178.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.98 -12.23 31.88 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.353 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.525 ' O ' ' HB1' ' A' ' 32' ' ' ALA . 7.4 p -100.64 108.72 23.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 117.137 0.469 . . . . 0.0 111.255 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.525 ' HB1' ' O ' ' A' ' 31' ' ' VAL . . . 172.72 153.72 0.08 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.881 -179.571 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -123.88 67.26 1.03 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.632 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.498 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 2.0 mt -90.3 135.76 33.48 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.466 -178.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 52.23 83.44 0.06 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.39 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.7 m -108.91 134.0 52.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.537 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -160.62 -178.28 6.77 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.838 0.351 . . . . 0.0 111.319 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 -81.33 136.82 49.08 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.725 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.588 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 68.4 Cg_endo -90.51 117.08 0.59 Allowed 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 123.034 2.489 . . . . 0.0 112.746 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -91.31 113.41 0.37 Allowed 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.052 1.835 . . . . 0.0 112.227 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.89 -178.57 1.06 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.833 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.9 m -109.27 88.09 2.65 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 177.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.0 mt -63.08 124.4 21.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.408 -178.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -117.8 -40.33 3.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.981 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -151.08 -168.41 3.09 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.985 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.89 -44.32 81.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.2 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.5 m -68.35 -39.22 81.94 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.552 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -60.25 -34.99 74.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.787 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 1.64 ' HD2' ' CD1' ' A' ' 49' ' ' PHE . 21.4 t80 -68.42 -39.07 81.73 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.932 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -61.78 -39.57 92.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.23 0.538 . . . . 0.0 109.746 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.1 m -68.09 -24.33 65.04 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.171 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 90.4 m -68.56 -43.52 76.45 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.304 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.535 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 59.0 m -78.74 -26.13 44.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.102 -179.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.63 -19.93 54.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.4 0.619 . . . . 0.0 110.139 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.05 -37.29 86.89 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.983 -1.008 . . . . 0.0 112.043 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.3 pt -105.39 8.74 9.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 -178.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.67 42.72 5.67 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 120.413 -0.899 . . . . 0.0 114.015 178.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -147.83 -178.55 6.33 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 117.336 0.568 . . . . 0.0 111.192 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -120.31 153.15 36.82 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.338 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.535 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -67.99 117.67 10.16 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.704 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.3 mmm180 -136.02 115.24 12.48 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.988 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.691 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 23.0 t -93.29 109.28 20.81 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.53 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 76.7 m -104.67 148.67 26.31 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.22 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.764 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -99.02 148.32 6.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.761 179.861 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.2 mt -49.48 140.74 13.38 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.395 -179.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.407 ' O ' HD11 ' A' ' 67' ' ' ILE . 33.0 Cg_exo -59.52 137.98 81.03 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.674 2.249 . . . . 0.0 112.495 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.407 HD11 ' O ' ' A' ' 66' ' ' PRO . 31.1 mm -131.97 108.56 14.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.308 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.72 121.46 7.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.001 0.429 . . . . 0.0 111.406 -179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 114.76 -4.58 22.76 Favored Glycine 0 C--N 1.33 0.212 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.682 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -148.67 165.4 31.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.324 0.583 . . . . 0.0 111.189 -179.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -81.37 169.9 16.66 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.648 -179.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.3 tt -82.74 123.65 38.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.116 0.484 . . . . 0.0 110.502 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.518 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.1 mm? -90.52 110.93 22.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.254 -179.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 67.2 m -138.15 132.33 31.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.143 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.81 168.64 26.83 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.815 0.34 . . . . 0.0 110.611 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.425 HG21 ' HD2' ' A' ' 77' ' ' PRO . 86.0 m -96.73 137.25 21.42 Favored Pre-proline 0 CA--C 1.532 0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.761 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.425 ' HD2' HG21 ' A' ' 76' ' ' THR . 86.2 Cg_endo -83.48 139.49 9.07 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.418 2.079 . . . . 0.0 112.958 -179.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.06 3.37 1.25 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.038 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.35 38.51 87.3 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.249 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 31.5 mt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.235 179.965 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.9 m . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.725 0.297 . . . . 0.0 110.791 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.23 103.07 0.14 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.668 2.245 . . . . 0.0 112.529 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.58 82.5 1.64 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.825 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -111.07 -33.87 6.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.498 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 9.0 ptp -103.17 -38.13 7.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.013 0.435 . . . . 0.0 110.689 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -77.52 -161.28 0.22 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.833 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.443 ' HD3' ' H ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -47.04 122.66 4.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.131 0.491 . . . . 0.0 111.156 179.891 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -52.79 140.89 22.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.184 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.432 HG23 ' HD2' ' A' ' 10' ' ' PRO . 0.9 OUTLIER -98.75 153.69 37.77 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.924 179.893 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.432 ' HD2' HG23 ' A' ' 9' ' ' VAL . 73.4 Cg_exo -47.77 122.92 7.65 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.83 2.353 . . . . 0.0 112.473 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -68.31 148.51 50.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.89 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 98.6 m -132.55 89.68 35.34 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.006 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.628 ' HG2' ' HA ' ' A' ' 20' ' ' THR . 93.2 Cg_endo -75.09 166.46 29.05 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.48 2.12 . . . . 0.0 111.814 179.246 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.6 t 48.54 -163.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.24 0.543 . . . . 0.0 111.093 -178.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.599 ' O ' ' O ' ' A' ' 16' ' ' GLY . 88.7 p -115.16 -156.4 0.6 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.588 -178.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.599 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -17.58 -148.35 0.0 OUTLIER Glycine 0 CA--C 1.529 0.933 0 N-CA-C 118.701 2.241 . . . . 0.0 118.701 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.401 HD12 ' O ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -23.23 -41.41 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -177.232 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.562 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 5.3 m-85 -68.3 -36.74 79.8 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 119.895 -0.722 . . . . 0.0 111.497 -177.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.2 -12.13 0.01 OUTLIER Glycine 0 CA--C 1.526 0.742 0 N-CA-C 115.644 1.018 . . . . 0.0 115.644 176.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.628 ' HA ' ' HG2' ' A' ' 13' ' ' PRO . 26.9 m -137.91 143.34 40.77 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 118.631 1.216 . . . . 0.0 112.451 -178.143 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -110.6 106.39 15.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.554 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.452 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 20.0 mm-40 -126.18 -176.55 3.68 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.834 0.35 . . . . 0.0 111.309 -179.21 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.474 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 72.6 m -124.64 111.8 16.04 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.159 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.566 ' HB2' ' HD3' ' A' ' 61' ' ' ARG . 63.6 m -128.61 153.84 46.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.208 0.527 . . . . 0.0 111.566 -179.265 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.451 ' HB2' ' HB2' ' A' ' 34' ' ' LEU . . . -84.88 166.81 16.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.667 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.5 t -133.96 158.23 44.03 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.742 -179.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -77.99 -169.93 1.74 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.369 -179.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.481 HG22 ' HG ' ' A' ' 29' ' ' LEU . 7.3 m -64.25 -46.61 92.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.722 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.481 ' HG ' HG22 ' A' ' 28' ' ' VAL . 30.7 mt -75.91 -19.94 58.41 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -178.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.75 -15.29 31.76 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 120.589 -0.815 . . . . 0.0 113.625 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 40.4 t -101.49 107.83 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 117.28 0.54 . . . . 0.0 111.006 179.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 176.17 158.46 0.27 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.315 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -127.48 89.92 3.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.78 179.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.451 ' HB2' ' HB2' ' A' ' 25' ' ' ALA . 2.9 mt -116.73 141.91 47.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.798 -178.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.6 t70 48.9 83.3 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.679 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 35.8 m -112.78 131.1 55.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.018 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -161.66 -179.51 7.33 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.878 0.37 . . . . 0.0 111.099 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -73.26 133.16 81.28 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.271 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.474 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 63.7 Cg_endo -90.14 124.11 1.14 Allowed 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.807 2.338 . . . . 0.0 112.14 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -90.85 113.32 0.41 Allowed 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 121.88 1.72 . . . . 0.0 112.34 -179.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.75 -179.69 1.24 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.615 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 48.3 m -109.66 88.03 2.65 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 177.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.4 mt -61.84 120.73 11.29 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.201 -178.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.424 ' HB2' ' ND1' ' A' ' 48' ' ' HIS . . . -120.33 -33.39 3.89 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.904 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -165.14 -178.76 5.27 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.738 0.304 . . . . 0.0 111.288 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.22 -60.71 2.57 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.213 -0.449 . . . . 0.0 112.1 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 22.0 m -60.1 -37.25 79.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.825 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.424 ' ND1' ' HB2' ' A' ' 44' ' ' ALA . 1.6 t60 -62.02 -32.63 73.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.929 179.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.418 ' CE2' ' HB2' ' A' ' 60' ' ' ALA . 11.0 t80 -69.51 -39.19 77.7 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.881 178.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -63.53 -38.39 90.96 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.009 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.9 m -67.16 -15.48 63.74 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.377 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 91.5 m -79.34 -41.4 27.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.517 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.464 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 74.8 m -86.04 -22.99 26.94 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.251 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.93 -20.02 42.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.388 0.613 . . . . 0.0 110.361 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.1 -37.78 88.68 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.054 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.6 pt -104.42 11.17 8.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.21 43.75 6.51 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.5 -0.857 . . . . 0.0 114.185 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -144.34 179.89 6.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 117.399 0.599 . . . . 0.0 111.136 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -115.32 145.6 42.33 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.195 -179.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.464 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -72.25 123.69 23.49 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.344 -179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.566 ' HD3' ' HB2' ' A' ' 24' ' ' CYS . 13.9 ptm180 -155.86 126.29 6.74 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.929 0.395 . . . . 0.0 110.507 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.408 ' HB3' ' O ' ' A' ' 20' ' ' THR . 25.5 m -90.45 100.74 13.53 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.961 -179.017 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.576 ' HA ' ' HB2' ' A' ' 74' ' ' CYS . 9.2 m -98.32 115.34 28.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.247 0.546 . . . . 0.0 112.234 -178.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.562 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -65.64 146.25 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.466 179.212 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.5 mt -49.81 135.31 20.24 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.261 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -62.43 136.96 62.16 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.506 2.138 . . . . 0.0 112.574 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.477 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 51.2 mm -129.12 104.54 11.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.482 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.59 119.5 2.46 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.035 0.445 . . . . 0.0 111.16 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.43 -12.14 11.22 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.553 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.7 pt20 -135.21 168.46 19.11 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.486 0.66 . . . . 0.0 111.207 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -82.24 166.12 19.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.308 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.3 tt -83.53 124.65 39.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-O 120.951 0.405 . . . . 0.0 111.072 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.496 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.7 mm? -101.19 109.42 21.3 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.849 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.576 ' HB2' ' HA ' ' A' ' 63' ' ' CYS . 51.3 t -161.78 133.65 5.59 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.515 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -160.95 171.88 17.91 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.099 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 74.4 m -77.7 136.97 62.88 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.665 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -84.09 134.41 6.04 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.398 2.066 . . . . 0.0 112.887 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.37 2.29 1.13 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.024 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 73.5 42.17 41.77 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.463 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 28.2 mt . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.148 179.907 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 67.6 p . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.615 0.245 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.01 89.83 0.06 OUTLIER 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.733 2.289 . . . . 0.0 112.453 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -92.67 90.79 7.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.017 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -102.49 -34.94 8.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.354 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 11.5 ttp -111.04 -29.11 8.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.715 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -76.19 -166.04 0.56 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.954 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.692 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -47.05 113.01 0.59 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.31 0.576 . . . . 0.0 111.226 -179.839 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.691 HE21 ' H ' ' A' ' 9' ' ' VAL . 0.3 OUTLIER -53.83 -47.81 70.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.443 -0.798 . . . . 0.0 111.595 179.826 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.691 ' H ' HE21 ' A' ' 8' ' ' GLN . 0.8 OUTLIER -97.55 153.2 38.42 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.155 179.848 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.508 ' HD2' HG23 ' A' ' 9' ' ' VAL . 52.9 Cg_exo -50.04 123.47 10.94 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.95 2.433 . . . . 0.0 112.539 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 1.653 ' HE1' ' CE2' ' A' ' 11' ' ' TYR . 10.9 t80 -67.48 153.04 44.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.701 179.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 65.7 m -155.34 101.89 2.24 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.263 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.446 ' O ' ' O ' ' A' ' 14' ' ' CYS . 65.3 Cg_endo -76.12 166.37 27.96 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.732 2.288 . . . . 0.0 112.352 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.446 ' O ' ' O ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER 17.44 106.87 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.124 0 O-C-N 124.336 1.022 . . . . 0.0 112.237 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -93.73 116.95 29.46 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.0 -166.18 39.02 Favored Glycine 0 N--CA 1.439 -1.128 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.996 -177.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.482 HD11 ' O ' ' A' ' 17' ' ' LEU . 1.7 tm? -59.05 -36.73 75.53 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.596 -0.802 . . . . 0.0 110.686 178.07 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 1.669 ' HD2' ' CD1' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -82.29 -37.58 25.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.141 -178.106 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.07 -12.34 0.02 OUTLIER Glycine 0 CA--C 1.529 0.911 0 N-CA-C 115.586 0.994 . . . . 0.0 115.586 177.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.472 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 17.9 m -109.1 123.87 49.88 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 118.625 1.212 . . . . 0.0 112.194 -178.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.2 102.29 14.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.931 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.2 mm-40 -128.41 -174.22 3.17 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.051 0.453 . . . . 0.0 111.249 -179.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.548 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 70.9 m -128.03 116.14 19.56 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.031 179.327 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.53 ' HB2' ' HD3' ' A' ' 61' ' ' ARG . 78.2 m -129.77 158.49 39.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.068 0.461 . . . . 0.0 111.407 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.32 165.71 12.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.569 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.2 t -125.55 157.39 37.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.78 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -81.48 -170.1 2.62 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.224 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.476 HG22 ' HG ' ' A' ' 29' ' ' LEU . 7.3 m -62.65 -47.1 94.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.476 ' HG ' HG22 ' A' ' 28' ' ' VAL . 29.1 mt -77.65 -20.28 54.04 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.587 0.232 . . . . 0.0 111.531 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.21 -17.47 31.65 Favored Glycine 0 CA--C 1.522 0.483 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.696 179.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.402 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 49.0 t -101.61 108.07 22.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 117.276 0.538 . . . . 0.0 111.142 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 31' ' ' VAL . . . 175.45 170.9 0.32 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.058 0.456 . . . . 0.0 111.328 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -133.28 95.05 3.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.58 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mt -120.53 140.52 51.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.892 -178.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.6 t70 48.1 82.53 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.795 178.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 47.1 m -113.13 129.79 56.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.821 179.405 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.76 -178.28 7.14 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.979 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -73.92 136.94 76.4 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.496 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.548 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.1 Cg_endo -89.47 117.17 0.75 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.826 2.35 . . . . 0.0 112.276 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -90.52 112.74 0.43 Allowed 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 121.765 1.643 . . . . 0.0 112.561 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -176.28 -176.35 0.77 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.647 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.6 m -110.84 88.54 2.8 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.425 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -63.09 124.32 20.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.382 -178.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.73 -33.72 3.73 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.75 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.41 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.8 p30 -163.2 -178.6 6.08 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.157 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.13 -59.68 3.92 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.333 -0.394 . . . . 0.0 112.005 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 35.0 m -61.54 -36.1 79.64 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.975 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.41 ' HB3' ' H ' ' A' ' 45' ' ' ASN . 1.9 t60 -62.44 -32.95 73.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.824 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 1.658 ' HD2' ' CD1' ' A' ' 49' ' ' PHE . 18.3 t80 -70.34 -39.56 74.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.944 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -60.63 -36.85 79.66 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.27 0.557 . . . . 0.0 109.773 178.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 51.1 m -67.34 -22.73 65.58 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.479 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 75.6 m -70.07 -43.77 70.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.551 -179.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.539 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 81.0 m -83.02 -24.94 32.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.189 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.96 -19.92 56.75 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.414 0.626 . . . . 0.0 110.115 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.97 -38.86 92.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.891 -1.049 . . . . 0.0 112.137 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.8 pt -101.76 9.91 8.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.41 39.47 6.33 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.554 -0.831 . . . . 0.0 114.225 178.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -146.41 -177.47 5.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 117.161 0.481 . . . . 0.0 111.131 179.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 58.3 mtt180 -119.97 154.96 33.73 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.682 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.539 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -65.9 119.61 11.62 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.364 -179.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.53 ' HD3' ' HB2' ' A' ' 24' ' ' CYS . 39.6 mtp180 -135.93 118.29 15.7 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.161 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.651 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 14.2 t -96.19 107.04 19.32 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.535 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 54.3 m -102.8 146.94 27.5 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.365 0.602 . . . . 0.0 112.548 -178.393 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.73 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -97.76 143.85 12.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.55 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.9 mt -49.66 139.55 15.64 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.212 -179.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 31.5 Cg_exo -59.28 132.8 48.71 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.54 2.16 . . . . 0.0 112.5 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.451 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 51.1 mm -129.55 106.94 14.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.763 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.21 120.47 5.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.301 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.07 -12.53 11.46 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.635 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.451 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.9 pt20 -135.44 167.25 21.42 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.504 0.668 . . . . 0.0 111.299 -179.771 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -81.84 169.87 16.36 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.218 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.1 tt -82.8 125.71 40.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.895 0.378 . . . . 0.0 110.928 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.544 ' HB2' HG12 ' A' ' 64' ' ' VAL . 3.8 mm? -101.61 113.01 25.76 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.01 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 72.5 m -146.45 129.12 16.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.048 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -160.87 170.13 21.28 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 120.867 0.365 . . . . 0.0 110.986 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 85.4 m -92.61 136.41 25.24 Favored Pre-proline 0 CA--C 1.532 0.28 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.001 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -86.89 144.36 7.3 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.685 2.257 . . . . 0.0 112.599 -179.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 68.36 -0.94 2.02 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.759 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.11 35.7 64.26 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.578 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 42.1 mt . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.253 -0.879 . . . . 0.0 111.172 179.934 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 59.3 m . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.209 0.052 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_exo -41.1 140.01 1.38 Allowed 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.802 2.335 . . . . 0.0 112.782 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.474 ' HB2' ' HB2' ' A' ' 6' ' ' GLU . . . -128.26 91.82 3.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.139 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -98.77 -37.43 9.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.808 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 23.8 mmt -110.04 -8.08 14.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.773 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.474 ' HB2' ' HB2' ' A' ' 3' ' ' ALA . 30.7 mt-10 -78.43 -113.99 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.676 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.408 ' HD3' ' C ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER 43.7 82.0 0.03 OUTLIER 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.888 0.851 . . . . 0.0 110.852 -179.842 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -92.54 120.67 33.22 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.074 -1.421 . . . . 0.0 110.849 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.59 HG23 ' HD2' ' A' ' 10' ' ' PRO . 0.5 OUTLIER -66.55 153.5 93.12 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.919 -179.795 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.59 ' HD2' HG23 ' A' ' 9' ' ' VAL . 73.1 Cg_exo -47.1 120.9 4.63 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.857 2.371 . . . . 0.0 112.85 179.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -78.6 151.17 32.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.756 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 91.6 m -59.71 111.98 4.64 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.831 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.36 176.49 0.11 Allowed 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.646 2.231 . . . . 0.0 112.713 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 14.6 p -39.46 114.89 0.45 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.541 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.6 p -97.59 116.89 30.68 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 173.35 -155.17 21.92 Favored Glycine 0 N--CA 1.435 -1.387 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.57 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.44 ' O ' HD12 ' A' ' 17' ' ' LEU . 1.8 tm? -62.96 -42.45 99.83 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.762 0.425 . . . . 0.0 111.225 178.478 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.769 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -78.1 -38.15 44.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.179 0.514 . . . . 0.0 112.028 -178.222 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.9 -8.92 0.02 OUTLIER Glycine 0 CA--C 1.527 0.785 0 CA-C-N 115.148 -0.933 . . . . 0.0 115.288 176.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.441 ' H ' ' C ' ' A' ' 18' ' ' TYR . 89.9 m -112.54 123.05 49.44 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 118.491 1.145 . . . . 0.0 112.546 -178.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.1 118.49 27.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.081 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 77.5 mm-40 -146.52 167.79 22.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.858 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.487 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 60.8 m -117.45 113.29 21.83 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.09 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.09 156.35 49.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.018 0.437 . . . . 0.0 111.269 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.529 ' HB1' ' HB2' ' A' ' 34' ' ' LEU . . . -80.56 166.35 21.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.747 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.4 t -131.02 157.68 42.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.927 -179.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -82.17 -169.6 2.48 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.237 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.507 HG22 ' HG ' ' A' ' 29' ' ' LEU . 8.5 m -62.65 -46.16 97.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.612 -179.438 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.507 ' HG ' HG22 ' A' ' 28' ' ' VAL . 29.3 mt -78.42 -20.12 51.77 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 -178.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.43 -15.36 32.56 Favored Glycine 0 CA--C 1.52 0.402 0 C-N-CA 120.633 -0.794 . . . . 0.0 113.575 179.241 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.5 t -101.53 108.13 22.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 117.244 0.522 . . . . 0.0 111.181 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 177.68 168.39 0.68 Allowed 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.264 179.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -134.42 90.38 2.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.731 179.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.529 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 2.1 mt -118.6 135.91 54.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.605 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 51.9 84.08 0.05 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.349 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -109.29 134.96 51.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.863 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.7 164.24 36.09 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.182 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -60.92 136.01 93.24 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.914 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.487 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.7 Cg_endo -90.16 109.66 0.4 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.825 2.35 . . . . 0.0 112.3 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -91.21 113.88 0.39 Allowed 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.124 1.883 . . . . 0.0 112.741 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.403 ' HB1' HG21 ' A' ' 52' ' ' THR . . . -175.47 -177.44 1.0 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.788 178.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.3 m -109.09 88.65 2.78 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.0 mt -65.61 120.16 12.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.352 -178.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -117.32 -40.58 3.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.791 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -151.99 -169.09 3.26 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.969 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.46 -48.48 77.53 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.423 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 27.8 m -66.75 -42.05 86.83 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.679 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -60.04 -32.82 71.27 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 1.671 ' HD2' ' CD1' ' A' ' 49' ' ' PHE . 13.9 t80 -68.54 -38.88 81.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.866 178.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -62.45 -37.39 85.7 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.143 0.497 . . . . 0.0 109.769 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.0 m -69.6 -13.37 62.28 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.616 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.403 HG21 ' HB1' ' A' ' 41' ' ' ALA . 49.8 m -75.08 -44.89 44.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.436 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.506 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 60.4 m -84.99 -25.52 27.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.974 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.3 -20.16 59.27 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.519 0.676 . . . . 0.0 109.921 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.46 -38.57 90.22 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.733 -1.121 . . . . 0.0 112.145 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.1 pt -100.98 -0.93 10.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.98 39.69 2.83 Favored Glycine 0 CA--C 1.521 0.446 0 C-N-CA 120.284 -0.96 . . . . 0.0 113.963 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -149.8 -177.21 5.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 117.057 0.428 . . . . 0.0 110.906 179.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 53.5 mtt180 -118.76 154.82 32.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.843 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.506 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -70.37 116.62 10.92 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.256 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.8 mmm180 -133.56 118.42 18.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.038 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.66 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 34.7 t -94.32 108.62 20.5 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.42 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.547 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 65.5 m -105.82 146.01 30.45 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.399 0.619 . . . . 0.0 112.551 -178.312 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.769 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -95.18 146.95 6.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.39 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.422 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.4 mt -49.49 135.64 17.78 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.369 -179.184 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 30.8 Cg_exo -62.32 136.47 59.85 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.571 2.18 . . . . 0.0 112.452 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.5 mm -129.92 109.02 17.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.417 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.54 109.29 0.29 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.058 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.97 -11.62 6.19 Favored Glycine 0 C--N 1.333 0.384 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.882 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -135.8 167.87 20.36 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.484 0.659 . . . . 0.0 111.41 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -81.39 166.95 19.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.301 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.9 tt -83.3 124.32 39.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 121.037 0.446 . . . . 0.0 110.803 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.521 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.0 mm? -97.68 110.39 22.96 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.224 -179.425 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 68.2 m -141.15 130.83 24.11 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.595 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -154.78 161.18 41.6 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.781 0.324 . . . . 0.0 110.874 -179.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 71.4 m -100.56 123.52 45.79 Favored Pre-proline 0 CA--C 1.533 0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.127 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -67.21 140.79 54.77 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.563 2.175 . . . . 0.0 112.714 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.11 2.32 1.04 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.061 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.68 35.07 73.41 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.408 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.3 mt . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.996 179.897 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 74.4 p . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.532 0.206 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -57.59 117.46 4.17 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.621 2.214 . . . . 0.0 112.16 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.543 ' HB2' ' HB2' ' A' ' 6' ' ' GLU . . . -140.21 91.98 2.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.228 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -99.65 -22.68 15.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.094 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.2 ptp -104.58 -34.42 8.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.439 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.543 ' HB2' ' HB2' ' A' ' 3' ' ' ALA . 23.0 mt-10 -60.51 -51.81 67.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.05 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.536 ' O ' ' HG2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -164.26 91.58 0.62 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.665 0.745 . . . . 0.0 110.801 179.675 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -48.83 145.31 3.9 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.226 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.533 HG23 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -97.71 155.14 37.52 Favored Pre-proline 0 CA--C 1.532 0.28 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.737 179.908 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.533 ' HD2' HG23 ' A' ' 9' ' ' VAL . 88.4 Cg_exo -44.84 131.78 10.44 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.672 2.248 . . . . 0.0 112.7 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 1.668 ' HD1' ' CD2' ' A' ' 11' ' ' TYR . 26.7 t80 -54.6 149.72 10.37 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.085 179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 87.8 m -125.21 99.47 34.03 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.189 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.402 ' O ' ' C ' ' A' ' 14' ' ' CYS . 59.4 Cg_exo -53.1 176.7 0.07 OUTLIER 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.723 2.282 . . . . 0.0 113.169 179.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.402 ' C ' ' O ' ' A' ' 13' ' ' PRO . 0.5 OUTLIER -30.38 111.92 0.08 Allowed 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.723 -179.947 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.8 p -96.27 115.57 27.64 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.12 -155.08 22.94 Favored Glycine 0 N--CA 1.436 -1.31 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.397 -177.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.426 HD11 ' O ' ' A' ' 17' ' ' LEU . 1.5 tm? -67.16 -40.13 86.6 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.899 0.381 . . . . 0.0 110.717 177.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.711 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.2 OUTLIER -75.23 -37.97 60.84 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.268 0.556 . . . . 0.0 111.422 -178.8 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.75 -9.44 0.02 OUTLIER Glycine 0 CA--C 1.524 0.651 0 CA-C-N 114.922 -1.035 . . . . 0.0 114.945 177.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.468 ' H ' ' C ' ' A' ' 18' ' ' TYR . 6.0 m -109.56 142.36 40.76 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 118.16 0.98 . . . . 0.0 112.212 -178.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -113.74 100.64 8.61 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.484 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.56 ' NE2' ' HA ' ' A' ' 38' ' ' ASN . 6.1 mm-40 -134.23 -177.74 4.72 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.919 0.39 . . . . 0.0 111.349 -178.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.479 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 56.9 m -126.34 106.82 9.78 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 178.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.433 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 2.0 m -109.08 154.46 22.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.604 -178.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -91.0 166.97 12.73 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.699 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.3 t -131.86 158.25 41.82 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -179.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.93 -169.63 2.09 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.198 -179.608 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.477 HG22 ' HG ' ' A' ' 29' ' ' LEU . 7.1 m -63.56 -46.34 95.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.676 -179.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.477 ' HG ' HG22 ' A' ' 28' ' ' VAL . 34.3 mt -76.25 -19.65 58.13 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -178.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.97 -13.29 31.81 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.566 -0.826 . . . . 0.0 113.497 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 61.1 t -101.45 108.05 22.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 117.132 0.466 . . . . 0.0 111.108 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 176.13 163.4 0.37 Allowed 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.406 179.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -134.56 65.95 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.431 179.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 mt -93.15 138.38 31.62 Favored 'General case' 0 C--O 1.226 -0.159 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.567 -178.081 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 43.95 83.42 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.769 177.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.433 ' HB2' ' HB3' ' A' ' 24' ' ' CYS . 21.0 t -133.33 136.38 45.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.91 0.386 . . . . 0.0 110.66 179.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -164.1 -174.87 3.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.503 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.56 ' HA ' ' NE2' ' A' ' 22' ' ' GLN . 6.3 p30 -58.43 126.35 78.67 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.702 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.479 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 68.4 Cg_endo -90.57 134.37 1.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 122.751 2.301 . . . . 0.0 112.293 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -91.66 113.76 0.36 Allowed 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.207 1.938 . . . . 0.0 112.839 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.63 -178.63 1.12 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.021 179.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.0 m -110.33 88.47 2.77 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 177.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.9 mt -64.56 120.15 11.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.41 -178.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -115.36 -40.94 3.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.78 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -152.01 -169.02 3.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.806 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.11 -41.56 94.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.221 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.1 m -70.61 -44.47 67.17 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.759 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -58.56 -34.88 71.53 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 1.661 ' HE1' ' CE2' ' A' ' 49' ' ' PHE . 13.5 t80 -67.32 -38.33 84.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.581 178.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -60.66 -40.51 92.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.222 0.535 . . . . 0.0 109.761 178.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.6 m -66.3 -23.85 66.45 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.442 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 66.4 m -63.97 -45.93 86.9 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.501 -179.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 61.1 m -80.11 -28.75 38.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.25 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.92 -20.08 61.82 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.579 0.704 . . . . 0.0 109.948 -179.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.45 -36.61 84.72 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.876 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.3 pt -108.71 1.08 9.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -179.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.84 43.46 2.64 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 120.324 -0.941 . . . . 0.0 114.306 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -148.83 174.64 12.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 117.468 0.634 . . . . 0.0 110.923 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.426 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 11.7 ptm180 -119.01 142.18 48.04 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.766 0.317 . . . . 0.0 110.992 -179.682 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.51 125.77 24.92 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.167 -179.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.462 ' HB2' ' SG ' ' A' ' 74' ' ' CYS . 8.6 ptm180 -153.63 127.87 9.12 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.125 179.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 6.4 m -95.02 105.11 17.0 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.846 -178.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.438 ' HA ' ' HB2' ' A' ' 74' ' ' CYS . 3.9 m -105.58 136.24 45.52 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.12 0.486 . . . . 0.0 111.934 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.711 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -85.29 148.4 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.922 179.911 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.418 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.7 mt -49.5 137.7 16.59 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.126 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 37.2 Cg_exo -60.79 137.12 70.74 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 122.458 2.105 . . . . 0.0 112.464 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.447 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 51.1 mm -129.56 106.1 13.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.565 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -47.63 120.69 3.47 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.379 -179.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 116.21 -11.93 16.91 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.718 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.447 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.3 pt20 -138.6 169.51 17.67 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.492 0.663 . . . . 0.0 111.335 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -84.4 165.34 18.27 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.968 179.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.9 tt -83.66 122.97 38.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.206 0.527 . . . . 0.0 110.938 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.576 ' O ' HG13 ' A' ' 64' ' ' VAL . 4.1 mm? -92.53 115.33 28.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.571 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.462 ' SG ' ' HB2' ' A' ' 61' ' ' ARG . 51.7 t -161.03 137.63 8.59 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.572 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -160.34 167.39 27.54 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.199 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 84.1 m -87.79 137.11 31.95 Favored Pre-proline 0 CA--C 1.531 0.229 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.83 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -84.21 141.24 9.1 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 122.496 2.131 . . . . 0.0 112.902 -179.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.98 1.03 1.06 Allowed 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.05 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.02 37.92 64.07 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.32 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 37.1 mt . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.145 -179.951 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 53.0 m . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.493 0.187 . . . . 0.0 111.048 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.05 90.66 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.649 2.232 . . . . 0.0 112.296 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.23 89.24 3.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.911 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -98.07 -44.81 6.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.3 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -103.87 -2.04 26.84 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.294 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -86.21 -72.49 0.49 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.984 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.61 117.27 8.11 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 120.983 0.42 . . . . 0.0 110.918 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -56.41 145.76 26.46 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.745 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.591 HG23 ' HD2' ' A' ' 10' ' ' PRO . 0.5 OUTLIER -84.3 152.87 61.96 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.694 179.912 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.591 ' HD2' HG23 ' A' ' 9' ' ' VAL . 82.8 Cg_exo -43.81 127.09 6.22 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.862 2.375 . . . . 0.0 112.564 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 31.0 t80 -52.77 153.04 3.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.294 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 44.9 m -118.9 95.63 49.41 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.047 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -52.55 176.65 0.06 OUTLIER 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.795 2.33 . . . . 0.0 113.191 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -37.08 109.01 0.09 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.738 -179.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.6 p -95.34 115.5 27.52 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 178.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.46 -154.81 22.05 Favored Glycine 0 N--CA 1.436 -1.334 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.772 -177.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.439 HD11 ' O ' ' A' ' 17' ' ' LEU . 1.6 tm? -66.32 -40.8 90.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.169 -0.515 . . . . 0.0 110.896 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.743 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -76.04 -37.84 57.86 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.495 0.664 . . . . 0.0 111.117 -179.055 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.87 -8.23 0.02 OUTLIER Glycine 0 CA--C 1.525 0.665 0 CA-C-N 114.733 -1.121 . . . . 0.0 114.8 177.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.493 HG23 ' HG2' ' A' ' 22' ' ' GLN . 23.3 m -108.72 142.98 38.44 Favored 'General case' 0 N--CA 1.457 -0.087 0 CA-C-N 118.016 0.908 . . . . 0.0 112.194 -178.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.422 ' O ' ' HG3' ' A' ' 39' ' ' PRO . . . -107.9 101.72 10.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.038 179.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.493 ' HG2' HG23 ' A' ' 20' ' ' THR . 27.8 mm-40 -126.33 -179.28 4.67 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 121.137 0.494 . . . . 0.0 111.505 -179.12 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.57 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 77.4 m -133.86 117.44 16.82 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.84 179.347 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.08 -179.04 5.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.843 0.354 . . . . 0.0 111.083 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.475 ' HB1' ' HB2' ' A' ' 34' ' ' LEU . . . -111.32 165.66 11.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.815 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.1 t -129.77 157.08 43.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.8 -179.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.07 -170.18 2.9 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.092 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.494 HG22 ' HG ' ' A' ' 29' ' ' LEU . 7.4 m -61.76 -45.97 97.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.672 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.494 ' HG ' HG22 ' A' ' 28' ' ' VAL . 30.3 mt -77.5 -20.08 54.87 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.59 -13.22 32.82 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.561 -0.828 . . . . 0.0 113.424 179.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 22.5 t -101.16 107.83 22.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 117.255 0.527 . . . . 0.0 110.957 179.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 174.46 154.36 0.13 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.177 179.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -123.55 59.54 1.11 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.76 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.475 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 3.3 mt -81.46 135.64 35.63 Favored 'General case' 0 C--O 1.227 -0.108 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.849 -178.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.0 t70 51.0 83.23 0.05 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.78 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.6 m -109.28 132.09 54.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.379 179.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.07 -177.1 6.31 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.892 0.377 . . . . 0.0 111.647 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -77.7 138.14 62.54 Favored Pre-proline 0 CA--C 1.532 0.27 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.357 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.57 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 62.6 Cg_endo -90.72 110.75 0.37 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.021 2.481 . . . . 0.0 112.993 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -91.5 113.69 0.37 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.002 1.802 . . . . 0.0 112.032 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.14 -178.38 1.19 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.985 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.2 m -110.53 88.68 2.83 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.3 mt -63.52 122.08 15.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.274 -178.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.415 ' HB2' ' ND1' ' A' ' 48' ' ' HIS . . . -120.36 -33.4 3.88 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.753 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.414 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.1 p30 -162.88 -178.05 5.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.073 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.62 -61.51 2.15 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.102 -179.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 34.2 m -60.81 -35.93 77.75 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.956 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.415 ' ND1' ' HB2' ' A' ' 44' ' ' ALA . 1.7 t60 -62.19 -32.93 73.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.016 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -71.08 -39.97 71.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.142 179.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -61.39 -35.63 78.05 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.219 0.533 . . . . 0.0 109.735 178.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.2 m -67.71 -24.0 65.34 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.195 179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 51.6 m -65.03 -45.66 84.54 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.439 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.552 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 38.3 m -81.73 -26.17 34.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.14 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.27 -20.2 59.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.452 0.644 . . . . 0.0 110.151 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.59 -36.88 85.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.062 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.5 pt -107.48 14.2 8.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -179.064 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.34 41.9 8.22 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.421 -0.895 . . . . 0.0 113.546 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -143.71 -178.81 6.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 117.034 0.417 . . . . 0.0 111.074 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.419 ' HD3' HH21 ' A' ' 61' ' ' ARG . 99.2 mtt180 -122.99 151.59 41.7 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.406 -179.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.552 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -66.91 120.05 12.94 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.326 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HB3' ' SG ' ' A' ' 74' ' ' CYS . 13.9 mmt180 -138.9 125.74 20.96 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.964 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 22.4 m -100.03 99.94 10.74 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 4.0 m -104.07 141.11 36.79 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -177.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.743 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.4 OUTLIER -97.77 144.11 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.181 179.255 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.46 ' N ' HG21 ' A' ' 64' ' ' VAL . 8.1 mt -53.25 135.08 50.92 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.753 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -66.82 141.06 57.79 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.545 2.163 . . . . 0.0 112.74 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.443 ' O ' ' C ' ' A' ' 68' ' ' LEU . 1.8 mp -112.68 102.99 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.443 ' C ' ' O ' ' A' ' 67' ' ' ILE . 0.3 OUTLIER -30.32 108.67 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.928 0.394 . . . . 0.0 111.206 -179.675 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 121.78 -8.89 9.93 Favored Glycine 0 C--N 1.333 0.395 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.374 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -135.67 170.21 16.33 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.516 0.674 . . . . 0.0 111.339 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -85.9 169.9 12.85 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.33 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.3 tt -83.28 126.66 40.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.076 0.465 . . . . 0.0 111.024 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.554 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.9 mm? -98.43 119.78 37.72 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.113 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.421 ' SG ' ' HB3' ' A' ' 61' ' ' ARG . 41.8 t -161.56 137.81 8.11 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.47 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -160.81 170.74 20.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.82 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.9 m -89.88 137.25 28.4 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.826 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -86.8 142.77 6.84 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.693 2.262 . . . . 0.0 112.787 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 66.65 -1.32 1.34 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.92 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.18 36.52 63.85 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.452 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.1 mt . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.229 179.969 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 56.6 m . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.607 0.242 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -56.78 113.45 1.47 Allowed 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.664 2.243 . . . . 0.0 112.351 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 6' ' ' GLU . . . -146.06 104.01 3.79 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.322 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -95.54 -28.66 14.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.933 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 9.8 ttm -110.87 -28.98 8.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.105 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.465 ' HB2' ' HB2' ' A' ' 3' ' ' ALA . 19.8 mt-10 -81.15 -158.42 0.21 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.584 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.633 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -49.18 119.69 3.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.989 179.859 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -51.95 139.03 23.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.93 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.551 HG23 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -88.81 154.71 50.33 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.946 -179.823 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.551 ' HD2' HG23 ' A' ' 9' ' ' VAL . 82.4 Cg_exo -43.55 123.97 3.99 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.884 2.389 . . . . 0.0 112.51 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 1.647 ' HD2' ' CD1' ' A' ' 11' ' ' TYR . 8.6 t80 -57.81 157.43 7.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.075 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 84.7 m -117.02 126.18 27.67 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.072 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_exo -58.2 176.78 0.33 Allowed 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.52 2.147 . . . . 0.0 112.433 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -42.41 126.06 3.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.927 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.4 p -103.87 116.04 31.55 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 173.13 -154.89 21.59 Favored Glycine 0 N--CA 1.434 -1.443 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.743 -177.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.43 HD11 ' O ' ' A' ' 17' ' ' LEU . 1.5 tm? -65.56 -40.63 93.02 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.31 -0.445 . . . . 0.0 110.96 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 1.638 ' HE1' ' CE2' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -77.43 -39.04 48.29 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.233 0.539 . . . . 0.0 111.645 -178.347 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.4 -12.91 0.01 OUTLIER Glycine 0 CA--C 1.528 0.87 0 N-CA-C 115.919 1.128 . . . . 0.0 115.919 176.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.443 ' H ' ' C ' ' A' ' 18' ' ' TYR . 25.6 m -110.73 129.11 55.92 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 118.78 1.29 . . . . 0.0 112.683 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.38 115.99 28.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.431 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.476 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 18.9 mm-40 -135.53 -178.24 5.03 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.03 0.443 . . . . 0.0 111.366 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.522 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 98.1 m -138.02 100.42 4.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.837 179.192 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 4.5 t -118.89 177.88 4.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.903 -179.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.489 ' HB2' ' HB2' ' A' ' 34' ' ' LEU . . . -104.08 166.94 10.09 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.8 -179.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.2 t -129.19 157.8 40.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.674 -179.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 p-10 -77.64 -170.02 1.68 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.051 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.485 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.8 m -65.19 -44.67 95.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.516 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.485 ' HG ' HG22 ' A' ' 28' ' ' VAL . 31.3 mt -76.6 -19.36 57.93 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.795 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.88 -16.86 30.46 Favored Glycine 0 CA--C 1.521 0.465 0 C-N-CA 120.541 -0.838 . . . . 0.0 113.79 179.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 66.2 t -101.48 107.68 21.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 117.464 0.632 . . . . 0.0 111.074 179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 175.74 168.42 0.38 Allowed 'General case' 0 C--O 1.231 0.113 0 CA-C-O 121.091 0.472 . . . . 0.0 111.389 179.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -135.24 65.41 1.56 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.58 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.489 ' HB2' ' HB2' ' A' ' 25' ' ' ALA . 2.6 mt -87.57 132.23 34.13 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.119 -178.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.9 t70 51.17 84.75 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.562 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 86.8 m -108.12 129.72 55.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.121 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -148.17 -178.98 6.6 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.861 0.362 . . . . 0.0 111.433 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -73.79 137.94 76.76 Favored Pre-proline 0 CA--C 1.531 0.246 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.75 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.522 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 63.8 Cg_endo -90.88 109.73 0.34 Allowed 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 123.044 2.496 . . . . 0.0 112.609 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -91.01 113.73 0.4 Allowed 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 121.948 1.765 . . . . 0.0 112.387 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.27 177.27 1.9 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.887 178.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.1 m -106.99 88.11 2.66 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 177.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mt -61.8 122.71 16.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.252 -178.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.411 ' HB2' ' ND1' ' A' ' 48' ' ' HIS . . . -120.59 -31.72 4.22 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 116.232 -0.44 . . . . 0.0 112.074 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.4 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.0 p30 -166.24 -179.53 5.12 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.708 0.289 . . . . 0.0 111.337 -179.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.98 -59.17 4.14 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.026 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.6 m -60.26 -36.64 78.27 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.792 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.411 ' ND1' ' HB2' ' A' ' 44' ' ' ALA . 1.8 t60 -62.49 -33.81 75.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.861 179.295 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -69.05 -34.48 75.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.184 179.232 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -70.29 -24.06 62.97 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.626 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 29.5 t -85.43 -12.76 51.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.315 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 60.4 m -72.15 -44.17 63.52 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.756 0.312 . . . . 0.0 111.284 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.503 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 48.2 m -84.67 -25.48 28.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.069 -179.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.45 -20.06 57.42 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.471 0.653 . . . . 0.0 110.176 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.2 -36.53 82.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.946 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.5 pt -105.36 -4.5 9.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 112.951 0.722 . . . . 0.0 112.951 -178.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 103.98 39.59 2.46 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 120.272 -0.966 . . . . 0.0 114.133 178.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -143.94 -178.89 6.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 117.265 0.533 . . . . 0.0 111.069 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -114.95 149.77 36.79 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.327 -179.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.503 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -76.22 121.15 22.49 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.831 -179.24 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.454 HH21 ' HB2' ' A' ' 74' ' ' CYS . 11.9 ptm180 -146.08 125.62 13.26 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.692 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.638 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 10.6 t -88.95 118.16 28.47 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.539 -179.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.584 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 40.6 m -109.76 148.1 32.04 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -178.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.742 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -99.91 149.21 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 115.041 -0.982 . . . . 0.0 111.061 -179.556 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.1 mt -49.37 136.84 16.42 Favored Pre-proline 0 CA--C 1.531 0.228 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.422 -179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_exo -63.18 133.36 40.42 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.562 2.175 . . . . 0.0 112.642 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.3 mm -129.38 106.8 14.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.664 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.45 ' O ' HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -50.86 110.83 0.46 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 121.563 0.696 . . . . 0.0 111.529 -179.763 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.27 -15.58 5.79 Favored Glycine 0 C--N 1.335 0.51 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.548 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -132.37 168.3 18.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.441 0.639 . . . . 0.0 111.176 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -84.27 167.1 16.93 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.258 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.414 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.0 tt -83.14 125.03 40.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.001 0.429 . . . . 0.0 110.919 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.553 ' HB2' HG12 ' A' ' 64' ' ' VAL . 3.9 mm? -96.28 110.73 22.99 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.164 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.454 ' HB2' HH21 ' A' ' 61' ' ' ARG . 57.4 m -145.93 135.98 23.65 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.226 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.542 ' HG2' ' HH ' ' A' ' 18' ' ' TYR . 2.2 pt20 -159.83 166.67 29.85 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.699 0.285 . . . . 0.0 110.851 179.252 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.2 m -91.89 135.99 26.75 Favored Pre-proline 0 CA--C 1.531 0.246 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.986 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -88.12 143.47 5.75 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.795 2.33 . . . . 0.0 112.817 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 64.94 4.05 2.32 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.853 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.35 33.69 68.51 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.351 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 47.4 mt . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.183 -0.913 . . . . 0.0 111.078 179.981 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 78.3 p . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.599 0.238 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -57.41 102.19 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.581 2.187 . . . . 0.0 112.199 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -80.37 91.87 5.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.192 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.05 -52.67 4.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.02 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.9 ttt -112.9 -7.7 13.73 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 122.031 0.919 . . . . 0.0 108.815 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.611 ' N ' ' CD ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -66.33 -164.6 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.256 -1.338 . . . . 0.0 110.904 -178.825 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.543 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -52.13 118.88 3.8 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.056 0.455 . . . . 0.0 110.946 -179.921 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -54.38 133.38 45.37 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.78 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.665 HG11 ' HD2' ' A' ' 10' ' ' PRO . 3.6 t -93.82 141.01 23.19 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.925 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.665 ' HD2' HG11 ' A' ' 9' ' ' VAL . 79.8 Cg_exo -32.55 121.42 0.1 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.856 3.037 . . . . 0.0 113.209 -179.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -82.55 140.44 33.28 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.324 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 54.6 m -139.44 99.91 7.76 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.232 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.585 ' HB2' ' H ' ' A' ' 21' ' ' ALA . 37.3 Cg_exo -56.13 171.24 0.87 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.071 1.847 . . . . 0.0 111.649 179.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.449 ' SG ' ' N ' ' A' ' 15' ' ' SER . 3.4 p 44.98 -154.5 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.2 0.524 . . . . 0.0 111.101 -179.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.583 ' O ' ' O ' ' A' ' 16' ' ' GLY . 4.2 m -113.3 -157.85 0.63 Allowed 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -178.505 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.583 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -19.49 -149.69 0.0 OUTLIER Glycine 0 CA--C 1.531 1.079 0 N-CA-C 119.086 2.394 . . . . 0.0 119.086 -179.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.43 ' O ' HD12 ' A' ' 17' ' ' LEU . 0.9 OUTLIER -22.79 -41.09 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 115.757 1.762 . . . . 0.0 115.757 -177.252 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 1.617 ' HD1' ' CD2' ' A' ' 18' ' ' TYR . 2.8 m-85 -68.59 -36.67 79.03 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 118.679 0.672 . . . . 0.0 111.485 -177.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.3 -20.33 0.01 OUTLIER Glycine 0 CA--C 1.533 1.204 0 N-CA-C 117.981 1.952 . . . . 0.0 117.981 175.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.481 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 76.9 m -130.04 120.58 24.93 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 120.064 1.932 . . . . 0.0 113.539 -177.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.585 ' H ' ' HB2' ' A' ' 13' ' ' PRO . . . -69.13 120.58 15.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.291 -179.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.427 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 20.4 mm-40 -138.46 -175.39 4.11 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.89 0.376 . . . . 0.0 110.781 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.8 t -145.91 134.04 21.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.608 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.7 m -148.38 162.26 39.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.015 0.436 . . . . 0.0 111.392 -179.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -96.32 170.35 9.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.297 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.1 t -130.59 157.94 41.34 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.709 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -82.09 -169.96 2.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.212 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.506 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.6 m -63.02 -43.5 99.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.623 -179.472 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.506 ' HG ' HG22 ' A' ' 28' ' ' VAL . 29.4 mt -78.37 -19.92 52.37 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.77 -14.54 31.99 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.395 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.6 t -101.71 107.94 22.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 117.239 0.52 . . . . 0.0 111.127 179.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 176.4 145.38 0.09 Allowed 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.283 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -116.62 60.96 0.73 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.758 179.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.8 mt -84.91 153.23 22.99 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.577 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.1 t70 41.37 79.74 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.785 178.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 54.4 m -109.31 131.45 55.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.71 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -162.45 -174.8 4.18 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.931 0.395 . . . . 0.0 111.369 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.492 HD21 ' H ' ' A' ' 38' ' ' ASN . 0.1 OUTLIER -78.99 133.05 62.0 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.883 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 22' ' ' GLN . 92.5 Cg_endo -85.27 117.88 1.89 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.665 2.244 . . . . 0.0 111.78 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -91.1 114.34 0.41 Allowed 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 122.229 1.953 . . . . 0.0 113.036 -179.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.62 178.02 1.65 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.915 178.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 31.7 m -106.86 88.42 2.74 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mt -63.95 124.3 21.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.59 -178.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.1 -40.52 2.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.855 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -151.91 -167.34 2.75 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.997 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.16 -45.29 77.46 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.364 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 42.4 m -67.83 -40.98 83.69 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.497 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -61.15 -32.7 72.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.549 179.115 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -68.82 -37.32 79.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.167 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -67.1 -27.45 67.36 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.526 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.6 t -82.37 -13.85 56.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.936 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 42.8 m -69.91 -40.07 75.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.91 0.386 . . . . 0.0 111.176 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 12.2 m -88.58 -29.31 20.11 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.293 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.31 -19.95 62.26 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.706 0.765 . . . . 0.0 109.579 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.12 -38.02 89.34 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.884 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.7 pt -103.13 -1.35 9.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -179.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.4 44.1 3.3 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 120.331 -0.938 . . . . 0.0 113.519 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -146.03 -172.98 4.04 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 117.227 0.514 . . . . 0.0 111.089 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 19.3 ptt180 -119.37 141.89 48.65 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 -178.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -72.05 123.24 22.4 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.213 -179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.446 HH21 ' HB2' ' A' ' 74' ' ' CYS . 14.2 ptm180 -158.55 126.15 5.06 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.337 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.672 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 18.7 t -85.43 145.36 27.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.404 -179.268 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 21.6 m -125.5 147.38 49.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.327 0.584 . . . . 0.0 111.723 -179.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.62 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -101.52 147.4 8.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.251 179.79 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 7.9 mt -49.32 133.12 17.41 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.29 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 23.9 Cg_exo -63.65 139.05 67.56 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.622 2.214 . . . . 0.0 112.521 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 46.0 mm -131.6 110.42 17.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.394 179.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.81 109.49 0.29 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.878 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.84 -13.74 5.8 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.588 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -133.39 167.65 20.03 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.473 0.654 . . . . 0.0 111.31 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -83.53 168.56 16.32 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.77 -1.104 . . . . 0.0 110.181 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.437 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.8 tt -83.32 125.56 40.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.867 0.365 . . . . 0.0 110.615 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.51 ' HB2' HG12 ' A' ' 64' ' ' VAL . 3.9 mm? -98.28 105.85 18.05 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.83 0.348 . . . . 0.0 111.328 -179.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.446 ' HB2' HH21 ' A' ' 61' ' ' ARG . 48.5 m -146.89 133.63 20.0 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.099 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -161.03 166.76 27.66 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-O 120.823 0.344 . . . . 0.0 110.825 179.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.2 m -80.34 137.38 52.33 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.803 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -89.86 142.69 4.03 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.797 2.331 . . . . 0.0 112.757 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.23 4.47 1.64 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.613 179.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.46 36.7 58.99 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.537 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.6 mt . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.875 179.94 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.564 0.221 . . . . 0.0 110.976 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -58.76 119.58 6.92 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.566 2.178 . . . . 0.0 112.384 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -113.54 87.95 2.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.961 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -107.28 -48.11 3.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.333 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 86.9 mmm -112.15 4.22 17.76 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 121.849 0.833 . . . . 0.0 109.301 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.585 ' N ' ' CD ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -75.8 -34.83 60.18 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.219 -1.355 . . . . 0.0 111.15 -178.586 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.64 62.19 1.22 Allowed 'General case' 0 CA--C 1.508 -0.638 0 CA-C-O 122.225 1.012 . . . . 0.0 109.987 178.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.42 ' CG ' ' N ' ' A' ' 9' ' ' VAL . 1.7 pt20 -45.44 -50.4 12.59 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 113.245 -1.798 . . . . 0.0 111.497 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.56 HG23 ' HD2' ' A' ' 10' ' ' PRO . 0.7 OUTLIER -74.39 154.95 87.95 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.882 179.823 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.56 ' HD2' HG23 ' A' ' 9' ' ' VAL . 84.5 Cg_exo -45.18 123.96 5.73 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.725 2.283 . . . . 0.0 112.586 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -63.67 156.21 27.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.99 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 59.8 m -137.17 91.3 14.78 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.088 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.422 ' O ' ' O ' ' A' ' 14' ' ' CYS . 69.0 Cg_endo -75.1 170.13 21.07 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.898 2.399 . . . . 0.0 112.781 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.422 ' O ' ' O ' ' A' ' 13' ' ' PRO . 51.3 t 31.16 104.97 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.1 p -96.22 115.81 28.01 Favored 'General case' 0 C--O 1.232 0.147 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 170.94 -166.56 39.74 Favored Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 120.582 -0.818 . . . . 0.0 113.26 -177.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.457 ' O ' HD12 ' A' ' 17' ' ' LEU . 1.8 tm? -60.06 -37.51 80.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.823 -0.688 . . . . 0.0 110.27 177.554 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.734 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -79.43 -36.07 39.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.565 -178.653 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 59.02 -11.7 0.02 OUTLIER Glycine 0 CA--C 1.525 0.698 0 N-CA-C 115.507 0.963 . . . . 0.0 115.507 177.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.437 ' H ' ' C ' ' A' ' 18' ' ' TYR . 28.0 m -119.15 120.59 37.56 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 118.602 1.201 . . . . 0.0 112.38 -178.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.412 ' HB1' ' HB2' ' A' ' 14' ' ' CYS . . . -86.77 107.2 18.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.313 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.7 mm-40 -126.14 -169.45 2.02 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.092 0.472 . . . . 0.0 111.724 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 4.4 t -143.67 138.04 28.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.747 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.8 t -157.15 173.47 16.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.932 0.396 . . . . 0.0 111.215 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.98 166.23 11.54 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.691 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.6 t -125.67 156.99 38.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.681 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -84.76 -169.81 2.82 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.194 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.51 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.6 m -61.42 -44.81 99.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.557 -179.545 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.51 ' HG ' HG22 ' A' ' 28' ' ' VAL . 27.0 mt -79.74 -20.27 46.77 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.037 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.35 -15.42 32.72 Favored Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.596 -0.812 . . . . 0.0 113.485 179.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 31.0 t -101.77 108.1 22.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 117.241 0.52 . . . . 0.0 111.124 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 179.52 168.0 1.11 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.044 0.45 . . . . 0.0 111.451 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -132.84 64.21 1.62 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.609 179.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -91.51 131.33 37.03 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.526 -178.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 52.14 83.23 0.06 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.956 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 56.4 m -108.08 131.9 54.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.338 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -153.65 -178.03 6.76 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.879 0.371 . . . . 0.0 111.29 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -77.96 140.51 62.38 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.633 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -90.72 111.17 0.38 Allowed 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.953 2.436 . . . . 0.0 111.909 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -90.71 113.78 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 121.903 1.736 . . . . 0.0 112.866 -179.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.99 -178.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.651 178.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.8 m -107.01 88.28 2.7 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.4 mt -62.51 122.85 16.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.482 -178.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.405 ' HB2' ' ND1' ' A' ' 48' ' ' HIS . . . -120.77 -33.62 3.75 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.764 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.9 p30 -163.48 -179.16 6.3 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.134 -179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.08 -60.03 3.33 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.289 -0.414 . . . . 0.0 112.025 -179.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 23.2 m -60.11 -37.78 81.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.756 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . 0.405 ' ND1' ' HB2' ' A' ' 44' ' ' ALA . 1.6 t60 -61.27 -33.11 73.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.904 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -68.78 -33.6 74.14 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.042 179.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -69.29 -41.58 76.6 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.025 178.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.1 m -64.36 -17.47 63.75 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.237 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 50.8 m -71.37 -42.1 68.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.443 -179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 23.0 m -84.59 -30.43 25.01 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.657 -179.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.83 -19.71 63.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.635 0.731 . . . . 0.0 109.631 -179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -68.56 -39.72 80.92 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.286 -179.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 23.4 pt -100.57 1.41 10.51 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.24 39.56 5.67 Favored Glycine 0 CA--C 1.522 0.516 0 C-N-CA 120.294 -0.955 . . . . 0.0 113.443 179.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -145.96 -174.13 4.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.814 0.307 . . . . 0.0 110.807 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 23.9 mtm180 -119.73 156.45 30.53 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.89 0.376 . . . . 0.0 111.184 -179.416 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -85.49 122.87 30.25 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.645 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -144.14 129.67 19.04 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.947 0.404 . . . . 0.0 110.546 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.676 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.9 t -98.5 109.67 22.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.732 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.521 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 91.9 m -101.07 145.75 28.34 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.308 0.575 . . . . 0.0 112.493 -178.419 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.734 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -95.25 148.42 5.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.495 179.704 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 10.5 mt -49.24 140.64 12.38 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.398 -179.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.444 ' O ' HD11 ' A' ' 67' ' ' ILE . 34.1 Cg_exo -59.79 139.65 89.47 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.734 2.289 . . . . 0.0 112.327 -179.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.444 HD11 ' O ' ' A' ' 66' ' ' PRO . 30.2 mm -131.95 110.12 16.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.476 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.48 111.89 0.8 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.092 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 122.65 -2.96 10.17 Favored Glycine 0 C--N 1.335 0.485 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.089 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -149.7 165.42 32.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.269 0.557 . . . . 0.0 111.163 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -78.87 169.85 17.59 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.577 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.408 ' O ' HG21 ' A' ' 72' ' ' ILE . 17.2 tt -82.85 121.69 36.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.152 0.501 . . . . 0.0 110.613 179.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.528 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.7 mm? -90.49 124.64 35.16 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.466 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -160.27 135.84 8.22 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.217 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -159.51 162.37 35.48 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.741 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 53.1 m -82.82 136.31 44.74 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.862 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -85.74 140.88 7.26 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.577 2.184 . . . . 0.0 112.653 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.12 3.69 1.36 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.664 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.94 38.04 60.31 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.485 179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 35.6 mt . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.232 -0.889 . . . . 0.0 111.049 179.992 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.483 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 57.8 m . . . . . 0 N--CA 1.486 1.361 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.483 ' HD2' ' N ' ' A' ' 1' ' ' SER . 17.8 Cg_endo -59.35 112.46 1.24 Allowed 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 122.059 1.839 . . . . 0.0 112.369 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.58 98.92 3.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.163 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -106.15 -30.36 9.28 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.979 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 24.3 mmt -108.74 -4.09 17.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.778 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -98.39 -164.02 1.1 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.67 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.623 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -50.47 119.86 4.12 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.03 0.443 . . . . 0.0 111.329 -179.835 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -52.17 145.28 10.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.085 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.547 HG23 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -90.88 154.34 45.38 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.921 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.547 ' HD2' HG23 ' A' ' 9' ' ' VAL . 86.3 Cg_exo -44.68 126.35 7.1 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.92 2.414 . . . . 0.0 112.687 179.774 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -55.25 157.12 3.74 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.974 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 40.5 m -130.57 91.81 36.73 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.138 -179.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.552 ' HB2' ' HB1' ' A' ' 21' ' ' ALA . 89.7 Cg_endo -72.9 177.24 7.94 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.916 2.411 . . . . 0.0 112.521 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.488 ' C ' ' O ' ' A' ' 13' ' ' PRO . 23.1 p -15.98 115.17 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 O-C-N 123.969 0.793 . . . . 0.0 112.241 -179.605 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.0 p -95.32 117.96 31.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.27 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.25 -166.79 39.65 Favored Glycine 0 N--CA 1.441 -1.031 0 C-N-CA 120.551 -0.833 . . . . 0.0 113.161 -177.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.462 ' O ' HD12 ' A' ' 17' ' ' LEU . 1.7 tm? -56.86 -37.21 70.99 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.764 -0.718 . . . . 0.0 110.591 177.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.709 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -80.91 -38.9 27.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.404 0.621 . . . . 0.0 111.375 -178.551 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.72 -8.18 0.01 OUTLIER Glycine 0 CA--C 1.527 0.805 0 CA-C-N 114.671 -1.149 . . . . 0.0 115.739 176.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.417 ' H ' ' C ' ' A' ' 18' ' ' TYR . 18.1 m -115.69 126.12 53.7 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 118.658 1.229 . . . . 0.0 112.996 -178.024 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.552 ' HB1' ' HB2' ' A' ' 13' ' ' PRO . . . -87.43 104.89 16.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.087 179.051 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -128.25 -169.41 2.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.126 0.488 . . . . 0.0 111.69 -178.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.9 t -139.68 140.73 36.94 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.974 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -161.86 155.86 21.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.085 0.469 . . . . 0.0 111.285 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.492 ' HB1' ' HB2' ' A' ' 34' ' ' LEU . . . -79.5 166.46 21.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.594 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.0 t -134.74 158.21 44.72 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 0.431 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 1.6 p-10 -77.33 -168.89 1.23 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.007 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.52 HG22 ' HG ' ' A' ' 29' ' ' LEU . 11.0 m -65.24 -44.67 95.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.632 -179.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.52 ' HG ' HG22 ' A' ' 28' ' ' VAL . 29.1 mt -78.16 -19.29 54.28 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -178.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.77 -15.44 31.62 Favored Glycine 0 CA--C 1.521 0.416 0 C-N-CA 120.541 -0.838 . . . . 0.0 113.697 179.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.5 t -101.68 108.14 23.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 117.302 0.551 . . . . 0.0 111.181 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.431 ' HB3' ' HB3' ' A' ' 27' ' ' ASP . . . 179.51 171.33 1.0 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.124 0.488 . . . . 0.0 111.322 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -139.41 93.45 2.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.769 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.492 ' HB2' ' HB1' ' A' ' 25' ' ' ALA . 1.7 mt -125.08 134.67 52.41 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.548 -178.623 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.3 t70 52.94 86.24 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.198 179.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 m -108.46 133.93 51.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.964 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -156.32 -178.09 7.07 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.937 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -83.31 138.21 42.06 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.541 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -90.1 114.56 0.54 Allowed 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.814 2.343 . . . . 0.0 111.928 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -90.44 114.0 0.48 Allowed 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 121.982 1.788 . . . . 0.0 112.783 -179.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.482 ' HB2' ' HG1' ' A' ' 52' ' ' THR . . . -175.48 -179.28 1.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.532 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.6 m -108.2 88.12 2.66 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 177.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -61.41 123.18 17.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.284 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.64 -40.61 2.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.906 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -152.92 -168.36 3.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.045 179.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.473 ' HB2' ' HG ' ' A' ' 80' ' ' LEU . . . -64.94 -44.05 90.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.257 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 41.3 m -70.4 -41.94 72.31 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.798 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -60.49 -33.85 73.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.118 0.485 . . . . 0.0 109.856 179.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -69.27 -35.76 76.41 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.975 179.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -67.02 -32.12 73.13 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.216 179.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.5 t -76.2 -12.89 60.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.776 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.482 ' HG1' ' HB2' ' A' ' 41' ' ' ALA . 52.4 m -73.81 -40.93 63.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.075 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 7.4 m -86.16 -31.95 21.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.51 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.8 -19.93 63.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.659 0.742 . . . . 0.0 109.825 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.03 -39.22 93.04 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.925 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.4 pt -103.34 0.79 10.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -179.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.18 43.13 3.09 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.318 -0.944 . . . . 0.0 113.58 178.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -150.63 -175.03 4.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 117.097 0.448 . . . . 0.0 110.995 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -120.66 153.99 36.12 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.976 0.417 . . . . 0.0 111.122 -179.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.59 126.2 30.56 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.241 -179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -149.64 155.41 40.2 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.044 0.45 . . . . 0.0 110.925 179.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.617 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 33.6 t -121.44 104.76 9.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.18 -179.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . 0.525 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 5.0 m -109.95 145.0 37.65 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.197 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.709 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.3 OUTLIER -90.81 146.02 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.742 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.426 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.5 mt -49.95 138.65 18.38 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.451 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 27.3 Cg_exo -62.65 138.53 70.29 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.589 2.193 . . . . 0.0 112.556 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.403 HD11 ' O ' ' A' ' 66' ' ' PRO . 50.3 mm -130.82 108.4 15.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.658 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.65 109.98 0.33 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.266 -179.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.14 -12.46 6.42 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.643 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -136.95 168.9 18.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.416 0.627 . . . . 0.0 111.25 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -82.22 166.82 19.26 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.113 179.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.403 HG21 ' O ' ' A' ' 72' ' ' ILE . 18.6 tt -83.44 124.49 39.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 121.065 0.459 . . . . 0.0 110.995 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.579 ' O ' HG13 ' A' ' 64' ' ' VAL . 4.0 mm? -98.94 113.7 25.98 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.705 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 43.6 t -161.55 138.67 8.65 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.623 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . 0.401 HE21 ' HB2' ' A' ' 75' ' ' GLN . 0.0 OUTLIER -159.93 163.3 34.34 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.95 179.793 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.3 m -90.2 126.62 56.29 Favored Pre-proline 0 CA--C 1.531 0.218 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.182 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -53.57 108.89 0.3 Allowed 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.679 2.252 . . . . 0.0 113.178 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.82 34.06 18.39 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.55 179.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 62.49 20.95 61.92 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.924 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.473 ' HG ' ' HB2' ' A' ' 46' ' ' ALA . 0.6 OUTLIER . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.775 -0.631 . . . . 0.0 111.063 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 54.0 m . . . . . 0 N--CA 1.485 1.296 0 CA-C-O 120.615 0.245 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -57.4 110.52 0.62 Allowed 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.689 2.26 . . . . 0.0 112.229 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.536 ' HB2' ' HB2' ' A' ' 6' ' ' GLU . . . -102.06 99.35 9.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.308 -179.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -96.26 -22.35 17.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.828 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 15.0 ptm -110.61 -38.84 5.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.622 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.536 ' HB2' ' HB2' ' A' ' 3' ' ' ALA . 19.1 mt-10 -63.16 -43.16 99.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.277 -179.723 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.2 ptm180 -166.71 86.67 0.3 Allowed 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.775 0.798 . . . . 0.0 110.731 -179.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -51.11 144.56 8.92 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.86 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.671 HG11 ' HD2' ' A' ' 10' ' ' PRO . 4.0 t -86.29 141.31 34.72 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.004 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.671 ' HD2' HG11 ' A' ' 9' ' ' VAL . 68.4 Cg_exo -31.3 121.45 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 124.006 3.137 . . . . 0.0 113.366 -179.176 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 1.595 ' HE2' ' CE1' ' A' ' 11' ' ' TYR . 26.5 t80 -47.95 144.55 3.5 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.028 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 97.6 m -156.74 97.38 2.13 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.359 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -78.47 166.14 24.43 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.673 2.249 . . . . 0.0 112.387 179.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 48.15 -163.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.318 0.58 . . . . 0.0 111.946 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.585 ' O ' ' O ' ' A' ' 16' ' ' GLY . 14.0 m -133.36 -157.57 0.82 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.711 -179.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.585 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -19.42 -149.78 0.0 OUTLIER Glycine 0 CA--C 1.532 1.096 0 N-CA-C 119.084 2.394 . . . . 0.0 119.084 -179.368 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.474 HD11 ' O ' ' A' ' 17' ' ' LEU . 1.2 tm? -23.21 -43.13 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -177.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 1.632 ' HE2' ' CE1' ' A' ' 18' ' ' TYR . 3.7 m-85 -68.55 -35.92 78.08 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.207 -0.597 . . . . 0.0 112.208 -176.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.31 -10.98 0.01 OUTLIER Glycine 0 CA--C 1.527 0.816 0 N-CA-C 115.554 0.982 . . . . 0.0 115.554 176.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.457 ' H ' ' C ' ' A' ' 18' ' ' TYR . 32.5 m -125.13 145.9 49.73 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 118.591 1.196 . . . . 0.0 112.162 -178.163 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -111.73 109.15 18.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.794 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.576 ' HA ' HE21 ' A' ' 22' ' ' GLN . 0.1 OUTLIER -129.07 -172.03 2.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.153 0.501 . . . . 0.0 111.673 -178.787 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.1 t -135.93 105.59 6.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.79 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.477 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 2.3 m -126.76 151.8 47.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.964 0.411 . . . . 0.0 111.712 -178.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -89.32 166.37 13.8 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.046 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.9 t -121.76 157.21 31.51 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -179.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -86.18 -170.26 3.01 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.418 -179.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.522 HG22 ' HG ' ' A' ' 29' ' ' LEU . 6.4 m -61.1 -45.12 99.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.407 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.522 ' HG ' HG22 ' A' ' 28' ' ' VAL . 24.0 mt -79.9 -20.72 45.14 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.606 0.241 . . . . 0.0 111.446 -179.094 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.63 -18.07 32.65 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 120.674 -0.774 . . . . 0.0 113.7 179.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.439 ' O ' ' HB3' ' A' ' 32' ' ' ALA . 39.5 t -101.96 107.72 22.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 117.497 0.649 . . . . 0.0 111.058 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 31' ' ' VAL . . . 174.81 171.16 0.25 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.029 0.442 . . . . 0.0 111.401 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -133.15 85.71 2.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.585 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 mt -109.03 137.01 47.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.043 -178.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.6 t70 41.63 81.23 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.075 178.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.477 ' HB2' ' HB3' ' A' ' 24' ' ' CYS . 49.1 t -128.03 139.76 52.36 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.342 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -155.71 -173.19 4.43 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.243 -179.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -64.93 133.1 95.66 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.85 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . 0.411 ' HD3' HE21 ' A' ' 22' ' ' GLN . 90.7 Cg_endo -90.46 110.04 0.38 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.89 2.393 . . . . 0.0 111.922 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -90.75 115.13 0.47 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.24 1.96 . . . . 0.0 112.887 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.05 -179.14 1.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.784 178.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 34.9 m -105.87 88.52 2.83 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 177.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.15 123.18 19.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.449 -178.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.9 -40.64 2.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.826 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -151.49 -168.23 3.03 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.037 179.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.64 -49.8 71.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.415 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.8 m -65.17 -40.81 94.8 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.806 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -60.65 -32.34 71.51 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.814 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -69.37 -37.95 77.83 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.938 178.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.0 -41.19 97.57 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.954 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.4 m -64.44 -20.06 65.93 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.416 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 51.8 m -69.52 -39.18 77.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.534 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 2.5 m -87.72 -32.6 19.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.816 -179.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.21 -19.37 63.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.674 0.749 . . . . 0.0 109.686 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.5 -39.11 88.51 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.399 -1.273 . . . . 0.0 112.446 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.9 pt -105.85 3.03 10.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.71 42.7 3.06 Favored Glycine 0 CA--C 1.523 0.563 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.784 178.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -151.32 -174.56 4.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 117.041 0.421 . . . . 0.0 110.717 179.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.2 mtp180 -125.47 153.79 43.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.798 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -67.66 118.83 11.46 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.005 -179.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -130.48 123.79 30.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.855 0.359 . . . . 0.0 110.52 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . 0.659 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 3.4 t -96.31 107.68 20.07 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 57.8 m -105.78 151.03 24.98 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.538 0.685 . . . . 0.0 112.635 -178.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.694 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -105.3 150.33 8.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.483 179.569 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.402 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 1.2 tp -50.35 122.76 15.83 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.137 -179.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 24.3 Cg_exo -65.31 139.53 60.28 Favored 'Trans proline' 0 C--N 1.355 0.921 0 C-N-CA 122.481 2.121 . . . . 0.0 112.516 -179.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.423 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 48.2 mm -131.38 112.63 21.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.486 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -46.93 108.91 0.16 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.792 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.94 -14.56 5.71 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.525 -179.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 3.2 pt20 -129.07 166.55 19.03 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.534 0.683 . . . . 0.0 111.265 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -82.49 162.21 22.13 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.225 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.418 ' O ' HG21 ' A' ' 72' ' ' ILE . 17.0 tt -83.35 121.02 35.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.138 0.494 . . . . 0.0 111.004 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.511 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.9 mm? -95.13 107.92 20.01 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.959 -179.581 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.408 ' SG ' HG12 ' A' ' 72' ' ' ILE . 69.7 m -144.79 130.35 18.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.11 -179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -160.37 161.91 33.24 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.879 0.371 . . . . 0.0 110.86 179.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.424 HG21 ' HD2' ' A' ' 77' ' ' PRO . 86.5 m -85.97 135.24 37.72 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.163 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.424 ' HD2' HG21 ' A' ' 76' ' ' THR . 93.7 Cg_endo -86.04 142.42 7.59 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.736 2.29 . . . . 0.0 112.644 -179.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 65.17 1.54 1.58 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.842 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.14 36.57 64.0 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.405 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.7 mt . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.253 -0.879 . . . . 0.0 111.012 179.801 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.463 0.18 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 80.0 p -95.08 115.83 27.93 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.07 -154.63 22.02 Favored Glycine 0 N--CA 1.436 -1.314 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.733 -177.181 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.478 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.5 tm? -65.58 -40.49 92.78 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.327 -0.436 . . . . 0.0 110.783 177.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.764 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -76.54 -36.96 57.38 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.442 0.639 . . . . 0.0 111.595 -178.804 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.64 -8.92 0.02 OUTLIER Glycine 0 CA--C 1.525 0.671 0 CA-C-N 114.763 -1.108 . . . . 0.0 114.794 177.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.423 ' H ' ' C ' ' A' ' 18' ' ' TYR . 7.6 m -112.61 154.59 25.79 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 118.174 0.987 . . . . 0.0 111.929 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.88 107.57 12.86 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.256 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.507 ' HA ' ' HG3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -137.71 -169.86 2.63 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -179.195 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.516 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 60.1 m -134.28 119.84 19.22 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.501 -179.462 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.495 ' HB3' ' HD3' ' A' ' 61' ' ' ARG . 1.1 t -128.43 -179.8 5.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.958 0.408 . . . . 0.0 110.927 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.508 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -115.2 164.71 13.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.873 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.7 t -130.46 157.68 41.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.512 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.407 ' H ' ' HB3' ' A' ' 32' ' ' ALA . 0.8 OUTLIER -80.56 -170.67 2.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.545 -179.194 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.529 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.7 m -62.63 -47.0 95.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.721 -179.328 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.529 ' HG ' HG23 ' A' ' 28' ' ' VAL . 32.5 mt -76.2 -19.68 58.18 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.39 -13.39 33.31 Favored Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.702 -0.761 . . . . 0.0 113.451 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.602 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.6 p -100.36 108.18 22.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 117.156 0.478 . . . . 0.0 111.103 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.542 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 172.58 161.27 0.12 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.637 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -131.24 63.07 1.61 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.632 179.306 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.508 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 3.8 mt -82.59 135.54 35.04 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.83 -178.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.1 t70 50.37 81.62 0.06 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.679 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -109.34 129.56 55.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.461 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -166.25 172.64 10.93 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.102 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -66.52 145.2 98.93 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.444 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.516 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 57.1 Cg_endo -91.19 121.37 0.69 Allowed 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.864 2.376 . . . . 0.0 112.657 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -90.7 112.11 0.4 Allowed 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 121.684 1.589 . . . . 0.0 112.025 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -176.63 -175.83 0.67 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.748 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 36.5 m -109.05 88.27 2.69 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -64.35 123.98 20.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.555 -178.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.474 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.6 -33.35 3.84 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.955 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.465 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 6.9 p30 -163.86 -179.5 6.35 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.099 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.59 -58.46 6.27 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -179.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.4 m -60.3 -35.79 76.39 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.804 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.474 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.9 t60 -62.43 -34.5 76.9 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.981 179.477 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.409 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 25.7 t80 -70.15 -35.96 74.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.394 179.181 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -67.01 -31.23 71.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.063 0.458 . . . . 0.0 110.138 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.8 t -76.59 -17.74 59.03 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.389 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 60.0 m -73.35 -42.5 62.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.988 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.4 m -80.79 -26.77 36.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.223 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.22 -20.1 55.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.437 0.637 . . . . 0.0 110.302 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.88 -36.08 80.23 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.923 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.4 pt -108.96 11.42 8.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 84.3 41.6 7.87 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.489 -0.862 . . . . 0.0 113.393 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -140.95 177.93 7.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.855 0.327 . . . . 0.0 110.878 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -117.2 162.95 17.04 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.878 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.409 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -85.98 118.42 25.45 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.746 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.593 HH21 ' HB3' ' A' ' 74' ' ' CYS . 12.9 ptm180 -147.55 125.74 12.2 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.164 0.507 . . . . 0.0 110.211 179.203 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.472 ' HB2' ' CD2' ' A' ' 18' ' ' TYR . 5.5 m -85.88 106.22 16.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.261 -178.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.415 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 65.2 m -98.0 142.61 29.51 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.229 0.538 . . . . 0.0 111.904 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.764 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -93.83 144.3 9.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.444 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.448 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.5 mt -49.43 137.14 16.59 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.535 -178.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 37.9 Cg_exo -61.42 138.13 74.38 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.71 2.273 . . . . 0.0 112.617 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 51.3 mm -130.3 108.17 15.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.375 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.65 109.36 0.31 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.12 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.68 -13.68 5.84 Favored Glycine 0 C--N 1.333 0.38 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.773 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -135.16 168.48 19.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.451 0.643 . . . . 0.0 111.161 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -81.29 169.3 17.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.294 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 20.2 tt -84.09 132.27 31.94 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-O 120.813 0.34 . . . . 0.0 110.876 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.553 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.5 mm? -109.82 132.15 54.41 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.789 0.328 . . . . 0.0 110.622 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.593 ' HB3' HH21 ' A' ' 61' ' ' ARG . 0.5 OUTLIER -160.14 135.39 8.05 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.339 179.406 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -153.11 163.13 40.43 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.63 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.458 HG23 ' HD2' ' A' ' 77' ' ' PRO . 54.4 m -96.38 139.47 21.72 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.654 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' PRO . . . . . 0.458 ' HD2' HG23 ' A' ' 76' ' ' THR . 64.1 Cg_endo -75.49 125.22 8.86 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.28 1.987 . . . . 0.0 113.144 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 57.19 23.83 9.09 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.801 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 63.62 33.76 88.12 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.559 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.6 tp . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.282 -179.552 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.39 0 CA-C-O 120.987 0.422 . . . . 0.0 110.675 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 75.3 p -98.29 117.13 31.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.532 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 173.77 -155.22 21.56 Favored Glycine 0 N--CA 1.434 -1.47 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.744 -178.026 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.496 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.4 tm? -66.75 -38.64 87.02 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.216 -0.492 . . . . 0.0 110.966 178.335 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.749 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -79.07 -39.24 34.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.833 -178.252 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.79 -11.5 0.01 OUTLIER Glycine 0 CA--C 1.528 0.855 0 CA-C-N 114.97 -1.014 . . . . 0.0 115.285 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.517 HG22 ' HG2' ' A' ' 22' ' ' GLN . 6.6 m -105.94 131.14 53.61 Favored 'General case' 0 N--CA 1.46 0.074 0 CA-C-N 118.383 1.091 . . . . 0.0 112.372 -178.204 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -100.98 99.53 10.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.544 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.517 ' HG2' HG22 ' A' ' 20' ' ' THR . 24.1 mm-40 -126.31 -174.57 3.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.88 0.371 . . . . 0.0 111.003 -179.34 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.585 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 58.3 m -135.51 107.76 7.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.298 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.14 151.56 51.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.886 0.374 . . . . 0.0 111.143 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.41 169.65 16.72 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.593 -178.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.4 t -126.35 158.13 36.67 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.635 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -76.87 -169.86 1.43 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.451 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.543 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.6 m -65.74 -46.04 90.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.699 -179.557 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.543 ' HG ' HG23 ' A' ' 28' ' ' VAL . 30.6 mt -75.46 -19.8 59.22 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -178.636 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.82 -18.33 29.29 Favored Glycine 0 CA--C 1.521 0.464 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.765 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.41 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 46.8 t -101.51 107.81 22.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 117.603 0.702 . . . . 0.0 111.033 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 175.94 172.74 0.35 Allowed 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.049 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -141.38 84.23 1.9 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.91 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.7 mt -104.38 134.95 46.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.682 -178.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 51.53 84.14 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.006 178.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.5 t -122.76 137.77 54.82 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.826 0.346 . . . . 0.0 111.005 179.213 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -159.76 -178.4 7.04 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -65.85 124.62 88.07 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.825 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.585 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 93.7 Cg_endo -85.84 122.17 2.23 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.506 2.137 . . . . 0.0 112.087 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -91.25 113.73 0.39 Allowed 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.113 1.875 . . . . 0.0 112.508 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.53 179.12 1.5 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 179.001 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 32.1 m -106.89 88.07 2.66 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.5 mt -63.36 121.2 13.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.411 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.483 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.62 -34.46 3.59 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.71 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.47 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.1 p30 -162.77 -179.18 6.64 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.238 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.88 -59.84 3.7 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.937 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.6 m -60.27 -36.33 77.57 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.745 -179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.483 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.7 t60 -62.78 -32.44 73.61 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.947 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.533 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 13.8 t80 -71.34 -38.65 71.64 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.103 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.08 -31.86 73.1 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 121.058 0.456 . . . . 0.0 110.149 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.3 t -75.51 -13.38 60.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.958 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 74.2 m -78.06 -44.04 27.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.077 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.492 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 36.2 m -82.95 -26.94 30.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.986 -179.622 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.49 -20.18 58.92 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.501 0.667 . . . . 0.0 110.186 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.81 -37.24 86.95 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.744 -1.117 . . . . 0.0 112.077 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.0 pt -106.01 11.29 8.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.42 40.36 6.07 Favored Glycine 0 CA--C 1.522 0.492 0 C-N-CA 120.493 -0.861 . . . . 0.0 114.235 178.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -148.44 -178.1 6.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 117.263 0.531 . . . . 0.0 111.059 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -122.98 154.81 37.93 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.168 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.533 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -69.57 119.91 14.55 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.689 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -139.6 125.3 19.44 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.563 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.602 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 15.4 t -98.72 99.54 10.66 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.503 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 3.8 m -109.1 141.37 41.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.257 0.551 . . . . 0.0 112.33 -177.668 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.749 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.3 OUTLIER -87.48 144.12 9.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.457 179.873 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.4 mt -49.52 136.43 17.62 Favored Pre-proline 0 N--CA 1.462 0.165 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.359 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 37.5 Cg_exo -61.1 133.92 49.81 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.497 2.132 . . . . 0.0 112.531 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.4 mm -128.17 106.14 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.6 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.18 110.98 0.38 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.18 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.49 -13.97 5.87 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.464 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -138.18 166.86 23.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.41 0.624 . . . . 0.0 111.144 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -80.46 164.63 22.89 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.288 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.5 tt -83.43 125.2 40.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.05 0.452 . . . . 0.0 110.952 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.626 ' O ' HG12 ' A' ' 64' ' ' VAL . 4.0 mm? -100.66 115.73 30.92 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.9 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 42.2 t -161.27 140.45 10.18 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.251 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -160.7 168.24 25.26 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.384 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 72.9 m -100.69 124.65 41.54 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.325 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -69.45 141.2 45.85 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.403 2.069 . . . . 0.0 112.72 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.47 -0.85 0.64 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.246 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.9 36.84 65.39 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.397 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 28.6 mt . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.191 -0.909 . . . . 0.0 111.193 179.849 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.1 t . . . . . 0 C--O 1.232 0.158 0 CA-C-O 121.148 0.499 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.624 ' O ' ' O ' ' A' ' 16' ' ' GLY . 87.6 p -134.18 -156.99 0.77 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.392 -179.382 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.624 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -18.52 -147.71 0.0 OUTLIER Glycine 0 CA--C 1.532 1.146 0 N-CA-C 118.251 2.06 . . . . 0.0 118.251 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.481 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -22.85 -42.07 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 115.402 1.63 . . . . 0.0 115.402 -177.675 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.577 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 5.7 m-85 -69.37 -36.46 76.84 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.275 -0.57 . . . . 0.0 112.264 -177.259 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.69 -14.43 0.01 OUTLIER Glycine 0 CA--C 1.531 1.034 0 N-CA-C 115.708 1.043 . . . . 0.0 115.708 177.358 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.434 ' H ' ' C ' ' A' ' 18' ' ' TYR . 23.3 m -129.54 153.92 47.55 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 118.576 1.188 . . . . 0.0 112.175 -178.307 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -115.31 114.97 25.88 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.976 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -132.63 -169.88 2.33 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.128 0.489 . . . . 0.0 111.646 -178.395 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.458 ' HB2' ' HB3' ' A' ' 39' ' ' PRO . 5.6 t -147.27 131.11 17.05 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.115 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.543 ' HB2' ' HD2' ' A' ' 61' ' ' ARG . 36.7 m -147.34 165.83 28.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.967 0.413 . . . . 0.0 111.498 -179.096 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.35 168.77 10.86 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.385 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.427 ' HB ' HH21 ' A' ' 59' ' ' ARG . 5.7 t -122.98 156.82 33.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.72 -179.401 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -85.0 -169.61 2.73 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.234 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.584 HG23 ' HG ' ' A' ' 29' ' ' LEU . 8.2 m -60.93 -46.29 96.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.571 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.584 ' HG ' HG23 ' A' ' 28' ' ' VAL . 24.8 mt -80.21 -20.4 44.77 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 111.636 0.235 . . . . 0.0 111.636 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.32 -16.38 32.2 Favored Glycine 0 CA--C 1.522 0.509 0 C-N-CA 120.716 -0.754 . . . . 0.0 113.52 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 61.0 t -101.4 108.38 23.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 117.192 0.496 . . . . 0.0 111.178 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.35 167.41 0.81 Allowed 'General case' 0 N--CA 1.461 0.119 0 CA-C-O 120.967 0.413 . . . . 0.0 111.336 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -130.36 76.29 1.71 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.834 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 mt -102.95 143.21 32.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.976 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 30.3 t70 45.52 83.48 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.946 178.286 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 52.0 m -109.66 130.28 55.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.211 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -156.99 -176.18 5.84 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.053 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -79.33 133.32 60.46 Favored Pre-proline 0 CA--C 1.533 0.304 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.685 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.458 ' HB3' ' HB2' ' A' ' 23' ' ' CYS . 93.5 Cg_endo -89.07 119.97 1.03 Allowed 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.72 2.28 . . . . 0.0 111.931 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -91.27 114.34 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.32 2.013 . . . . 0.0 113.105 -179.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.455 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.58 179.98 1.34 Allowed 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.939 178.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.6 m -106.72 88.47 2.76 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.2 mt -62.47 121.56 13.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.277 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.506 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.55 -34.44 3.61 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.553 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.454 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.0 p30 -162.89 -177.91 5.79 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.103 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.88 -61.25 2.33 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.245 -0.434 . . . . 0.0 112.011 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.7 m -59.55 -36.42 76.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.846 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.506 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.2 t60 -63.03 -33.33 75.19 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -67.73 -34.85 77.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.741 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -67.78 -42.3 81.87 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.055 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 57.0 m -63.26 -18.07 63.18 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.297 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.455 HG23 ' CB ' ' A' ' 41' ' ' ALA . 48.5 m -70.85 -40.68 72.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.486 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 32.6 m -86.66 -31.47 21.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.791 -179.331 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.53 -19.71 63.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.657 0.741 . . . . 0.0 109.542 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.49 -39.86 88.97 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.417 -1.265 . . . . 0.0 112.117 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 16.1 pt -101.41 1.25 10.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.43 40.66 5.34 Favored Glycine 0 CA--C 1.522 0.511 0 C-N-CA 120.282 -0.961 . . . . 0.0 113.289 179.206 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -143.41 -172.12 3.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.782 0.291 . . . . 0.0 110.826 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.427 HH21 ' HB ' ' A' ' 26' ' ' THR . 50.6 mtm180 -119.96 152.15 37.87 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.743 0.306 . . . . 0.0 111.119 -179.34 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -82.72 122.76 28.58 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.763 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.543 ' HD2' ' HB2' ' A' ' 24' ' ' CYS . 4.2 ptm180 -140.19 140.26 35.86 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-O 120.627 0.251 . . . . 0.0 110.564 -179.538 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -106.39 119.57 39.6 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 55.5 m -110.21 149.21 30.45 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 121.424 0.63 . . . . 0.0 112.254 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.577 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -101.39 149.3 6.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.543 179.725 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.2 mt -49.6 137.46 17.41 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.364 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 33.1 Cg_exo -60.63 134.97 57.51 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.604 2.203 . . . . 0.0 112.801 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.457 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.8 mm -130.57 106.19 12.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.51 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.2 119.79 4.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.982 0.42 . . . . 0.0 111.278 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 118.94 -8.13 12.76 Favored Glycine 0 CA--C 1.518 0.229 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.826 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.457 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 12.2 pt20 -139.24 168.5 19.69 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.477 0.656 . . . . 0.0 111.218 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -82.99 168.9 16.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.311 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.417 HG12 ' SG ' ' A' ' 74' ' ' CYS . 16.3 tt -83.4 124.81 39.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-O 120.922 0.391 . . . . 0.0 110.932 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.508 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.1 mm? -96.61 109.01 21.7 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.031 -179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.417 ' SG ' HG12 ' A' ' 72' ' ' ILE . 64.2 m -144.76 131.96 20.57 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.122 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -160.27 167.51 27.38 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.766 0.317 . . . . 0.0 110.941 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 49.4 m -82.86 137.47 43.73 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.87 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -83.67 136.22 7.23 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.378 2.052 . . . . 0.0 112.684 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 64.34 3.48 1.85 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.811 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.63 40.02 54.56 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.436 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.2 mt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.285 -0.864 . . . . 0.0 111.061 179.971 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.1 t . . . . . 0 CA--C 1.52 -0.187 0 CA-C-O 121.408 0.623 . . . . 0.0 111.664 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.596 ' O ' ' O ' ' A' ' 16' ' ' GLY . 10.6 m -129.11 -156.08 0.74 Allowed 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.136 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.596 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -17.2 -147.7 0.0 OUTLIER Glycine 0 CA--C 1.533 1.182 0 N-CA-C 118.655 2.222 . . . . 0.0 118.655 -179.534 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.451 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.7 OUTLIER -22.15 -45.96 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -176.846 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.636 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 6.4 m-85 -69.26 -37.23 77.81 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.927 -0.709 . . . . 0.0 112.031 -177.363 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.92 -12.26 0.01 OUTLIER Glycine 0 CA--C 1.529 0.952 0 N-CA-C 116.545 1.378 . . . . 0.0 116.545 176.388 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.473 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 52.6 m -138.16 138.11 38.29 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.139 1.469 . . . . 0.0 112.839 -177.791 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -106.18 125.87 51.52 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.407 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.537 ' HA ' ' HG3' ' A' ' 39' ' ' PRO . 67.1 mm-40 -147.56 176.31 10.16 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.78 0.324 . . . . 0.0 111.525 -178.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.442 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 75.7 m -122.82 116.41 23.64 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.999 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.652 ' HB2' ' HD2' ' A' ' 61' ' ' ARG . 60.2 m -132.44 159.95 37.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.016 0.436 . . . . 0.0 111.431 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.431 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -83.47 167.57 17.32 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.893 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.4 t -123.78 156.67 35.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.597 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -87.73 -170.59 3.07 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.339 -179.515 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.562 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.5 m -60.61 -44.88 97.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.428 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.562 ' HG ' HG23 ' A' ' 28' ' ' VAL . 24.0 mt -80.55 -20.47 43.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.701 0.286 . . . . 0.0 111.279 -179.278 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.69 -18.97 31.54 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 120.827 -0.701 . . . . 0.0 113.792 178.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.4 t -101.81 108.49 23.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 117.286 0.543 . . . . 0.0 111.255 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -179.68 168.34 1.37 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.048 0.451 . . . . 0.0 111.377 179.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -128.97 82.79 2.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.756 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.431 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.0 mt -110.48 137.35 48.3 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.017 -178.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 48.02 84.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.874 178.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 51.4 m -109.6 129.94 55.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.631 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -151.55 163.86 38.1 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.413 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.402 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 7.2 p30 -57.92 133.12 83.42 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.473 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.537 ' HG3' ' HA ' ' A' ' 22' ' ' GLN . 97.5 Cg_endo -90.67 113.45 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.87 2.38 . . . . 0.0 112.302 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -90.5 113.3 0.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 121.919 1.746 . . . . 0.0 112.495 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.79 -178.42 1.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.632 178.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.6 m -110.17 88.37 2.74 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 177.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.8 mt -64.79 119.77 11.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.432 -178.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.41 ' H ' ' HB3' ' A' ' 48' ' ' HIS . . . -116.55 -40.69 3.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.761 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -152.82 -168.69 3.11 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.723 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.78 -39.37 94.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.993 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 46.6 m -71.04 -47.98 55.47 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.863 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.41 ' HB3' ' H ' ' A' ' 44' ' ' ALA . 2.1 t-160 -57.22 -31.22 65.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.081 0.467 . . . . 0.0 109.753 179.373 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -70.48 -39.56 74.15 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.077 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -62.99 -38.58 91.72 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 121.244 0.545 . . . . 0.0 109.912 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 56.9 m -68.29 -16.06 63.81 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.291 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 94.2 m -75.74 -43.31 47.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.549 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.436 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 68.5 m -85.88 -23.46 27.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.346 -179.372 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.83 -20.0 43.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.259 0.552 . . . . 0.0 110.467 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.22 -39.93 93.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.158 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.1 pt -100.4 9.39 8.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.54 42.95 5.65 Favored Glycine 0 CA--C 1.522 0.477 0 C-N-CA 120.415 -0.898 . . . . 0.0 114.108 178.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -146.21 -177.42 5.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.362 0.581 . . . . 0.0 111.081 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 49.1 mtm180 -116.99 151.56 36.48 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.991 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.436 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -80.99 122.24 27.05 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.665 -179.374 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.652 ' HD2' ' HB2' ' A' ' 24' ' ' CYS . 9.5 ptp180 -145.72 125.58 13.52 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.948 0.404 . . . . 0.0 110.135 179.23 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.582 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.0 t -92.41 107.36 19.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.785 -179.068 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 93.0 m -98.21 150.88 21.03 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 121.281 0.563 . . . . 0.0 111.842 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.636 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -98.27 150.14 4.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.876 179.833 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.413 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.4 mt -49.32 138.07 15.18 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.371 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.421 ' O ' HD13 ' A' ' 67' ' ' ILE . 29.4 Cg_exo -62.13 132.98 41.53 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 122.537 2.158 . . . . 0.0 112.581 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.496 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 49.8 mm -131.74 104.71 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.739 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.43 ' HA ' HD12 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -50.71 121.08 5.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.266 -179.905 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 118.51 -11.19 12.57 Favored Glycine 0 CA--C 1.517 0.182 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.77 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 12.5 pt20 -135.33 167.41 21.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.484 0.659 . . . . 0.0 111.347 -179.791 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -81.65 167.64 18.98 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.493 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.4 tt -83.79 124.5 39.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.045 0.45 . . . . 0.0 110.927 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.543 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.5 mm? -101.2 128.47 47.3 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.293 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -160.72 132.57 5.88 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.28 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -151.61 166.11 32.22 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.847 0.356 . . . . 0.0 110.685 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 54.0 m -95.28 138.04 22.0 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.498 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -81.73 137.61 10.15 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.23 1.953 . . . . 0.0 112.756 -179.242 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.04 2.53 1.05 Allowed 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.928 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.47 38.64 61.99 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.285 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 28.6 mt . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.201 -0.904 . . . . 0.0 111.187 -179.919 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.1 m -94.42 116.7 29.1 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.2 -167.25 40.19 Favored Glycine 0 N--CA 1.439 -1.115 0 C-N-CA 120.565 -0.826 . . . . 0.0 113.244 -177.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.53 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.9 tm? -57.91 -37.08 73.38 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.571 -0.815 . . . . 0.0 110.656 178.079 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.769 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -82.93 -37.14 24.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.249 -177.978 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.28 -13.15 0.02 OUTLIER Glycine 0 CA--C 1.528 0.902 0 N-CA-C 115.558 0.983 . . . . 0.0 115.558 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.466 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 20.7 m -107.29 124.36 49.67 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 118.589 1.194 . . . . 0.0 112.202 -178.781 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -89.35 105.22 17.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.026 -179.249 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.451 ' HG2' HG22 ' A' ' 20' ' ' THR . 24.7 mm-40 -130.12 -179.18 5.08 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.082 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.581 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 83.6 m -129.85 117.44 20.2 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.03 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -135.48 160.38 38.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.084 0.468 . . . . 0.0 111.415 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.505 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -85.22 167.0 16.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.732 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.8 t -131.88 157.49 43.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.765 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -80.14 -170.37 2.46 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.059 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.565 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.9 m -63.58 -44.39 98.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.516 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.565 ' HG ' HG23 ' A' ' 28' ' ' VAL . 25.4 mt -79.53 -20.11 47.95 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -178.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.43 -17.56 31.0 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 120.636 -0.792 . . . . 0.0 113.873 179.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 40.1 t -101.4 108.07 22.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 117.493 0.647 . . . . 0.0 111.028 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 177.14 172.0 0.51 Allowed 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.248 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -135.82 96.78 3.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.834 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.505 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.1 mt -124.78 134.6 52.73 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.644 -178.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.7 t70 51.55 83.93 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.515 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.5 m -109.12 129.98 55.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.481 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -153.76 177.4 11.03 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.809 0.338 . . . . 0.0 111.357 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -74.98 137.47 72.87 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.45 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.581 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 65.4 Cg_endo -89.64 112.34 0.52 Allowed 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.83 2.354 . . . . 0.0 112.402 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -90.48 113.53 0.46 Allowed 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 121.897 1.731 . . . . 0.0 112.218 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.52 -177.7 1.03 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.812 179.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 34.7 m -108.0 88.04 2.64 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 177.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.5 mt -64.88 126.71 28.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.653 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.37 -40.34 2.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.864 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -150.27 -167.72 2.9 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.008 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.33 -41.69 76.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.24 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 42.3 m -69.74 -40.17 76.34 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.707 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -60.15 -33.68 72.51 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.445 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 24.9 t80 -67.65 -39.07 84.61 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.61 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -60.24 -38.77 84.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.297 0.57 . . . . 0.0 109.489 178.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 66.3 m -69.83 -22.39 63.29 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.167 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 70.9 m -67.99 -44.51 76.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.45 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.555 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 57.8 m -79.49 -26.25 41.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.296 -179.604 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.63 -20.37 56.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.454 0.645 . . . . 0.0 110.084 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.64 -37.71 88.52 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 114.881 -1.054 . . . . 0.0 112.097 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.2 pt -102.76 2.44 10.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -178.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.92 41.62 3.76 Favored Glycine 0 CA--C 1.523 0.532 0 C-N-CA 120.288 -0.958 . . . . 0.0 113.903 178.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -148.52 -178.31 6.26 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 117.219 0.509 . . . . 0.0 111.08 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -119.03 152.68 35.99 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.115 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.555 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -65.43 117.25 7.67 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.523 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 14.1 mtp180 -134.16 113.25 11.84 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.005 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.636 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 13.9 t -90.85 107.48 19.21 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.545 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 55.5 m -103.41 148.94 25.29 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -178.262 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.769 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -103.67 145.71 12.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.656 -179.784 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.432 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.8 mt -50.14 138.54 19.6 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.352 -179.624 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 32.2 Cg_exo -62.04 138.06 70.7 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.622 2.215 . . . . 0.0 112.483 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.462 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.4 mm -131.37 107.69 13.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.628 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -48.96 120.0 3.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.002 0.43 . . . . 0.0 111.273 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 117.88 -12.42 13.24 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.852 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 11.8 pt20 -134.93 167.35 21.07 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.606 0.717 . . . . 0.0 111.547 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -82.12 170.2 15.76 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.638 -1.164 . . . . 0.0 110.348 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.0 tt -82.81 127.56 39.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.941 0.401 . . . . 0.0 110.735 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.529 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.8 mm? -101.87 112.7 25.41 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 120.894 0.378 . . . . 0.0 111.259 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 77.8 m -147.22 129.08 15.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.859 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.38 169.86 22.22 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.788 0.327 . . . . 0.0 110.749 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 57.6 m -92.07 136.75 25.59 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.718 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -84.94 141.28 8.32 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.518 2.145 . . . . 0.0 113.077 -179.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.75 3.02 1.06 Allowed 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.883 179.524 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.62 38.4 67.93 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.357 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 38.6 mt . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.112 179.921 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 25.6 p . . . . . 0 N--CA 1.467 0.383 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.3 m -95.22 117.67 30.66 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.29 -166.38 39.16 Favored Glycine 0 N--CA 1.44 -1.066 0 C-N-CA 120.549 -0.834 . . . . 0.0 113.326 -177.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.531 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.8 tm? -56.23 -37.39 69.65 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.523 -0.839 . . . . 0.0 110.714 178.033 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.79 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -82.65 -39.2 22.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.894 -178.204 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.76 -9.47 0.01 OUTLIER Glycine 0 CA--C 1.528 0.864 0 CA-C-N 115.072 -0.967 . . . . 0.0 115.469 176.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.56 HG22 ' HG2' ' A' ' 22' ' ' GLN . 24.7 m -109.81 123.0 48.79 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 118.382 1.091 . . . . 0.0 112.491 -178.216 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -86.85 102.51 14.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.793 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.56 ' HG2' HG22 ' A' ' 20' ' ' THR . 25.4 mm-40 -125.27 -170.01 2.09 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.819 -179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.5 t -144.08 121.14 11.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.792 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.09 159.82 41.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.932 0.396 . . . . 0.0 111.206 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -88.64 166.89 13.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.9 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.418 ' HB ' ' NH2' ' A' ' 59' ' ' ARG . 10.3 t -124.94 157.49 35.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.791 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -81.73 -169.78 2.51 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.184 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.55 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.4 m -63.43 -45.32 98.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.653 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.55 ' HG ' HG23 ' A' ' 28' ' ' VAL . 26.8 mt -77.79 -20.1 53.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.583 0.23 . . . . 0.0 111.474 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.87 -17.66 32.39 Favored Glycine 0 CA--C 1.522 0.53 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.567 179.004 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.415 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 43.9 t -101.99 107.99 22.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 117.301 0.55 . . . . 0.0 111.092 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 176.11 171.77 0.39 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.01 0.434 . . . . 0.0 111.326 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -136.16 86.45 2.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.53 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -110.59 136.4 49.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.873 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.4 t70 51.71 86.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.35 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -108.74 133.76 52.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.87 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -157.55 -178.51 7.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.927 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -82.89 138.75 43.08 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.965 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -88.89 113.1 0.64 Allowed 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.656 2.237 . . . . 0.0 111.991 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -90.59 114.15 0.46 Allowed 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 122.21 1.94 . . . . 0.0 112.639 -179.401 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.4 -178.22 1.11 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.721 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.9 m -108.05 88.72 2.8 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 177.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mt -63.61 123.0 17.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.358 -178.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.49 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.35 -33.86 3.78 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.739 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.485 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.2 p30 -163.04 -178.97 6.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.979 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.15 -59.63 3.98 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.943 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 44.5 m -60.84 -37.42 82.02 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.834 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.49 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.8 t60 -61.86 -31.29 71.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.054 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.439 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 17.8 t80 -72.07 -40.81 68.03 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.099 179.234 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.499 ' HB2' HD22 ' A' ' 80' ' ' LEU . 30.9 tt0 -62.12 -27.19 68.76 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.051 0.453 . . . . 0.0 110.0 178.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 31.2 t -76.43 -23.77 53.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.47 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 66.5 m -67.31 -38.38 84.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.889 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 3.9 m -85.04 -30.87 23.77 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.317 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.56 -19.7 61.45 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.517 0.675 . . . . 0.0 109.795 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.97 -38.01 89.55 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 114.702 -1.136 . . . . 0.0 112.1 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pt -106.87 6.72 9.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 112.627 0.602 . . . . 0.0 112.627 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.36 44.47 5.28 Favored Glycine 0 CA--C 1.523 0.59 0 C-N-CA 120.385 -0.912 . . . . 0.0 113.864 178.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -147.56 -177.93 5.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 117.346 0.573 . . . . 0.0 111.082 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.418 ' NH2' ' HB ' ' A' ' 26' ' ' THR . 30.6 mtm180 -117.83 155.8 29.48 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.276 -179.309 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.439 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -71.41 118.72 14.58 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.848 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.0 mmt180 -138.17 114.89 10.62 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.039 0.447 . . . . 0.0 111.859 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.613 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 28.7 t -89.82 111.11 22.03 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.591 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 63.6 m -107.92 149.3 28.5 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.79 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -101.64 143.09 15.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 114.937 -1.029 . . . . 0.0 110.475 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.7 mt -50.38 137.04 23.03 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.351 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.417 ' O ' HD13 ' A' ' 67' ' ' ILE . 38.9 Cg_exo -61.24 137.39 70.47 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.485 2.123 . . . . 0.0 112.415 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.47 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 47.8 mm -131.94 109.94 16.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.421 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 68' ' ' LEU . 2.1 pt? -48.18 117.21 1.83 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.292 0.567 . . . . 0.0 110.883 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 120.12 -10.66 10.9 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.487 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.47 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 11.7 pt20 -138.83 168.44 19.81 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.527 0.679 . . . . 0.0 111.219 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -88.03 168.95 12.38 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.822 -1.081 . . . . 0.0 110.306 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.2 tt -83.22 125.25 40.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.919 0.39 . . . . 0.0 110.701 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.583 ' HB2' HG11 ' A' ' 64' ' ' VAL . 3.9 mm? -97.82 111.39 23.7 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.321 -179.342 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 77.0 m -139.39 129.34 24.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.708 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -155.84 164.75 38.13 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.807 0.337 . . . . 0.0 110.926 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.415 ' CG2' ' HB2' ' A' ' 80' ' ' LEU . 92.7 m -100.4 121.98 51.44 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.84 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.99 127.36 23.02 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.413 2.075 . . . . 0.0 111.849 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.26 -115.1 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.099 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -141.26 37.3 1.65 Allowed Glycine 0 N--CA 1.438 -1.188 0 C-N-CA 120.852 -0.69 . . . . 0.0 113.739 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.499 HD22 ' HB2' ' A' ' 50' ' ' GLU . 20.3 mt . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.291 -0.862 . . . . 0.0 110.708 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.488 ' SG ' ' HA ' ' A' ' 21' ' ' ALA . 1.1 m . . . . . 0 CA--C 1.52 -0.208 0 CA-C-O 120.967 0.413 . . . . 0.0 111.164 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.593 ' O ' ' O ' ' A' ' 16' ' ' GLY . 95.5 p -119.47 -159.07 0.76 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.113 0.782 . . . . 0.0 113.113 -178.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.593 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -20.93 -149.8 0.0 OUTLIER Glycine 0 CA--C 1.529 0.95 0 N-CA-C 118.825 2.29 . . . . 0.0 118.825 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.574 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.7 tm? -23.27 -38.18 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 115.417 1.636 . . . . 0.0 115.417 -178.191 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.753 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 1.7 m-85 -67.97 -36.6 80.33 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.121 -0.631 . . . . 0.0 112.078 -177.113 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.36 -17.73 0.01 OUTLIER Glycine 0 CA--C 1.53 0.988 0 N-CA-C 115.416 0.927 . . . . 0.0 115.416 177.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.473 ' H ' ' C ' ' A' ' 18' ' ' TYR . 41.3 m -116.79 151.5 36.34 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 118.388 1.094 . . . . 0.0 112.0 -178.287 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.488 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . . . -116.63 111.43 19.85 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.773 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -135.11 -179.61 5.73 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.53 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.573 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 61.8 m -131.33 108.29 9.55 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.028 179.136 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.452 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 3.3 m -116.61 157.77 24.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.125 -179.007 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.468 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -88.06 165.46 15.14 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.2 t -128.54 157.05 42.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.926 0.393 . . . . 0.0 111.973 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -86.53 -170.22 2.99 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.026 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.536 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.3 m -61.09 -45.13 99.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.357 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.536 ' HG ' HG23 ' A' ' 28' ' ' VAL . 30.2 mt -77.81 -20.35 53.39 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 -179.013 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.38 -14.36 33.07 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 120.541 -0.838 . . . . 0.0 113.643 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.5 t -101.95 108.14 23.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 117.249 0.524 . . . . 0.0 111.033 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.91 152.1 0.34 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.958 0.409 . . . . 0.0 111.539 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -120.76 60.89 0.89 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.261 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.468 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.6 mt -88.57 138.25 31.59 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.364 -0.834 . . . . 0.0 112.433 -178.199 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.6 t70 39.64 81.22 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.552 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.452 ' HB2' ' HB3' ' A' ' 24' ' ' CYS . 37.0 t -128.89 152.17 48.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.056 0.455 . . . . 0.0 111.055 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -170.17 -172.94 1.4 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.05 -179.139 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -65.12 136.31 96.59 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.557 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.573 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.7 Cg_endo -90.39 114.69 0.5 Allowed 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.882 2.388 . . . . 0.0 112.483 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -91.35 113.76 0.38 Allowed 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.097 1.865 . . . . 0.0 112.255 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.65 -175.55 0.79 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.004 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.1 m -109.68 88.51 2.76 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.8 mt -64.95 123.5 19.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.115 -178.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.484 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.34 -31.36 4.38 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.484 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.7 p30 -164.68 -177.36 4.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.627 0.251 . . . . 0.0 111.137 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.558 ' HB1' HD21 ' A' ' 80' ' ' LEU . . . -52.72 -58.66 6.14 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.868 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 23.7 m -62.25 -37.1 84.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.894 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.484 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.9 t60 -61.52 -33.1 73.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.859 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.419 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 22.0 t80 -70.82 -40.04 72.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.165 179.24 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -64.03 -32.19 73.65 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.09 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.4 m -71.76 -24.29 61.74 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.21 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 52.2 m -66.86 -43.43 83.58 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.391 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.493 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 60.8 m -79.19 -26.78 42.6 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.477 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.62 -20.06 54.48 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.448 0.642 . . . . 0.0 110.372 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.09 -37.82 88.84 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.153 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.3 pt -104.5 4.97 10.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.18 42.08 4.12 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.381 -0.914 . . . . 0.0 113.953 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -148.81 -178.12 6.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 117.309 0.555 . . . . 0.0 111.278 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 77.0 mtp180 -118.46 162.5 18.24 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.056 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.493 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -76.27 119.35 20.04 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.129 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -138.36 110.18 7.17 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.947 0.403 . . . . 0.0 111.468 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.422 ' HB3' ' HB2' ' A' ' 18' ' ' TYR . 48.9 m -79.07 99.91 7.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.558 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 42.6 m -96.61 138.76 33.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.496 0.665 . . . . 0.0 111.874 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.753 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -96.88 146.92 6.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.497 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.7 mt -49.42 136.31 16.99 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.382 -179.377 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 33.2 Cg_exo -60.34 136.8 70.43 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.543 2.162 . . . . 0.0 112.929 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.483 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.9 mm -129.07 104.79 11.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.271 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.25 120.1 2.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.005 0.431 . . . . 0.0 111.235 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 117.01 -10.25 15.4 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.622 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.483 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 11.2 pt20 -137.85 168.36 19.86 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.585 0.707 . . . . 0.0 111.41 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -84.58 170.0 13.84 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.277 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.429 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.5 tt -82.99 126.32 40.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.965 0.412 . . . . 0.0 110.729 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.534 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.0 mm? -97.46 110.81 23.29 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.177 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.429 ' SG ' HG12 ' A' ' 72' ' ' ILE . 50.0 m -146.02 130.82 18.06 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.123 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -160.61 165.67 30.29 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.784 0.325 . . . . 0.0 110.754 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 50.4 m -81.01 136.55 50.38 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.961 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -87.37 137.6 4.35 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.619 2.212 . . . . 0.0 112.887 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.29 2.71 0.89 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.904 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.05 41.84 53.28 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.375 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.558 HD21 ' HB1' ' A' ' 46' ' ' ALA . 36.2 mt . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.24 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.463 0.18 0 CA-C-O 122.018 0.913 . . . . 0.0 112.86 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.582 ' O ' ' O ' ' A' ' 16' ' ' GLY . 1.8 m -101.13 -154.02 0.47 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.738 -1.119 . . . . 0.0 112.914 -176.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.582 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -13.32 -145.34 0.0 OUTLIER Glycine 0 CA--C 1.529 0.941 0 N-CA-C 118.355 2.102 . . . . 0.0 118.355 -179.097 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.438 HD22 ' HA ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -20.0 -47.62 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 -176.179 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.485 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 2.6 m-85 -69.85 -38.62 76.51 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.016 0.825 . . . . 0.0 111.369 -178.318 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 16' ' ' GLY . . . 56.23 -12.52 0.01 OUTLIER Glycine 0 CA--C 1.527 0.831 0 N-CA-C 116.092 1.197 . . . . 0.0 116.092 176.437 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.421 HG22 ' N ' ' A' ' 21' ' ' ALA . 21.2 m -135.31 155.41 50.67 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.849 1.325 . . . . 0.0 112.852 -177.688 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.424 ' HB1' ' CZ ' ' A' ' 49' ' ' PHE . . . -116.33 103.66 10.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.346 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -124.86 -169.51 2.0 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.872 0.368 . . . . 0.0 111.279 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.9 t -142.14 139.08 32.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.246 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -155.8 171.08 20.64 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.975 0.417 . . . . 0.0 111.181 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.36 168.59 10.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.802 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.1 t -133.9 157.79 45.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.79 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -81.91 -169.86 2.57 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.282 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.522 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.2 m -63.04 -45.08 99.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.737 -179.479 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.522 ' HG ' HG23 ' A' ' 28' ' ' VAL . 26.5 mt -78.38 -20.4 51.32 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.598 0.222 . . . . 0.0 111.598 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.27 -15.82 32.69 Favored Glycine 0 CA--C 1.522 0.491 0 C-N-CA 120.636 -0.793 . . . . 0.0 113.558 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.3 t -101.42 107.56 21.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 117.26 0.53 . . . . 0.0 110.932 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.99 166.62 0.93 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.069 0.462 . . . . 0.0 111.429 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -133.51 89.09 2.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.558 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -119.82 135.83 54.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.696 -178.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.7 t70 51.51 83.83 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.364 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.6 m -108.86 133.01 53.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.7 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -159.47 -179.03 7.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.141 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -78.49 140.3 59.89 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.005 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -90.69 113.86 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 122.906 2.404 . . . . 0.0 111.904 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -90.22 113.51 0.49 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 121.893 1.728 . . . . 0.0 112.845 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.422 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -176.16 -177.59 0.91 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.936 178.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.2 m -108.72 88.88 2.83 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 177.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.3 mt -64.2 124.93 22.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.678 -178.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.514 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.97 -33.01 3.83 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.862 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.473 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.5 p30 -163.5 -177.28 5.16 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.113 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.01 -59.23 4.59 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.929 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 23.0 m -61.82 -38.43 88.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.871 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.514 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.7 t60 -61.17 -32.26 71.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.03 0.443 . . . . 0.0 109.845 179.543 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.431 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 17.7 t80 -69.94 -37.03 75.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.12 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.66 -32.85 74.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.286 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.2 t -70.55 -20.54 62.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.508 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.422 HG23 ' CB ' ' A' ' 41' ' ' ALA . 54.4 m -68.45 -44.02 75.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.118 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 19.0 m -81.11 -28.44 35.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.493 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.85 -19.58 62.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.554 0.693 . . . . 0.0 109.717 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.49 -38.85 90.97 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 114.653 -1.158 . . . . 0.0 112.17 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.8 pt -105.27 8.39 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -179.076 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.63 38.78 10.24 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 120.438 -0.886 . . . . 0.0 113.452 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -139.21 -175.93 4.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.719 0.26 . . . . 0.0 110.866 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 77.3 mtp180 -120.46 155.36 33.7 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 121.008 0.433 . . . . 0.0 111.903 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.431 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -84.97 124.96 32.28 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.022 -179.46 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.541 ' HE ' ' HB3' ' A' ' 74' ' ' CYS . 13.8 ptm180 -149.49 125.16 10.41 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.131 0.491 . . . . 0.0 110.909 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 31.8 m -85.26 99.61 11.24 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.719 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 59.9 m -90.94 143.21 26.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.331 0.586 . . . . 0.0 111.265 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.528 ' CG1' ' HB2' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -99.77 146.38 8.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.662 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 7.0 mt -49.43 133.09 18.2 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.502 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 24.3 Cg_exo -64.27 139.76 67.45 Favored 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 122.615 2.21 . . . . 0.0 112.596 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 51.0 mm -129.08 109.55 18.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.231 179.525 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.26 109.16 0.17 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.827 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.46 -13.49 6.22 Favored Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.611 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -133.51 167.71 19.96 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.524 0.678 . . . . 0.0 111.227 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -83.22 169.61 15.57 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.654 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.8 tt -83.19 126.89 40.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.719 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.528 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.1 mm? -101.96 112.21 24.76 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.965 0.412 . . . . 0.0 111.284 -179.387 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.541 ' HB3' ' HE ' ' A' ' 61' ' ' ARG . 63.4 m -143.99 135.09 25.51 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.703 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -158.26 171.24 20.55 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.947 0.403 . . . . 0.0 111.013 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.5 m -99.08 137.01 20.38 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.696 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -87.67 142.16 5.76 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.545 2.163 . . . . 0.0 112.821 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.58 6.5 2.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.782 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.92 36.09 73.16 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.26 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 38.5 mt . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.008 179.902 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.4 t . . . . . 0 CA--C 1.52 -0.211 0 CA-C-O 121.147 0.498 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.592 ' O ' ' O ' ' A' ' 16' ' ' GLY . 87.5 p -120.25 -156.35 0.66 Allowed 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.529 -178.53 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.592 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -17.01 -146.92 0.0 OUTLIER Glycine 0 CA--C 1.53 0.981 0 N-CA-C 118.349 2.1 . . . . 0.0 118.349 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.524 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.1 tm? -22.03 -41.41 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 115.19 1.552 . . . . 0.0 115.19 -177.474 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.613 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 2.0 m-85 -69.13 -36.91 78.0 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.093 -0.643 . . . . 0.0 111.947 -177.64 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.87 -14.09 0.02 OUTLIER Glycine 0 CA--C 1.528 0.853 0 N-CA-C 115.495 0.958 . . . . 0.0 115.495 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.454 ' H ' ' C ' ' A' ' 18' ' ' TYR . 28.2 m -140.26 144.89 36.7 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 118.471 1.135 . . . . 0.0 112.215 -178.426 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.433 ' HB1' ' CZ ' ' A' ' 49' ' ' PHE . . . -108.59 112.56 24.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.707 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.46 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 16.8 mm-40 -131.32 -175.91 3.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.0 0.429 . . . . 0.0 111.216 -179.388 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.569 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 71.0 m -127.56 109.97 12.25 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.032 179.336 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.536 ' HB2' ' HD3' ' A' ' 61' ' ' ARG . 59.2 m -127.59 155.92 43.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.094 0.474 . . . . 0.0 111.416 -179.08 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -86.42 165.41 16.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.584 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.7 t -126.43 157.22 39.16 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.478 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -80.78 -170.34 2.61 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.106 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.547 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.0 m -62.93 -45.53 98.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.547 ' HG ' HG23 ' A' ' 28' ' ' VAL . 28.0 mt -78.46 -20.17 51.53 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.647 0.261 . . . . 0.0 111.615 -178.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.29 -16.11 32.45 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.631 -0.795 . . . . 0.0 113.784 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.3 t -101.49 108.11 22.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 117.163 0.481 . . . . 0.0 111.191 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.21 167.17 0.78 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 121.106 0.479 . . . . 0.0 111.492 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -133.04 85.94 2.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.464 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -114.2 141.9 46.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.983 -178.235 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 46.8 82.1 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.863 178.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 34.2 m -110.0 129.64 55.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.929 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -153.18 -178.07 6.71 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.056 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -78.28 134.86 62.28 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.553 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.569 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.1 Cg_endo -89.61 114.61 0.6 Allowed 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.832 2.355 . . . . 0.0 112.053 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -90.7 112.87 0.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 121.885 1.724 . . . . 0.0 112.342 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -176.0 -176.55 0.83 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.756 179.231 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 42.6 m -111.22 88.58 2.82 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.3 mt -61.44 122.03 14.17 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.397 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.464 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.4 -32.84 4.0 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.94 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.469 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.1 p30 -165.41 -178.92 5.21 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 120.756 0.312 . . . . 0.0 111.307 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.14 -60.14 3.25 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 112.007 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 32.0 m -60.97 -36.57 79.76 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.857 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.469 ' HB3' ' H ' ' A' ' 45' ' ' ASN . 1.6 t60 -62.76 -31.73 72.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.77 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.435 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 13.2 t80 -70.17 -38.66 75.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.958 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -64.55 -34.67 78.8 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.426 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.2 t -72.92 -13.06 61.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.061 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 87.1 m -80.3 -40.83 26.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.232 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.451 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 72.8 m -85.93 -25.43 26.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.261 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.4 -19.91 52.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.363 0.602 . . . . 0.0 110.357 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.7 -37.72 88.56 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.051 -0.977 . . . . 0.0 112.278 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.1 pt -103.28 7.33 9.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.58 40.97 5.22 Favored Glycine 0 CA--C 1.522 0.493 0 C-N-CA 120.408 -0.901 . . . . 0.0 114.041 178.39 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -146.77 -179.03 6.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.344 0.572 . . . . 0.0 111.142 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 44.0 mtp180 -116.81 153.55 32.27 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.111 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.451 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -77.32 121.22 23.42 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.569 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.558 HH21 ' HB2' ' A' ' 74' ' ' CYS . 13.4 ptm180 -155.6 115.58 3.71 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 121.23 0.538 . . . . 0.0 110.551 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 20' ' ' THR . 33.5 m -79.11 103.21 8.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.745 -179.062 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 23.4 m -94.12 123.94 37.82 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 121.435 0.636 . . . . 0.0 111.572 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.665 HG11 ' HB2' ' A' ' 73' ' ' LEU . 1.5 p -72.85 148.05 9.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.182 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.437 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 7.9 mt -51.88 137.32 35.5 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.931 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 31.2 Cg_exo -60.37 124.78 15.84 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.386 2.057 . . . . 0.0 112.369 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.48 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.0 mm -124.85 101.67 9.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.565 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -48.33 120.21 3.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.14 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.2 -12.18 11.41 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.63 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 12.0 pt20 -135.27 168.45 19.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.396 0.617 . . . . 0.0 111.137 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -84.35 166.25 17.56 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.252 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.454 HG12 ' SG ' ' A' ' 74' ' ' CYS . 15.9 tt -83.31 126.91 40.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.807 0.337 . . . . 0.0 110.575 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.665 ' HB2' HG11 ' A' ' 64' ' ' VAL . 4.0 mm? -99.55 102.22 13.68 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.589 -179.234 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.558 ' HB2' HH21 ' A' ' 61' ' ' ARG . 44.3 m -137.81 131.63 31.44 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.803 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -160.32 163.44 33.32 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.745 0.307 . . . . 0.0 111.218 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.6 m -99.99 116.79 64.31 Favored Pre-proline 0 CA--C 1.532 0.274 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.11 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.21 136.73 61.84 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.663 2.242 . . . . 0.0 112.722 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.25 1.67 0.74 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.05 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.83 38.79 65.65 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.252 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 36.0 mt . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.155 -0.926 . . . . 0.0 111.104 179.934 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.3 t . . . . . 0 N--CA 1.472 0.662 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.8 p -95.42 115.32 27.26 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 171.31 -165.72 38.77 Favored Glycine 0 N--CA 1.44 -1.074 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.272 -177.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.532 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.7 tm? -61.67 -36.37 80.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.631 -0.784 . . . . 0.0 110.337 177.612 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.808 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -81.58 -36.01 29.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.256 -178.167 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.79 -11.56 0.02 OUTLIER Glycine 0 CA--C 1.529 0.919 0 N-CA-C 115.859 1.104 . . . . 0.0 115.859 177.296 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.602 HG22 ' HG2' ' A' ' 22' ' ' GLN . 16.3 m -111.3 126.96 55.46 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 118.792 1.296 . . . . 0.0 112.613 -178.668 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -96.55 101.35 12.95 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.816 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.602 ' HG2' HG22 ' A' ' 20' ' ' THR . 28.1 mm-40 -128.52 -174.74 3.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.935 0.397 . . . . 0.0 111.145 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.615 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 64.3 m -134.8 114.75 12.93 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.123 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.82 161.42 32.98 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.983 0.421 . . . . 0.0 111.164 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.494 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -87.94 166.34 14.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.675 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.0 t -131.05 157.64 42.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.814 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.11 -169.59 2.47 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.103 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.503 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.9 m -62.0 -47.14 94.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.747 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.503 ' HG ' HG23 ' A' ' 28' ' ' VAL . 33.2 mt -76.91 -19.99 56.74 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -178.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.98 -12.23 31.88 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.353 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.582 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.4 p -100.64 108.72 23.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 117.137 0.469 . . . . 0.0 111.255 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 172.72 153.72 0.08 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.881 -179.571 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -123.88 67.26 1.03 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.632 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.494 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.0 mt -90.3 135.76 33.48 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.466 -178.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 52.23 83.44 0.06 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.39 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.7 m -108.91 134.0 52.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.537 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -160.62 -178.28 6.77 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.838 0.351 . . . . 0.0 111.319 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 -81.33 136.82 49.08 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.725 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.615 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 68.4 Cg_endo -90.51 117.08 0.59 Allowed 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 123.034 2.489 . . . . 0.0 112.746 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -91.31 113.41 0.37 Allowed 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.052 1.835 . . . . 0.0 112.227 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.89 -178.57 1.06 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.833 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.9 m -109.27 88.09 2.65 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 177.571 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.0 mt -63.08 124.4 21.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.408 -178.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -117.8 -40.33 3.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.981 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -151.08 -168.41 3.09 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.985 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.89 -44.32 81.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.2 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.5 m -68.35 -39.22 81.94 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.552 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -60.25 -34.99 74.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.787 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.418 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 21.4 t80 -68.42 -39.07 81.73 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.932 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -61.78 -39.57 92.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.23 0.538 . . . . 0.0 109.746 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.1 m -68.09 -24.33 65.04 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.171 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 90.4 m -68.56 -43.52 76.45 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.304 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.531 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 59.0 m -78.74 -26.13 44.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.102 -179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.63 -19.93 54.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.4 0.619 . . . . 0.0 110.139 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.05 -37.29 86.89 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.983 -1.008 . . . . 0.0 112.043 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.3 pt -105.39 8.74 9.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 -178.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.67 42.72 5.67 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 120.413 -0.899 . . . . 0.0 114.015 178.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -147.83 -178.55 6.33 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 117.336 0.568 . . . . 0.0 111.192 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -120.31 153.15 36.82 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.338 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.531 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -67.99 117.67 10.16 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.704 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.3 mmm180 -136.02 115.24 12.48 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.988 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.708 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 23.0 t -93.29 109.28 20.81 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.554 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 76.7 m -104.67 148.67 26.31 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.22 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.808 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -99.02 148.32 6.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.761 179.861 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.424 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.2 mt -49.48 140.74 13.38 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.395 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.466 ' O ' HD13 ' A' ' 67' ' ' ILE . 33.0 Cg_exo -59.52 137.98 81.03 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.674 2.249 . . . . 0.0 112.495 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.466 HD13 ' O ' ' A' ' 66' ' ' PRO . 31.1 mm -131.97 108.56 14.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.308 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.414 HD12 ' HA ' ' A' ' 68' ' ' LEU . 0.7 OUTLIER -52.72 121.46 7.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.001 0.429 . . . . 0.0 111.406 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 114.76 -4.58 22.76 Favored Glycine 0 C--N 1.33 0.212 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.682 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 14.2 pt20 -148.67 165.4 31.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.324 0.583 . . . . 0.0 111.189 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -81.37 169.9 16.66 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.648 -179.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.3 tt -82.74 123.65 38.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.116 0.484 . . . . 0.0 110.502 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.526 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.1 mm? -90.52 110.93 22.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.254 -179.171 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 67.2 m -138.15 132.33 31.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.143 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.81 168.64 26.83 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.815 0.34 . . . . 0.0 110.611 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.0 m -96.73 137.25 21.42 Favored Pre-proline 0 CA--C 1.532 0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.761 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -83.48 139.49 9.07 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.418 2.079 . . . . 0.0 112.958 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.06 3.37 1.25 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.038 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.35 38.51 87.3 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.249 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 31.5 mt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.235 179.965 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.6 t . . . . . 0 CA--C 1.52 -0.192 0 CA-C-O 121.24 0.543 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.599 ' O ' ' O ' ' A' ' 16' ' ' GLY . 88.7 p -115.16 -156.4 0.6 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.588 -178.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.599 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -17.58 -148.35 0.0 OUTLIER Glycine 0 CA--C 1.529 0.933 0 N-CA-C 118.701 2.241 . . . . 0.0 118.701 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.491 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -23.23 -41.41 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -177.232 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.592 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 5.3 m-85 -68.3 -36.74 79.8 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 119.895 -0.722 . . . . 0.0 111.497 -177.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.2 -12.13 0.01 OUTLIER Glycine 0 CA--C 1.526 0.742 0 N-CA-C 115.644 1.018 . . . . 0.0 115.644 176.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.437 HG22 ' HG2' ' A' ' 22' ' ' GLN . 26.9 m -137.91 143.34 40.77 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 118.631 1.216 . . . . 0.0 112.451 -178.143 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.434 ' HB1' ' CZ ' ' A' ' 49' ' ' PHE . . . -110.6 106.39 15.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.554 179.531 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.477 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 20.0 mm-40 -126.18 -176.55 3.68 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.834 0.35 . . . . 0.0 111.309 -179.21 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.506 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 72.6 m -124.64 111.8 16.04 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.159 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.577 ' HB2' ' HD3' ' A' ' 61' ' ' ARG . 63.6 m -128.61 153.84 46.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.208 0.527 . . . . 0.0 111.566 -179.265 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.437 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -84.88 166.81 16.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.667 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.5 t -133.96 158.23 44.03 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.742 -179.486 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -77.99 -169.93 1.74 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.369 -179.475 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.536 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.3 m -64.25 -46.61 92.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.722 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.536 ' HG ' HG23 ' A' ' 28' ' ' VAL . 30.7 mt -75.91 -19.94 58.41 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -178.787 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.75 -15.29 31.76 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 120.589 -0.815 . . . . 0.0 113.625 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.4 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 40.4 t -101.49 107.83 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 117.28 0.54 . . . . 0.0 111.006 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 176.17 158.46 0.27 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.315 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -127.48 89.92 3.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.78 179.33 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.437 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.9 mt -116.73 141.91 47.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.798 -178.43 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.6 t70 48.9 83.3 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.679 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 35.8 m -112.78 131.1 55.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.018 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -161.66 -179.51 7.33 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.878 0.37 . . . . 0.0 111.099 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -73.26 133.16 81.28 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.271 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.506 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 63.7 Cg_endo -90.14 124.11 1.14 Allowed 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.807 2.338 . . . . 0.0 112.14 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -90.85 113.32 0.41 Allowed 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 121.88 1.72 . . . . 0.0 112.34 -179.702 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.75 -179.69 1.24 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.615 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 48.3 m -109.66 88.03 2.65 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 177.453 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.4 mt -61.84 120.73 11.29 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.201 -178.249 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.497 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.33 -33.39 3.89 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.904 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.476 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.1 p30 -165.14 -178.76 5.27 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.738 0.304 . . . . 0.0 111.288 -179.722 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.22 -60.71 2.57 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.213 -0.449 . . . . 0.0 112.1 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 22.0 m -60.1 -37.25 79.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.825 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.497 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.6 t60 -62.02 -32.63 73.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.929 179.411 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.439 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 11.0 t80 -69.51 -39.19 77.7 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.881 178.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -63.53 -38.39 90.96 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.009 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.9 m -67.16 -15.48 63.74 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.377 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 91.5 m -79.34 -41.4 27.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.517 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.455 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 74.8 m -86.04 -22.99 26.94 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.251 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.93 -20.02 42.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.388 0.613 . . . . 0.0 110.361 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.1 -37.78 88.68 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.054 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.6 pt -104.42 11.17 8.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.21 43.75 6.51 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.5 -0.857 . . . . 0.0 114.185 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -144.34 179.89 6.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 117.399 0.599 . . . . 0.0 111.136 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -115.32 145.6 42.33 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.195 -179.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.455 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -72.25 123.69 23.49 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.344 -179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.577 ' HD3' ' HB2' ' A' ' 24' ' ' CYS . 13.9 ptm180 -155.86 126.29 6.74 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.929 0.395 . . . . 0.0 110.507 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.406 ' HB3' ' O ' ' A' ' 20' ' ' THR . 25.5 m -90.45 100.74 13.53 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.961 -179.017 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.533 ' HA ' ' HB2' ' A' ' 74' ' ' CYS . 9.2 m -98.32 115.34 28.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.247 0.546 . . . . 0.0 112.234 -178.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.626 HG12 ' O ' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -65.64 146.25 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.466 179.212 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.5 mt -49.81 135.31 20.24 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.261 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -62.43 136.96 62.16 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.506 2.138 . . . . 0.0 112.574 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.491 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 51.2 mm -129.12 104.54 11.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.482 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.59 119.5 2.46 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.035 0.445 . . . . 0.0 111.16 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.43 -12.14 11.22 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.553 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 11.6 pt20 -135.21 168.46 19.11 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.486 0.66 . . . . 0.0 111.207 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -82.24 166.12 19.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.308 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.3 tt -83.53 124.65 39.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-O 120.951 0.405 . . . . 0.0 111.072 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.626 ' O ' HG12 ' A' ' 64' ' ' VAL . 3.7 mm? -101.19 109.42 21.3 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.849 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.533 ' HB2' ' HA ' ' A' ' 63' ' ' CYS . 51.3 t -161.78 133.65 5.59 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.515 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -160.95 171.88 17.91 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.099 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 74.4 m -77.7 136.97 62.88 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.665 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -84.09 134.41 6.04 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.398 2.066 . . . . 0.0 112.887 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.37 2.29 1.13 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.024 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 73.5 42.17 41.77 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.463 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 28.2 mt . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.148 179.907 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.481 1.124 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -93.73 116.95 29.46 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.0 -166.18 39.02 Favored Glycine 0 N--CA 1.439 -1.128 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.996 -177.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.523 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.7 tm? -59.05 -36.73 75.53 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.596 -0.802 . . . . 0.0 110.686 178.07 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.758 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -82.29 -37.58 25.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.141 -178.106 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.07 -12.34 0.02 OUTLIER Glycine 0 CA--C 1.529 0.911 0 N-CA-C 115.586 0.994 . . . . 0.0 115.586 177.296 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.529 HG22 ' HG2' ' A' ' 22' ' ' GLN . 17.9 m -109.1 123.87 49.88 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 118.625 1.212 . . . . 0.0 112.194 -178.664 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.2 102.29 14.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.931 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.529 ' HG2' HG22 ' A' ' 20' ' ' THR . 26.2 mm-40 -128.41 -174.22 3.17 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.051 0.453 . . . . 0.0 111.249 -179.28 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.571 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 70.9 m -128.03 116.14 19.56 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.031 179.327 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.556 ' HB2' ' HD3' ' A' ' 61' ' ' ARG . 78.2 m -129.77 158.49 39.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.068 0.461 . . . . 0.0 111.407 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.32 165.71 12.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.569 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.2 t -125.55 157.39 37.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.78 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -81.48 -170.1 2.62 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.224 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.529 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.3 m -62.65 -47.1 94.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.529 ' HG ' HG23 ' A' ' 28' ' ' VAL . 29.1 mt -77.65 -20.28 54.04 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.587 0.232 . . . . 0.0 111.531 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.21 -17.47 31.65 Favored Glycine 0 CA--C 1.522 0.483 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.696 179.018 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.415 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 49.0 t -101.61 108.07 22.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 117.276 0.538 . . . . 0.0 111.142 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 175.45 170.9 0.32 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.058 0.456 . . . . 0.0 111.328 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -133.28 95.05 3.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.58 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mt -120.53 140.52 51.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.892 -178.363 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.6 t70 48.1 82.53 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.795 178.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 47.1 m -113.13 129.79 56.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.821 179.405 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.76 -178.28 7.14 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.979 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -73.92 136.94 76.4 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.496 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.571 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.1 Cg_endo -89.47 117.17 0.75 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.826 2.35 . . . . 0.0 112.276 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -90.52 112.74 0.43 Allowed 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 121.765 1.643 . . . . 0.0 112.561 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -176.28 -176.35 0.77 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.647 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.6 m -110.84 88.54 2.8 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.425 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -63.09 124.32 20.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.382 -178.419 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.474 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.73 -33.72 3.73 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.75 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.476 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.8 p30 -163.2 -178.6 6.08 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.157 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.13 -59.68 3.92 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.333 -0.394 . . . . 0.0 112.005 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 35.0 m -61.54 -36.1 79.64 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.975 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.476 ' HB3' ' H ' ' A' ' 45' ' ' ASN . 1.9 t60 -62.44 -32.95 73.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.824 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.49 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 18.3 t80 -70.34 -39.56 74.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.944 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -60.63 -36.85 79.66 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.27 0.557 . . . . 0.0 109.773 178.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 51.1 m -67.34 -22.73 65.58 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.479 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 75.6 m -70.07 -43.77 70.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.551 -179.62 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.538 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 81.0 m -83.02 -24.94 32.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.189 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.96 -19.92 56.75 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.414 0.626 . . . . 0.0 110.115 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.97 -38.86 92.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.891 -1.049 . . . . 0.0 112.137 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.8 pt -101.76 9.91 8.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.41 39.47 6.33 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.554 -0.831 . . . . 0.0 114.225 178.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -146.41 -177.47 5.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 117.161 0.481 . . . . 0.0 111.131 179.378 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 58.3 mtt180 -119.97 154.96 33.73 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.682 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.538 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -65.9 119.61 11.62 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.364 -179.546 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.556 ' HD3' ' HB2' ' A' ' 24' ' ' CYS . 39.6 mtp180 -135.93 118.29 15.7 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.161 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.664 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 14.2 t -96.19 107.04 19.32 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.556 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 54.3 m -102.8 146.94 27.5 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.365 0.602 . . . . 0.0 112.548 -178.393 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.758 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -97.76 143.85 12.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.55 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.9 mt -49.66 139.55 15.64 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.212 -179.598 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 31.5 Cg_exo -59.28 132.8 48.71 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.54 2.16 . . . . 0.0 112.5 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.468 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 51.1 mm -129.55 106.94 14.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.763 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.21 120.47 5.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.301 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.07 -12.53 11.46 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.635 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.468 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 12.6 pt20 -135.44 167.25 21.42 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.504 0.668 . . . . 0.0 111.299 -179.771 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -81.84 169.87 16.36 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.218 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.1 tt -82.8 125.71 40.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.895 0.378 . . . . 0.0 110.928 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.559 ' HB2' HG11 ' A' ' 64' ' ' VAL . 3.8 mm? -101.61 113.01 25.76 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.01 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 72.5 m -146.45 129.12 16.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.048 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -160.87 170.13 21.28 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 120.867 0.365 . . . . 0.0 110.986 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 85.4 m -92.61 136.41 25.24 Favored Pre-proline 0 CA--C 1.532 0.28 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.001 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -86.89 144.36 7.3 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.685 2.257 . . . . 0.0 112.599 -179.626 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 68.36 -0.94 2.02 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.759 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.11 35.7 64.26 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.578 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 42.1 mt . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.253 -0.879 . . . . 0.0 111.172 179.934 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 14.6 p . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.876 0.369 . . . . 0.0 111.541 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.6 p -97.59 116.89 30.68 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 173.35 -155.17 21.92 Favored Glycine 0 N--CA 1.435 -1.387 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.57 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.483 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.8 tm? -62.96 -42.45 99.83 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.762 0.425 . . . . 0.0 111.225 178.478 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.802 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -78.1 -38.15 44.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.179 0.514 . . . . 0.0 112.028 -178.222 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.9 -8.92 0.02 OUTLIER Glycine 0 CA--C 1.527 0.785 0 CA-C-N 115.148 -0.933 . . . . 0.0 115.288 176.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.429 HG22 ' HG2' ' A' ' 22' ' ' GLN . 89.9 m -112.54 123.05 49.44 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 118.491 1.145 . . . . 0.0 112.546 -178.483 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.1 118.49 27.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.081 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.429 ' HG2' HG22 ' A' ' 20' ' ' THR . 77.5 mm-40 -146.52 167.79 22.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.858 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.508 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 60.8 m -117.45 113.29 21.83 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.09 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.09 156.35 49.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.018 0.437 . . . . 0.0 111.269 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.519 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -80.56 166.35 21.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.747 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.4 t -131.02 157.68 42.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.927 -179.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -82.17 -169.6 2.48 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.237 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.566 HG23 ' HG ' ' A' ' 29' ' ' LEU . 8.5 m -62.65 -46.16 97.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.612 -179.438 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.566 ' HG ' HG23 ' A' ' 28' ' ' VAL . 29.3 mt -78.42 -20.12 51.77 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 -178.912 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.43 -15.36 32.56 Favored Glycine 0 CA--C 1.52 0.402 0 C-N-CA 120.633 -0.794 . . . . 0.0 113.575 179.241 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.5 t -101.53 108.13 22.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 117.244 0.522 . . . . 0.0 111.181 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 177.68 168.39 0.68 Allowed 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.264 179.6 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.412 ' HB2' HD13 ' A' ' 72' ' ' ILE . 10.1 t70 -134.42 90.38 2.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.731 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.1 mt -118.6 135.91 54.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.605 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 51.9 84.08 0.05 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.349 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -109.29 134.96 51.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.863 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.7 164.24 36.09 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.182 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -60.92 136.01 93.24 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.914 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.508 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.7 Cg_endo -90.16 109.66 0.4 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.825 2.35 . . . . 0.0 112.3 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -91.21 113.88 0.39 Allowed 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.124 1.883 . . . . 0.0 112.741 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.417 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.47 -177.44 1.0 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.788 178.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.3 m -109.09 88.65 2.78 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.0 mt -65.61 120.16 12.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.352 -178.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -117.32 -40.58 3.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.791 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -151.99 -169.09 3.26 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.969 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.46 -48.48 77.53 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.423 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 27.8 m -66.75 -42.05 86.83 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.679 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -60.04 -32.82 71.27 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.173 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.535 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 13.9 t80 -68.54 -38.88 81.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.866 178.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -62.45 -37.39 85.7 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.143 0.497 . . . . 0.0 109.769 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.0 m -69.6 -13.37 62.28 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.616 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.417 HG23 ' CB ' ' A' ' 41' ' ' ALA . 49.8 m -75.08 -44.89 44.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.436 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.504 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 60.4 m -84.99 -25.52 27.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.974 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.3 -20.16 59.27 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.519 0.676 . . . . 0.0 109.921 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.46 -38.57 90.22 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.733 -1.121 . . . . 0.0 112.145 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.1 pt -100.98 -0.93 10.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.98 39.69 2.83 Favored Glycine 0 CA--C 1.521 0.446 0 C-N-CA 120.284 -0.96 . . . . 0.0 113.963 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -149.8 -177.21 5.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 117.057 0.428 . . . . 0.0 110.906 179.379 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 53.5 mtt180 -118.76 154.82 32.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.843 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.535 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -70.37 116.62 10.92 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.256 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.8 mmm180 -133.56 118.42 18.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.038 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.673 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 34.7 t -94.32 108.62 20.5 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.42 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.568 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 65.5 m -105.82 146.01 30.45 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.399 0.619 . . . . 0.0 112.551 -178.312 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.802 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -95.18 146.95 6.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.39 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.4 mt -49.49 135.64 17.78 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.369 -179.184 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 30.8 Cg_exo -62.32 136.47 59.85 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.571 2.18 . . . . 0.0 112.452 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.5 mm -129.92 109.02 17.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.417 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.54 109.29 0.29 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.058 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.97 -11.62 6.19 Favored Glycine 0 C--N 1.333 0.384 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.882 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -135.8 167.87 20.36 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.484 0.659 . . . . 0.0 111.41 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -81.39 166.95 19.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.301 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.412 HD13 ' HB2' ' A' ' 33' ' ' ASP . 17.9 tt -83.3 124.32 39.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 121.037 0.446 . . . . 0.0 110.803 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.529 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.0 mm? -97.68 110.39 22.96 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.224 -179.425 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 68.2 m -141.15 130.83 24.11 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.595 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -154.78 161.18 41.6 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.781 0.324 . . . . 0.0 110.874 -179.385 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 71.4 m -100.56 123.52 45.79 Favored Pre-proline 0 CA--C 1.533 0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.127 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -67.21 140.79 54.77 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.563 2.175 . . . . 0.0 112.714 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.11 2.32 1.04 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.061 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.68 35.07 73.41 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.408 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.3 mt . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.996 179.897 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.464 0.275 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.8 p -96.27 115.57 27.64 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.263 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.12 -155.08 22.94 Favored Glycine 0 N--CA 1.436 -1.31 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.397 -177.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.5 tm? -67.16 -40.13 86.6 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.899 0.381 . . . . 0.0 110.717 177.878 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.759 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.2 OUTLIER -75.23 -37.97 60.84 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.268 0.556 . . . . 0.0 111.422 -178.8 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.75 -9.44 0.02 OUTLIER Glycine 0 CA--C 1.524 0.651 0 CA-C-N 114.922 -1.035 . . . . 0.0 114.945 177.407 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.526 HG22 ' HG2' ' A' ' 22' ' ' GLN . 6.0 m -109.56 142.36 40.76 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 118.16 0.98 . . . . 0.0 112.212 -178.333 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -113.74 100.64 8.61 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.484 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.563 ' NE2' ' HA ' ' A' ' 38' ' ' ASN . 6.1 mm-40 -134.23 -177.74 4.72 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.919 0.39 . . . . 0.0 111.349 -178.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.511 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 56.9 m -126.34 106.82 9.78 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 178.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.438 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 2.0 m -109.08 154.46 22.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.604 -178.617 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -91.0 166.97 12.73 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.699 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.3 t -131.86 158.25 41.82 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -179.274 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.93 -169.63 2.09 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.198 -179.608 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.536 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.1 m -63.56 -46.34 95.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.676 -179.5 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.536 ' HG ' HG23 ' A' ' 28' ' ' VAL . 34.3 mt -76.25 -19.65 58.13 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -178.545 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.97 -13.29 31.81 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.566 -0.826 . . . . 0.0 113.497 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.416 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 61.1 t -101.45 108.05 22.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 117.132 0.466 . . . . 0.0 111.108 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 176.13 163.4 0.37 Allowed 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.406 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -134.56 65.95 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.431 179.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 mt -93.15 138.38 31.62 Favored 'General case' 0 C--O 1.226 -0.159 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.567 -178.081 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 43.95 83.42 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.769 177.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.438 ' HB2' ' HB3' ' A' ' 24' ' ' CYS . 21.0 t -133.33 136.38 45.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.91 0.386 . . . . 0.0 110.66 179.451 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -164.1 -174.87 3.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.503 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.563 ' HA ' ' NE2' ' A' ' 22' ' ' GLN . 6.3 p30 -58.43 126.35 78.67 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.702 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.511 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 68.4 Cg_endo -90.57 134.37 1.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 122.751 2.301 . . . . 0.0 112.293 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -91.66 113.76 0.36 Allowed 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.207 1.938 . . . . 0.0 112.839 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.406 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.63 -178.63 1.12 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.021 179.029 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.0 m -110.33 88.47 2.77 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 177.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.9 mt -64.56 120.15 11.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.41 -178.402 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -115.36 -40.94 3.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.78 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -152.01 -169.02 3.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.806 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.11 -41.56 94.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.221 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.1 m -70.61 -44.47 67.17 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.759 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -58.56 -34.88 71.53 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.177 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.447 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 13.5 t80 -67.32 -38.33 84.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.581 178.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -60.66 -40.51 92.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.222 0.535 . . . . 0.0 109.761 178.614 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.6 m -66.3 -23.85 66.45 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.442 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.406 HG23 ' CB ' ' A' ' 41' ' ' ALA . 66.4 m -63.97 -45.93 86.9 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.501 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 61.1 m -80.11 -28.75 38.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.25 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.92 -20.08 61.82 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.579 0.704 . . . . 0.0 109.948 -179.101 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.45 -36.61 84.72 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.876 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.3 pt -108.71 1.08 9.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -179.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.84 43.46 2.64 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 120.324 -0.941 . . . . 0.0 114.306 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -148.83 174.64 12.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 117.468 0.634 . . . . 0.0 110.923 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.437 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 11.7 ptm180 -119.01 142.18 48.04 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.766 0.317 . . . . 0.0 110.992 -179.682 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.447 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -60.51 125.77 24.92 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.167 -179.181 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.468 ' HB2' ' SG ' ' A' ' 74' ' ' CYS . 8.6 ptm180 -153.63 127.87 9.12 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.125 179.117 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.42 ' HB2' ' CD2' ' A' ' 18' ' ' TYR . 6.4 m -95.02 105.11 17.0 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.846 -178.294 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 3.9 m -105.58 136.24 45.52 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.12 0.486 . . . . 0.0 111.934 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.759 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -85.29 148.4 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.922 179.911 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.7 mt -49.5 137.7 16.59 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.126 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 37.2 Cg_exo -60.79 137.12 70.74 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 122.458 2.105 . . . . 0.0 112.464 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.462 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 51.1 mm -129.56 106.1 13.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.565 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.412 ' HA ' HD12 ' A' ' 68' ' ' LEU . 0.6 OUTLIER -47.63 120.69 3.47 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.379 -179.716 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 116.21 -11.93 16.91 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.718 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 11.1 pt20 -138.6 169.51 17.67 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.492 0.663 . . . . 0.0 111.335 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -84.4 165.34 18.27 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.968 179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.9 tt -83.66 122.97 38.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.206 0.527 . . . . 0.0 110.938 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.619 ' O ' HG12 ' A' ' 64' ' ' VAL . 4.1 mm? -92.53 115.33 28.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.571 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.468 ' SG ' ' HB2' ' A' ' 61' ' ' ARG . 51.7 t -161.03 137.63 8.59 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.572 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -160.34 167.39 27.54 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.199 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 84.1 m -87.79 137.11 31.95 Favored Pre-proline 0 CA--C 1.531 0.229 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.83 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -84.21 141.24 9.1 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 122.496 2.131 . . . . 0.0 112.902 -179.359 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.98 1.03 1.06 Allowed 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.05 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.02 37.92 64.07 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.32 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 37.1 mt . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.145 -179.951 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.463 0.219 0 CA-C-O 120.719 0.295 . . . . 0.0 111.738 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.6 p -95.34 115.5 27.52 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 178.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.46 -154.81 22.05 Favored Glycine 0 N--CA 1.436 -1.334 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.772 -177.646 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.463 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.6 tm? -66.32 -40.8 90.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.169 -0.515 . . . . 0.0 110.896 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.781 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -76.04 -37.84 57.86 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.495 0.664 . . . . 0.0 111.117 -179.055 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.87 -8.23 0.02 OUTLIER Glycine 0 CA--C 1.525 0.665 0 CA-C-N 114.733 -1.121 . . . . 0.0 114.8 177.356 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.536 HG22 ' HG2' ' A' ' 22' ' ' GLN . 23.3 m -108.72 142.98 38.44 Favored 'General case' 0 N--CA 1.457 -0.087 0 CA-C-N 118.016 0.908 . . . . 0.0 112.194 -178.572 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.445 ' O ' ' HG3' ' A' ' 39' ' ' PRO . . . -107.9 101.72 10.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.038 179.241 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.536 ' HG2' HG22 ' A' ' 20' ' ' THR . 27.8 mm-40 -126.33 -179.28 4.67 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 121.137 0.494 . . . . 0.0 111.505 -179.12 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.596 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 77.4 m -133.86 117.44 16.82 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.84 179.347 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.08 -179.04 5.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.843 0.354 . . . . 0.0 111.083 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.476 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -111.32 165.66 11.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.815 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.1 t -129.77 157.08 43.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.8 -179.519 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.07 -170.18 2.9 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.092 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.556 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.4 m -61.76 -45.97 97.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.672 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.556 ' HG ' HG23 ' A' ' 28' ' ' VAL . 30.3 mt -77.5 -20.08 54.87 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.59 -13.22 32.82 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.561 -0.828 . . . . 0.0 113.424 179.435 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.412 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 22.5 t -101.16 107.83 22.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 117.255 0.527 . . . . 0.0 110.957 179.575 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.412 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 174.46 154.36 0.13 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.177 179.761 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -123.55 59.54 1.11 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.76 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.476 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 3.3 mt -81.46 135.64 35.63 Favored 'General case' 0 C--O 1.227 -0.108 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.849 -178.745 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.0 t70 51.0 83.23 0.05 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.78 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.6 m -109.28 132.09 54.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.379 179.302 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.07 -177.1 6.31 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.892 0.377 . . . . 0.0 111.647 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -77.7 138.14 62.54 Favored Pre-proline 0 CA--C 1.532 0.27 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.357 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.596 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 62.6 Cg_endo -90.72 110.75 0.37 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.021 2.481 . . . . 0.0 112.993 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -91.5 113.69 0.37 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.002 1.802 . . . . 0.0 112.032 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.14 -178.38 1.19 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.985 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.2 m -110.53 88.68 2.83 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.3 mt -63.52 122.08 15.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.274 -178.439 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.507 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.36 -33.4 3.88 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.753 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.475 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.1 p30 -162.88 -178.05 5.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.073 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.62 -61.51 2.15 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.102 -179.389 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 34.2 m -60.81 -35.93 77.75 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.956 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.507 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.7 t60 -62.19 -32.93 73.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.016 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.493 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 29.3 t80 -71.08 -39.97 71.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.142 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -61.39 -35.63 78.05 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.219 0.533 . . . . 0.0 109.735 178.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.2 m -67.71 -24.0 65.34 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.195 179.722 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 51.6 m -65.03 -45.66 84.54 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.439 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.547 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 38.3 m -81.73 -26.17 34.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.14 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.27 -20.2 59.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.452 0.644 . . . . 0.0 110.151 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.59 -36.88 85.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.062 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.5 pt -107.48 14.2 8.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -179.064 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.34 41.9 8.22 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.421 -0.895 . . . . 0.0 113.546 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -143.71 -178.81 6.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 117.034 0.417 . . . . 0.0 111.074 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.449 ' HD3' HH21 ' A' ' 61' ' ' ARG . 99.2 mtt180 -122.99 151.59 41.7 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.406 -179.338 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.547 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -66.91 120.05 12.94 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.326 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.449 HH21 ' HD3' ' A' ' 59' ' ' ARG . 13.9 mmt180 -138.9 125.74 20.96 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.964 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 22.4 m -100.03 99.94 10.74 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.401 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 4.0 m -104.07 141.11 36.79 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -177.837 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.781 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.4 OUTLIER -97.77 144.11 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.181 179.255 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.1 mt -53.25 135.08 50.92 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.753 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -66.82 141.06 57.79 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.545 2.163 . . . . 0.0 112.74 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.443 ' O ' ' C ' ' A' ' 68' ' ' LEU . 1.8 mp -112.68 102.99 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.443 ' C ' ' O ' ' A' ' 67' ' ' ILE . 0.3 OUTLIER -30.32 108.67 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.928 0.394 . . . . 0.0 111.206 -179.675 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 121.78 -8.89 9.93 Favored Glycine 0 C--N 1.333 0.395 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.374 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -135.67 170.21 16.33 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.516 0.674 . . . . 0.0 111.339 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -85.9 169.9 12.85 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.33 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.3 tt -83.28 126.66 40.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.076 0.465 . . . . 0.0 111.024 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.561 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.9 mm? -98.43 119.78 37.72 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.113 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.438 ' SG ' ' HB3' ' A' ' 61' ' ' ARG . 41.8 t -161.56 137.81 8.11 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.47 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -160.81 170.74 20.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.82 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.9 m -89.88 137.25 28.4 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.826 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -86.8 142.77 6.84 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.693 2.262 . . . . 0.0 112.787 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 66.65 -1.32 1.34 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.92 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.18 36.52 63.85 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.452 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.1 mt . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.229 179.969 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.216 0 CA-C-O 120.887 0.375 . . . . 0.0 110.927 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.4 p -103.87 116.04 31.55 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 173.13 -154.89 21.59 Favored Glycine 0 N--CA 1.434 -1.443 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.743 -177.696 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.478 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.5 tm? -65.56 -40.63 93.02 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.31 -0.445 . . . . 0.0 110.96 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.783 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -77.43 -39.04 48.29 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.233 0.539 . . . . 0.0 111.645 -178.347 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.4 -12.91 0.01 OUTLIER Glycine 0 CA--C 1.528 0.87 0 N-CA-C 115.919 1.128 . . . . 0.0 115.919 176.818 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.426 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 25.6 m -110.73 129.11 55.92 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 118.78 1.29 . . . . 0.0 112.683 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.38 115.99 28.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.431 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.499 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 18.9 mm-40 -135.53 -178.24 5.03 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.03 0.443 . . . . 0.0 111.366 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.545 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 98.1 m -138.02 100.42 4.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.837 179.192 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 4.5 t -118.89 177.88 4.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.903 -179.136 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.423 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -104.08 166.94 10.09 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.8 -179.819 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.2 t -129.19 157.8 40.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.674 -179.464 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.417 ' H ' ' HB3' ' A' ' 32' ' ' ALA . 1.5 p-10 -77.64 -170.02 1.68 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.051 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.538 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.8 m -65.19 -44.67 95.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.516 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.538 ' HG ' HG23 ' A' ' 28' ' ' VAL . 31.3 mt -76.6 -19.36 57.93 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.88 -16.86 30.46 Favored Glycine 0 CA--C 1.521 0.465 0 C-N-CA 120.541 -0.838 . . . . 0.0 113.79 179.214 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 66.2 t -101.48 107.68 21.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 117.464 0.632 . . . . 0.0 111.074 179.562 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.417 ' HB3' ' H ' ' A' ' 27' ' ' ASP . . . 175.74 168.42 0.38 Allowed 'General case' 0 C--O 1.231 0.113 0 CA-C-O 121.091 0.472 . . . . 0.0 111.389 179.488 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -135.24 65.41 1.56 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.58 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.423 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.6 mt -87.57 132.23 34.13 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.119 -178.619 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.9 t70 51.17 84.75 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.562 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 86.8 m -108.12 129.72 55.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.121 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -148.17 -178.98 6.6 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.861 0.362 . . . . 0.0 111.433 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -73.79 137.94 76.76 Favored Pre-proline 0 CA--C 1.531 0.246 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.75 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.545 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 63.8 Cg_endo -90.88 109.73 0.34 Allowed 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 123.044 2.496 . . . . 0.0 112.609 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -91.01 113.73 0.4 Allowed 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 121.948 1.765 . . . . 0.0 112.387 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.27 177.27 1.9 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.887 178.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.1 m -106.99 88.11 2.66 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 177.55 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mt -61.8 122.71 16.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.252 -178.373 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.487 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.59 -31.72 4.22 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 116.232 -0.44 . . . . 0.0 112.074 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.472 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.0 p30 -166.24 -179.53 5.12 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.708 0.289 . . . . 0.0 111.337 -179.46 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.98 -59.17 4.14 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.026 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.6 m -60.26 -36.64 78.27 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.792 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.487 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.8 t60 -62.49 -33.81 75.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.861 179.295 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -69.05 -34.48 75.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.184 179.232 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -70.29 -24.06 62.97 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.626 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 29.5 t -85.43 -12.76 51.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.315 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 60.4 m -72.15 -44.17 63.52 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.756 0.312 . . . . 0.0 111.284 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.492 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 48.2 m -84.67 -25.48 28.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.069 -179.781 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.45 -20.06 57.42 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.471 0.653 . . . . 0.0 110.176 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.2 -36.53 82.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.946 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.5 pt -105.36 -4.5 9.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 112.951 0.722 . . . . 0.0 112.951 -178.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 103.98 39.59 2.46 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 120.272 -0.966 . . . . 0.0 114.133 178.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -143.94 -178.89 6.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 117.265 0.533 . . . . 0.0 111.069 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -114.95 149.77 36.79 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.327 -179.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.492 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -76.22 121.15 22.49 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.831 -179.24 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.499 HH21 ' HB2' ' A' ' 74' ' ' CYS . 11.9 ptm180 -146.08 125.62 13.26 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.692 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.648 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 10.6 t -88.95 118.16 28.47 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.539 -179.631 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.608 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 40.6 m -109.76 148.1 32.04 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -178.304 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.783 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -99.91 149.21 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 115.041 -0.982 . . . . 0.0 111.061 -179.556 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.422 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.1 mt -49.37 136.84 16.42 Favored Pre-proline 0 CA--C 1.531 0.228 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.422 -179.622 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 27.2 Cg_exo -63.18 133.36 40.42 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.562 2.175 . . . . 0.0 112.642 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.3 mm -129.38 106.8 14.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.664 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.748 HD22 ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -50.86 110.83 0.46 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 121.563 0.696 . . . . 0.0 111.529 -179.763 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.27 -15.58 5.79 Favored Glycine 0 C--N 1.335 0.51 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.548 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -132.37 168.3 18.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.441 0.639 . . . . 0.0 111.176 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -84.27 167.1 16.93 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.258 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.413 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.0 tt -83.14 125.03 40.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.001 0.429 . . . . 0.0 110.919 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.575 ' HB2' HG11 ' A' ' 64' ' ' VAL . 3.9 mm? -96.28 110.73 22.99 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.164 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.499 ' HB2' HH21 ' A' ' 61' ' ' ARG . 57.4 m -145.93 135.98 23.65 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.226 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -159.83 166.67 29.85 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.699 0.285 . . . . 0.0 110.851 179.252 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.2 m -91.89 135.99 26.75 Favored Pre-proline 0 CA--C 1.531 0.246 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.986 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -88.12 143.47 5.75 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.795 2.33 . . . . 0.0 112.817 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 64.94 4.05 2.32 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.853 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.35 33.69 68.51 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.351 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 47.4 mt . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.183 -0.913 . . . . 0.0 111.078 179.981 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.449 ' SG ' ' N ' ' A' ' 15' ' ' SER . 3.4 p . . . . . 0 CA--C 1.517 -0.302 0 CA-C-O 121.2 0.524 . . . . 0.0 111.101 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.583 ' O ' ' O ' ' A' ' 16' ' ' GLY . 4.2 m -113.3 -157.85 0.63 Allowed 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -178.505 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.583 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -19.49 -149.69 0.0 OUTLIER Glycine 0 CA--C 1.531 1.079 0 N-CA-C 119.086 2.394 . . . . 0.0 119.086 -179.283 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.507 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -22.79 -41.09 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 115.757 1.762 . . . . 0.0 115.757 -177.252 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.705 ' HB2' ' SG ' ' A' ' 62' ' ' CYS . 2.8 m-85 -68.59 -36.67 79.03 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 118.679 0.672 . . . . 0.0 111.485 -177.451 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.3 -20.33 0.01 OUTLIER Glycine 0 CA--C 1.533 1.204 0 N-CA-C 117.981 1.952 . . . . 0.0 117.981 175.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.481 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 76.9 m -130.04 120.58 24.93 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 120.064 1.932 . . . . 0.0 113.539 -177.791 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.13 120.58 15.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.291 -179.506 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.44 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 20.4 mm-40 -138.46 -175.39 4.11 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.89 0.376 . . . . 0.0 110.781 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.8 t -145.91 134.04 21.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.608 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.7 m -148.38 162.26 39.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.015 0.436 . . . . 0.0 111.392 -179.36 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -96.32 170.35 9.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.297 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.1 t -130.59 157.94 41.34 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.709 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -82.09 -169.96 2.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.212 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.549 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.6 m -63.02 -43.5 99.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.623 -179.472 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.549 ' HG ' HG23 ' A' ' 28' ' ' VAL . 29.4 mt -78.37 -19.92 52.37 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.77 -14.54 31.99 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.395 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.405 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 51.6 t -101.71 107.94 22.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 117.239 0.52 . . . . 0.0 111.127 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 176.4 145.38 0.09 Allowed 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.283 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -116.62 60.96 0.73 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.758 179.449 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.8 mt -84.91 153.23 22.99 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.577 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.1 t70 41.37 79.74 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.785 178.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 54.4 m -109.31 131.45 55.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.71 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -162.45 -174.8 4.18 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.931 0.395 . . . . 0.0 111.369 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.8 p-10 -78.99 133.05 62.0 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.883 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 22' ' ' GLN . 92.5 Cg_endo -85.27 117.88 1.89 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.665 2.244 . . . . 0.0 111.78 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -91.1 114.34 0.41 Allowed 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 122.229 1.953 . . . . 0.0 113.036 -179.128 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.447 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.62 178.02 1.65 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.915 178.71 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 31.7 m -106.86 88.42 2.74 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mt -63.95 124.3 21.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.59 -178.303 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.1 -40.52 2.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.855 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -151.91 -167.34 2.75 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.997 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.16 -45.29 77.46 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.364 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 42.4 m -67.83 -40.98 83.69 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.497 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -61.15 -32.7 72.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.549 179.115 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -68.82 -37.32 79.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.167 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -67.1 -27.45 67.36 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.526 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.6 t -82.37 -13.85 56.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.936 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.447 HG23 ' CB ' ' A' ' 41' ' ' ALA . 42.8 m -69.91 -40.07 75.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.91 0.386 . . . . 0.0 111.176 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 12.2 m -88.58 -29.31 20.11 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.293 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.31 -19.95 62.26 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.706 0.765 . . . . 0.0 109.579 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.12 -38.02 89.34 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.884 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.7 pt -103.13 -1.35 9.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -179.254 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.4 44.1 3.3 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 120.331 -0.938 . . . . 0.0 113.519 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -146.03 -172.98 4.04 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 117.227 0.514 . . . . 0.0 111.089 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 19.3 ptt180 -119.37 141.89 48.65 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 -178.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -72.05 123.24 22.4 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.213 -179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.484 HH21 ' HB2' ' A' ' 74' ' ' CYS . 14.2 ptm180 -158.55 126.15 5.06 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.337 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.705 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 18.7 t -85.43 145.36 27.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.404 -179.268 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 21.6 m -125.5 147.38 49.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.327 0.584 . . . . 0.0 111.723 -179.326 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.638 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -101.52 147.4 8.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.251 179.79 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.46 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 7.9 mt -49.32 133.12 17.41 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.29 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 23.9 Cg_exo -63.65 139.05 67.56 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.622 2.214 . . . . 0.0 112.521 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.429 HD13 ' O ' ' A' ' 66' ' ' PRO . 46.0 mm -131.6 110.42 17.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.394 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.81 109.49 0.29 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.878 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.84 -13.74 5.8 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.588 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -133.39 167.65 20.03 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.473 0.654 . . . . 0.0 111.31 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -83.53 168.56 16.32 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.77 -1.104 . . . . 0.0 110.181 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.439 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.8 tt -83.32 125.56 40.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.867 0.365 . . . . 0.0 110.615 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.524 ' HB2' HG11 ' A' ' 64' ' ' VAL . 3.9 mm? -98.28 105.85 18.05 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.83 0.348 . . . . 0.0 111.328 -179.344 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.484 ' HB2' HH21 ' A' ' 61' ' ' ARG . 48.5 m -146.89 133.63 20.0 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.099 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -161.03 166.76 27.66 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-O 120.823 0.344 . . . . 0.0 110.825 179.408 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.2 m -80.34 137.38 52.33 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.803 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -89.86 142.69 4.03 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.797 2.331 . . . . 0.0 112.757 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.23 4.47 1.64 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.613 179.762 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.46 36.7 58.99 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.537 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.6 mt . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.875 179.94 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 21' ' ' ALA . 51.3 t . . . . . 0 N--CA 1.473 0.687 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.1 p -96.22 115.81 28.01 Favored 'General case' 0 C--O 1.232 0.147 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 170.94 -166.56 39.74 Favored Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 120.582 -0.818 . . . . 0.0 113.26 -177.594 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.518 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.8 tm? -60.06 -37.51 80.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.823 -0.688 . . . . 0.0 110.27 177.554 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.77 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -79.43 -36.07 39.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.565 -178.653 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 59.02 -11.7 0.02 OUTLIER Glycine 0 CA--C 1.525 0.698 0 N-CA-C 115.507 0.963 . . . . 0.0 115.507 177.455 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.545 HG22 ' HG2' ' A' ' 22' ' ' GLN . 28.0 m -119.15 120.59 37.56 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 118.602 1.201 . . . . 0.0 112.38 -178.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.512 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . . . -86.77 107.2 18.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.313 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.545 ' HG2' HG22 ' A' ' 20' ' ' THR . 29.7 mm-40 -126.14 -169.45 2.02 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.092 0.472 . . . . 0.0 111.724 -178.87 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 4.4 t -143.67 138.04 28.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.747 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.8 t -157.15 173.47 16.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.932 0.396 . . . . 0.0 111.215 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.98 166.23 11.54 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.691 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.6 t -125.67 156.99 38.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.681 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -84.76 -169.81 2.82 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.194 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.548 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.6 m -61.42 -44.81 99.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.557 -179.545 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.548 ' HG ' HG23 ' A' ' 28' ' ' VAL . 27.0 mt -79.74 -20.27 46.77 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.037 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.35 -15.42 32.72 Favored Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.596 -0.812 . . . . 0.0 113.485 179.337 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 31.0 t -101.77 108.1 22.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 117.241 0.52 . . . . 0.0 111.124 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 179.52 168.0 1.11 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.044 0.45 . . . . 0.0 111.451 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -132.84 64.21 1.62 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.609 179.432 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -91.51 131.33 37.03 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.526 -178.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 52.14 83.23 0.06 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.956 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 56.4 m -108.08 131.9 54.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.338 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -153.65 -178.03 6.76 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.879 0.371 . . . . 0.0 111.29 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -77.96 140.51 62.38 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.633 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -90.72 111.17 0.38 Allowed 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.953 2.436 . . . . 0.0 111.909 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -90.71 113.78 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 121.903 1.736 . . . . 0.0 112.866 -179.293 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.439 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.99 -178.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.651 178.839 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.8 m -107.01 88.28 2.7 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.427 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.4 mt -62.51 122.85 16.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.482 -178.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.486 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.77 -33.62 3.75 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.764 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 0.465 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 6.9 p30 -163.48 -179.16 6.3 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.134 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.08 -60.03 3.33 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.289 -0.414 . . . . 0.0 112.025 -179.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 23.2 m -60.11 -37.78 81.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.756 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' HIS . . . . . 0.486 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.6 t60 -61.27 -33.11 73.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.904 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.411 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 18.3 t80 -68.78 -33.6 74.14 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.042 179.137 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -69.29 -41.58 76.6 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.025 178.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.1 m -64.36 -17.47 63.75 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.237 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.439 HG23 ' CB ' ' A' ' 41' ' ' ALA . 50.8 m -71.37 -42.1 68.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.443 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 23.0 m -84.59 -30.43 25.01 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.657 -179.394 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.83 -19.71 63.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.635 0.731 . . . . 0.0 109.631 -179.727 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -68.56 -39.72 80.92 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.286 -179.617 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 23.4 pt -100.57 1.41 10.51 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.24 39.56 5.67 Favored Glycine 0 CA--C 1.522 0.516 0 C-N-CA 120.294 -0.955 . . . . 0.0 113.443 179.078 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -145.96 -174.13 4.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.814 0.307 . . . . 0.0 110.807 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 23.9 mtm180 -119.73 156.45 30.53 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.89 0.376 . . . . 0.0 111.184 -179.416 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.411 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -85.49 122.87 30.25 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.645 -179.064 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -144.14 129.67 19.04 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.947 0.404 . . . . 0.0 110.546 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.689 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.9 t -98.5 109.67 22.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.732 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.539 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 91.9 m -101.07 145.75 28.34 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.308 0.575 . . . . 0.0 112.493 -178.419 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.77 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -95.25 148.42 5.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.495 179.704 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.431 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.5 mt -49.24 140.64 12.38 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.398 -179.361 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.501 ' O ' HD13 ' A' ' 67' ' ' ILE . 34.1 Cg_exo -59.79 139.65 89.47 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.734 2.289 . . . . 0.0 112.327 -179.873 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.501 HD13 ' O ' ' A' ' 66' ' ' PRO . 30.2 mm -131.95 110.12 16.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.476 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.48 111.89 0.8 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.092 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 122.65 -2.96 10.17 Favored Glycine 0 C--N 1.335 0.485 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.089 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -149.7 165.42 32.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.269 0.557 . . . . 0.0 111.163 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -78.87 169.85 17.59 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.577 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.406 HG23 ' O ' ' A' ' 72' ' ' ILE . 17.2 tt -82.85 121.69 36.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.152 0.501 . . . . 0.0 110.613 179.732 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.537 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.7 mm? -90.49 124.64 35.16 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.466 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -160.27 135.84 8.22 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.217 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -159.51 162.37 35.48 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.741 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 53.1 m -82.82 136.31 44.74 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.862 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -85.74 140.88 7.26 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.577 2.184 . . . . 0.0 112.653 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.12 3.69 1.36 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.664 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.94 38.04 60.31 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.485 179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 35.6 mt . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.232 -0.889 . . . . 0.0 111.049 179.992 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.1 p . . . . . 0 N--CA 1.466 0.33 0 CA-C-O 121.119 0.485 . . . . 0.0 112.241 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.0 p -95.32 117.96 31.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.27 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.25 -166.79 39.65 Favored Glycine 0 N--CA 1.441 -1.031 0 C-N-CA 120.551 -0.833 . . . . 0.0 113.161 -177.514 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.523 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.7 tm? -56.86 -37.21 70.99 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.764 -0.718 . . . . 0.0 110.591 177.945 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.746 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -80.91 -38.9 27.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.404 0.621 . . . . 0.0 111.375 -178.551 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.72 -8.18 0.01 OUTLIER Glycine 0 CA--C 1.527 0.805 0 CA-C-N 114.671 -1.149 . . . . 0.0 115.739 176.518 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.541 HG22 ' HG2' ' A' ' 22' ' ' GLN . 18.1 m -115.69 126.12 53.7 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 118.658 1.229 . . . . 0.0 112.996 -178.024 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -87.43 104.89 16.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.087 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.541 ' HG2' HG22 ' A' ' 20' ' ' THR . 29.4 mm-40 -128.25 -169.41 2.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.126 0.488 . . . . 0.0 111.69 -178.524 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.9 t -139.68 140.73 36.94 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.974 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -161.86 155.86 21.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.085 0.469 . . . . 0.0 111.285 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.521 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -79.5 166.46 21.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.594 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.0 t -134.74 158.21 44.72 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.426 ' HB3' ' HB2' ' A' ' 32' ' ' ALA . 1.6 p-10 -77.33 -168.89 1.23 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.007 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.588 HG23 ' HG ' ' A' ' 29' ' ' LEU . 11.0 m -65.24 -44.67 95.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.632 -179.627 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.588 ' HG ' HG23 ' A' ' 28' ' ' VAL . 29.1 mt -78.16 -19.29 54.28 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -178.708 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.77 -15.44 31.62 Favored Glycine 0 CA--C 1.521 0.416 0 C-N-CA 120.541 -0.838 . . . . 0.0 113.697 179.335 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.5 t -101.68 108.14 23.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 117.302 0.551 . . . . 0.0 111.181 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.426 ' HB2' ' HB3' ' A' ' 27' ' ' ASP . . . 179.51 171.33 1.0 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.124 0.488 . . . . 0.0 111.322 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -139.41 93.45 2.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.769 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.521 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 1.7 mt -125.08 134.67 52.41 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.548 -178.623 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.3 t70 52.94 86.24 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.198 179.36 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 m -108.46 133.93 51.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.964 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -156.32 -178.09 7.07 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.937 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -83.31 138.21 42.06 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.541 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -90.1 114.56 0.54 Allowed 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.814 2.343 . . . . 0.0 111.928 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -90.44 114.0 0.48 Allowed 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 121.982 1.788 . . . . 0.0 112.783 -179.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.42 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.48 -179.28 1.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.532 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.6 m -108.2 88.12 2.66 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 177.741 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -61.41 123.18 17.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.284 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.64 -40.61 2.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.906 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -152.92 -168.36 3.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.045 179.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.501 ' HB1' ' HG ' ' A' ' 80' ' ' LEU . . . -64.94 -44.05 90.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.257 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 41.3 m -70.4 -41.94 72.31 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.798 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -60.49 -33.85 73.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.118 0.485 . . . . 0.0 109.856 179.381 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -69.27 -35.76 76.41 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.975 179.151 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -67.02 -32.12 73.13 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.216 179.064 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.5 t -76.2 -12.89 60.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.776 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.42 HG23 ' CB ' ' A' ' 41' ' ' ALA . 52.4 m -73.81 -40.93 63.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.075 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 7.4 m -86.16 -31.95 21.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.51 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.8 -19.93 63.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.659 0.742 . . . . 0.0 109.825 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.03 -39.22 93.04 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.925 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.4 pt -103.34 0.79 10.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -179.116 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.18 43.13 3.09 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.318 -0.944 . . . . 0.0 113.58 178.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -150.63 -175.03 4.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 117.097 0.448 . . . . 0.0 110.995 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -120.66 153.99 36.12 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.976 0.417 . . . . 0.0 111.122 -179.51 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.59 126.2 30.56 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.241 -179.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -149.64 155.41 40.2 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.044 0.45 . . . . 0.0 110.925 179.475 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.626 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 33.6 t -121.44 104.76 9.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.18 -179.575 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' CYS . . . . . 0.543 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 5.0 m -109.95 145.0 37.65 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.197 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.746 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.3 OUTLIER -90.81 146.02 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.742 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.463 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.5 mt -49.95 138.65 18.38 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.451 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 27.3 Cg_exo -62.65 138.53 70.29 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.589 2.193 . . . . 0.0 112.556 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.41 HD13 ' O ' ' A' ' 66' ' ' PRO . 50.3 mm -130.82 108.4 15.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.658 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.65 109.98 0.33 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.266 -179.718 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.14 -12.46 6.42 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.643 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -136.95 168.9 18.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.416 0.627 . . . . 0.0 111.25 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -82.22 166.82 19.26 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.113 179.404 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.6 tt -83.44 124.49 39.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 121.065 0.459 . . . . 0.0 110.995 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.619 ' O ' HG12 ' A' ' 64' ' ' VAL . 4.0 mm? -98.94 113.7 25.98 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.705 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 43.6 t -161.55 138.67 8.65 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.623 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLN . . . . . 0.434 HE21 ' HE2' ' A' ' 18' ' ' TYR . 4.7 pp0? -159.93 163.3 34.34 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.95 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.3 m -90.2 126.62 56.29 Favored Pre-proline 0 CA--C 1.531 0.218 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.182 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -53.57 108.89 0.3 Allowed 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.679 2.252 . . . . 0.0 113.178 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.82 34.06 18.39 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.55 179.234 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 62.49 20.95 61.92 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.924 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.685 ' O ' HD13 ' A' ' 80' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.775 -0.631 . . . . 0.0 111.063 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.517 -0.299 0 CA-C-O 121.318 0.58 . . . . 0.0 111.946 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.585 ' O ' ' O ' ' A' ' 16' ' ' GLY . 14.0 m -133.36 -157.57 0.82 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.711 -179.014 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLY . . . . . 0.585 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -19.42 -149.78 0.0 OUTLIER Glycine 0 CA--C 1.532 1.096 0 N-CA-C 119.084 2.394 . . . . 0.0 119.084 -179.368 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.2 tm? -23.21 -43.13 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -177.395 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.726 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 3.7 m-85 -68.55 -35.92 78.08 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.207 -0.597 . . . . 0.0 112.208 -176.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.31 -10.98 0.01 OUTLIER Glycine 0 CA--C 1.527 0.816 0 N-CA-C 115.554 0.982 . . . . 0.0 115.554 176.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.425 ' H ' ' C ' ' A' ' 18' ' ' TYR . 32.5 m -125.13 145.9 49.73 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 118.591 1.196 . . . . 0.0 112.162 -178.163 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -111.73 109.15 18.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.794 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -129.07 -172.03 2.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.153 0.501 . . . . 0.0 111.673 -178.787 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 36' ' ' CYS . 2.1 t -135.93 105.59 6.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.79 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.458 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 2.3 m -126.76 151.8 47.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.964 0.411 . . . . 0.0 111.712 -178.468 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -89.32 166.37 13.8 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.046 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.9 t -121.76 157.21 31.51 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -179.263 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -86.18 -170.26 3.01 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.418 -179.185 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.553 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.4 m -61.1 -45.12 99.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.407 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.553 ' HG ' HG23 ' A' ' 28' ' ' VAL . 24.0 mt -79.9 -20.72 45.14 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.606 0.241 . . . . 0.0 111.446 -179.094 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.63 -18.07 32.65 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 120.674 -0.774 . . . . 0.0 113.7 179.196 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.427 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 39.5 t -101.96 107.72 22.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 117.497 0.649 . . . . 0.0 111.058 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.427 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 174.81 171.16 0.25 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.029 0.442 . . . . 0.0 111.401 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -133.15 85.71 2.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.585 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 mt -109.03 137.01 47.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.043 -178.464 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.6 t70 41.63 81.23 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.075 178.607 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.458 ' HB2' ' HB3' ' A' ' 24' ' ' CYS . 49.1 t -128.03 139.76 52.36 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.342 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -155.71 -173.19 4.43 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.243 -179.588 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -64.93 133.1 95.66 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.85 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -90.46 110.04 0.38 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.89 2.393 . . . . 0.0 111.922 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -90.75 115.13 0.47 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.24 1.96 . . . . 0.0 112.887 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.414 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.05 -179.14 1.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.784 178.983 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 34.9 m -105.87 88.52 2.83 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 177.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.15 123.18 19.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.449 -178.589 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.9 -40.64 2.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.826 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -151.49 -168.23 3.03 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.037 179.67 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.64 -49.8 71.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.415 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.8 m -65.17 -40.81 94.8 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.806 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -60.65 -32.34 71.51 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.814 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.49 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 18.5 t80 -69.37 -37.95 77.83 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.938 178.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.0 -41.19 97.57 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.954 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.4 m -64.44 -20.06 65.93 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.416 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.414 HG23 ' CB ' ' A' ' 41' ' ' ALA . 51.8 m -69.52 -39.18 77.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.534 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.401 ' HB3' ' C ' ' A' ' 58' ' ' GLN . 2.5 m -87.72 -32.6 19.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.816 -179.305 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.21 -19.37 63.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.674 0.749 . . . . 0.0 109.686 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.5 -39.11 88.51 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.399 -1.273 . . . . 0.0 112.446 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.9 pt -105.85 3.03 10.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.71 42.7 3.06 Favored Glycine 0 CA--C 1.523 0.563 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.784 178.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.401 ' C ' ' HB3' ' A' ' 53' ' ' CYS . 36.8 mt-30 -151.32 -174.56 4.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 117.041 0.421 . . . . 0.0 110.717 179.411 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.2 mtp180 -125.47 153.79 43.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.798 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.49 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -67.66 118.83 11.46 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.005 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -130.48 123.79 30.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.855 0.359 . . . . 0.0 110.52 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.678 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 3.4 t -96.31 107.68 20.07 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 57.8 m -105.78 151.03 24.98 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.538 0.685 . . . . 0.0 112.635 -178.36 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.726 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -105.3 150.33 8.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.483 179.569 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.484 HD12 ' HD2' ' A' ' 66' ' ' PRO . 1.2 tp -50.35 122.76 15.83 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.137 -179.324 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.484 ' HD2' HD12 ' A' ' 65' ' ' LEU . 24.3 Cg_exo -65.31 139.53 60.28 Favored 'Trans proline' 0 C--N 1.355 0.921 0 C-N-CA 122.481 2.121 . . . . 0.0 112.516 -179.756 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.438 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 48.2 mm -131.38 112.63 21.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.486 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -46.93 108.91 0.16 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.792 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.94 -14.56 5.71 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.525 -179.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 12.8 pt20 -129.07 166.55 19.03 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.534 0.683 . . . . 0.0 111.265 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -82.49 162.21 22.13 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.225 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.408 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.0 tt -83.35 121.02 35.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.138 0.494 . . . . 0.0 111.004 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.52 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.9 mm? -95.13 107.92 20.01 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.959 -179.581 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.408 ' SG ' HG12 ' A' ' 72' ' ' ILE . 69.7 m -144.79 130.35 18.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.11 -179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -160.37 161.91 33.24 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.879 0.371 . . . . 0.0 110.86 179.423 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.5 m -85.97 135.24 37.72 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.163 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -86.04 142.42 7.59 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.736 2.29 . . . . 0.0 112.644 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 65.17 1.54 1.58 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.842 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.14 36.57 64.0 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.405 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.7 mt . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.253 -0.879 . . . . 0.0 111.012 179.801 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.533 0.206 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.12 123.78 14.21 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.681 2.254 . . . . 0.0 112.407 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.632 ' HB1' ' HG2' ' A' ' 6' ' ' GLU . . . -88.63 82.11 6.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.857 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.533 ' HA ' ' CZ ' ' A' ' 7' ' ' ARG . . . -118.83 -10.95 9.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.376 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.2 ttm -112.97 -24.17 9.66 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.673 0.749 . . . . 0.0 109.413 -179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.819 ' HG3' ' HG3' ' A' ' 7' ' ' ARG . 0.3 OUTLIER -55.11 -26.93 41.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.223 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.819 ' HG3' ' HG3' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -105.48 82.34 1.8 Allowed 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 122.1 0.952 . . . . 0.0 110.49 -179.437 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -55.63 150.28 12.64 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 113.547 -1.66 . . . . 0.0 110.768 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.556 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -93.55 154.0 41.23 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.96 -179.922 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.556 ' HD2' HG22 ' A' ' 9' ' ' VAL . 82.2 Cg_exo -43.95 129.26 7.59 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.944 2.43 . . . . 0.0 112.727 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -56.21 151.07 13.14 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.975 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.4 m -111.79 97.3 36.99 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.338 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.426 ' O ' ' C ' ' A' ' 14' ' ' CYS . 60.1 Cg_exo -53.29 177.02 0.07 OUTLIER 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.743 2.296 . . . . 0.0 112.963 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.426 ' C ' ' O ' ' A' ' 13' ' ' PRO . 0.5 OUTLIER -27.27 109.47 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.859 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 80.0 p -95.08 115.83 27.93 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.07 -154.63 22.02 Favored Glycine 0 N--CA 1.436 -1.314 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.733 -177.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.478 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.5 tm? -65.58 -40.49 92.78 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.327 -0.436 . . . . 0.0 110.783 177.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.764 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -76.54 -36.96 57.38 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.442 0.639 . . . . 0.0 111.595 -178.804 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.64 -8.92 0.02 OUTLIER Glycine 0 CA--C 1.525 0.671 0 CA-C-N 114.763 -1.108 . . . . 0.0 114.794 177.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.423 ' H ' ' C ' ' A' ' 18' ' ' TYR . 7.6 m -112.61 154.59 25.79 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 118.174 0.987 . . . . 0.0 111.929 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.88 107.57 12.86 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.256 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.507 ' HA ' ' HG3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -137.71 -169.86 2.63 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -179.195 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.516 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 60.1 m -134.28 119.84 19.22 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.501 -179.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.495 ' HB3' ' HD3' ' A' ' 61' ' ' ARG . 1.1 t -128.43 -179.8 5.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.958 0.408 . . . . 0.0 110.927 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.508 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -115.2 164.71 13.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.873 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.7 t -130.46 157.68 41.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.512 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.407 ' H ' ' HB3' ' A' ' 32' ' ' ALA . 0.8 OUTLIER -80.56 -170.67 2.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.545 -179.194 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.529 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.7 m -62.63 -47.0 95.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.721 -179.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.529 ' HG ' HG23 ' A' ' 28' ' ' VAL . 32.5 mt -76.2 -19.68 58.18 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.39 -13.39 33.31 Favored Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.702 -0.761 . . . . 0.0 113.451 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.602 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.6 p -100.36 108.18 22.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 117.156 0.478 . . . . 0.0 111.103 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.542 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 172.58 161.27 0.12 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.637 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -131.24 63.07 1.61 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.632 179.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.508 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 3.8 mt -82.59 135.54 35.04 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.83 -178.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.1 t70 50.37 81.62 0.06 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.679 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -109.34 129.56 55.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.461 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -166.25 172.64 10.93 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.102 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -66.52 145.2 98.93 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.444 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.516 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 57.1 Cg_endo -91.19 121.37 0.69 Allowed 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.864 2.376 . . . . 0.0 112.657 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -90.7 112.11 0.4 Allowed 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 121.684 1.589 . . . . 0.0 112.025 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -176.63 -175.83 0.67 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.748 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 36.5 m -109.05 88.27 2.69 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -64.35 123.98 20.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.555 -178.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.474 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.6 -33.35 3.84 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.955 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.465 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 6.9 p30 -163.86 -179.5 6.35 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.099 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.59 -58.46 6.27 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -179.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.4 m -60.3 -35.79 76.39 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.804 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.474 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.9 t60 -62.43 -34.5 76.9 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.981 179.477 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.409 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 25.7 t80 -70.15 -35.96 74.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.394 179.181 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -67.01 -31.23 71.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.063 0.458 . . . . 0.0 110.138 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.8 t -76.59 -17.74 59.03 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.389 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 60.0 m -73.35 -42.5 62.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.988 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.4 m -80.79 -26.77 36.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.223 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.22 -20.1 55.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.437 0.637 . . . . 0.0 110.302 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.88 -36.08 80.23 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.923 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.4 pt -108.96 11.42 8.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 84.3 41.6 7.87 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.489 -0.862 . . . . 0.0 113.393 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -140.95 177.93 7.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.855 0.327 . . . . 0.0 110.878 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -117.2 162.95 17.04 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.878 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.409 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -85.98 118.42 25.45 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.746 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.593 HH21 ' HB3' ' A' ' 74' ' ' CYS . 12.9 ptm180 -147.55 125.74 12.2 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.164 0.507 . . . . 0.0 110.211 179.203 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.472 ' HB2' ' CD2' ' A' ' 18' ' ' TYR . 5.5 m -85.88 106.22 16.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.261 -178.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.415 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 65.2 m -98.0 142.61 29.51 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.229 0.538 . . . . 0.0 111.904 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.764 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -93.83 144.3 9.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.444 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.448 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.5 mt -49.43 137.14 16.59 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.535 -178.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 37.9 Cg_exo -61.42 138.13 74.38 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.71 2.273 . . . . 0.0 112.617 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 51.3 mm -130.3 108.17 15.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.375 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.65 109.36 0.31 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.12 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.68 -13.68 5.84 Favored Glycine 0 C--N 1.333 0.38 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.773 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -135.16 168.48 19.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.451 0.643 . . . . 0.0 111.161 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -81.29 169.3 17.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.294 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 20.2 tt -84.09 132.27 31.94 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-O 120.813 0.34 . . . . 0.0 110.876 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.553 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.5 mm? -109.82 132.15 54.41 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.789 0.328 . . . . 0.0 110.622 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.593 ' HB3' HH21 ' A' ' 61' ' ' ARG . 0.5 OUTLIER -160.14 135.39 8.05 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.339 179.406 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -153.11 163.13 40.43 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.63 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.458 HG23 ' HD2' ' A' ' 77' ' ' PRO . 54.4 m -96.38 139.47 21.72 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.654 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.458 ' HD2' HG23 ' A' ' 76' ' ' THR . 64.1 Cg_endo -75.49 125.22 8.86 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.28 1.987 . . . . 0.0 113.144 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 57.19 23.83 9.09 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.801 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 63.62 33.76 88.12 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.559 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.6 tp . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.282 -179.552 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 77.9 p . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.583 0.23 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -56.45 108.4 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.682 2.255 . . . . 0.0 112.45 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.55 ' HB1' ' HB2' ' A' ' 6' ' ' GLU . . . -106.58 108.87 20.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.783 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -97.56 -50.6 4.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.587 -179.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 22.8 mmt -106.36 -1.76 22.96 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.399 -179.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.55 ' HB2' ' HB1' ' A' ' 3' ' ' ALA . 32.2 mt-10 -82.89 -71.29 0.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.737 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.96 120.24 10.88 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 120.99 0.424 . . . . 0.0 110.866 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -88.57 134.62 33.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.994 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.565 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.7 OUTLIER -92.87 154.42 41.97 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.951 -179.933 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.565 ' HD2' HG22 ' A' ' 9' ' ' VAL . 80.3 Cg_exo -46.38 128.67 12.62 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 123.01 2.473 . . . . 0.0 112.866 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -54.22 153.96 4.8 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.386 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 26.4 m -120.78 91.75 47.61 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.84 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.81 176.57 0.07 OUTLIER 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.744 2.296 . . . . 0.0 112.916 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -41.04 121.55 1.57 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.675 -179.675 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 75.3 p -98.29 117.13 31.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.532 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 173.77 -155.22 21.56 Favored Glycine 0 N--CA 1.434 -1.47 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.744 -178.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.496 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.4 tm? -66.75 -38.64 87.02 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.216 -0.492 . . . . 0.0 110.966 178.335 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.749 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -79.07 -39.24 34.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.833 -178.252 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.79 -11.5 0.01 OUTLIER Glycine 0 CA--C 1.528 0.855 0 CA-C-N 114.97 -1.014 . . . . 0.0 115.285 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.517 HG22 ' HG2' ' A' ' 22' ' ' GLN . 6.6 m -105.94 131.14 53.61 Favored 'General case' 0 N--CA 1.46 0.074 0 CA-C-N 118.383 1.091 . . . . 0.0 112.372 -178.204 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -100.98 99.53 10.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.544 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.517 ' HG2' HG22 ' A' ' 20' ' ' THR . 24.1 mm-40 -126.31 -174.57 3.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.88 0.371 . . . . 0.0 111.003 -179.34 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.585 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 58.3 m -135.51 107.76 7.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.298 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.14 151.56 51.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.886 0.374 . . . . 0.0 111.143 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.41 169.65 16.72 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.593 -178.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.4 t -126.35 158.13 36.67 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.635 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -76.87 -169.86 1.43 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.451 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.543 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.6 m -65.74 -46.04 90.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.699 -179.557 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.543 ' HG ' HG23 ' A' ' 28' ' ' VAL . 30.6 mt -75.46 -19.8 59.22 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -178.636 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.82 -18.33 29.29 Favored Glycine 0 CA--C 1.521 0.464 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.765 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.41 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 46.8 t -101.51 107.81 22.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 117.603 0.702 . . . . 0.0 111.033 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 175.94 172.74 0.35 Allowed 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.049 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -141.38 84.23 1.9 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.91 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.7 mt -104.38 134.95 46.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.682 -178.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 51.53 84.14 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.006 178.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.5 t -122.76 137.77 54.82 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.826 0.346 . . . . 0.0 111.005 179.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -159.76 -178.4 7.04 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -65.85 124.62 88.07 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.825 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.585 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 93.7 Cg_endo -85.84 122.17 2.23 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.506 2.137 . . . . 0.0 112.087 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -91.25 113.73 0.39 Allowed 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.113 1.875 . . . . 0.0 112.508 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.53 179.12 1.5 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 179.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 32.1 m -106.89 88.07 2.66 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.5 mt -63.36 121.2 13.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.411 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.483 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.62 -34.46 3.59 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.71 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.47 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.1 p30 -162.77 -179.18 6.64 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.238 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.88 -59.84 3.7 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.937 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.6 m -60.27 -36.33 77.57 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.745 -179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.483 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.7 t60 -62.78 -32.44 73.61 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.947 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.533 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 13.8 t80 -71.34 -38.65 71.64 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.103 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.08 -31.86 73.1 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 121.058 0.456 . . . . 0.0 110.149 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.3 t -75.51 -13.38 60.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.958 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 74.2 m -78.06 -44.04 27.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.077 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.492 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 36.2 m -82.95 -26.94 30.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.986 -179.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.49 -20.18 58.92 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.501 0.667 . . . . 0.0 110.186 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.81 -37.24 86.95 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.744 -1.117 . . . . 0.0 112.077 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.0 pt -106.01 11.29 8.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.42 40.36 6.07 Favored Glycine 0 CA--C 1.522 0.492 0 C-N-CA 120.493 -0.861 . . . . 0.0 114.235 178.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -148.44 -178.1 6.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 117.263 0.531 . . . . 0.0 111.059 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -122.98 154.81 37.93 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.168 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.533 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -69.57 119.91 14.55 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.689 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -139.6 125.3 19.44 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.563 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.602 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 15.4 t -98.72 99.54 10.66 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.503 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 3.8 m -109.1 141.37 41.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.257 0.551 . . . . 0.0 112.33 -177.668 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.749 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.3 OUTLIER -87.48 144.12 9.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.457 179.873 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.4 mt -49.52 136.43 17.62 Favored Pre-proline 0 N--CA 1.462 0.165 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.359 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 37.5 Cg_exo -61.1 133.92 49.81 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.497 2.132 . . . . 0.0 112.531 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.4 mm -128.17 106.14 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.6 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.18 110.98 0.38 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.18 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.49 -13.97 5.87 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.464 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -138.18 166.86 23.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.41 0.624 . . . . 0.0 111.144 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -80.46 164.63 22.89 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.288 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.5 tt -83.43 125.2 40.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.05 0.452 . . . . 0.0 110.952 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.626 ' O ' HG12 ' A' ' 64' ' ' VAL . 4.0 mm? -100.66 115.73 30.92 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.9 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 42.2 t -161.27 140.45 10.18 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.251 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -160.7 168.24 25.26 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.384 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 72.9 m -100.69 124.65 41.54 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.325 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -69.45 141.2 45.85 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.403 2.069 . . . . 0.0 112.72 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.47 -0.85 0.64 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.246 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.9 36.84 65.39 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.397 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 28.6 mt . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.191 -0.909 . . . . 0.0 111.193 179.849 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 55.6 m . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.625 0.25 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.26 116.24 3.1 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.706 2.271 . . . . 0.0 112.364 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.471 ' HB1' ' HB2' ' A' ' 6' ' ' GLU . . . -74.5 143.02 44.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.072 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -110.22 -37.1 5.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.53 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 7.7 ptp -107.26 -36.28 6.58 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.927 0.394 . . . . 0.0 110.865 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.471 ' HB2' ' HB1' ' A' ' 3' ' ' ALA . 22.9 mt-10 -56.92 -70.7 0.11 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.865 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.67 116.96 7.92 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.071 0.462 . . . . 0.0 110.886 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -74.95 147.5 40.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.57 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.521 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.9 OUTLIER -90.19 152.79 46.33 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.984 -179.778 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.521 ' HD2' HG22 ' A' ' 9' ' ' VAL . 81.3 Cg_exo -42.89 133.42 5.68 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 123.003 2.469 . . . . 0.0 112.714 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -55.23 154.39 5.93 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.963 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 89.1 m -135.64 90.5 19.71 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.322 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -75.34 166.31 29.05 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.678 2.252 . . . . 0.0 111.962 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.1 t 51.32 -171.12 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.148 0.499 . . . . 0.0 111.173 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.624 ' O ' ' O ' ' A' ' 16' ' ' GLY . 87.6 p -134.18 -156.99 0.77 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.392 -179.382 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.624 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -18.52 -147.71 0.0 OUTLIER Glycine 0 CA--C 1.532 1.146 0 N-CA-C 118.251 2.06 . . . . 0.0 118.251 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.481 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -22.85 -42.07 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 115.402 1.63 . . . . 0.0 115.402 -177.675 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.577 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 5.7 m-85 -69.37 -36.46 76.84 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.275 -0.57 . . . . 0.0 112.264 -177.259 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.69 -14.43 0.01 OUTLIER Glycine 0 CA--C 1.531 1.034 0 N-CA-C 115.708 1.043 . . . . 0.0 115.708 177.358 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.434 ' H ' ' C ' ' A' ' 18' ' ' TYR . 23.3 m -129.54 153.92 47.55 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 118.576 1.188 . . . . 0.0 112.175 -178.307 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -115.31 114.97 25.88 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.976 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -132.63 -169.88 2.33 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.128 0.489 . . . . 0.0 111.646 -178.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.458 ' HB2' ' HB3' ' A' ' 39' ' ' PRO . 5.6 t -147.27 131.11 17.05 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.115 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.543 ' HB2' ' HD2' ' A' ' 61' ' ' ARG . 36.7 m -147.34 165.83 28.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.967 0.413 . . . . 0.0 111.498 -179.096 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.35 168.77 10.86 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.385 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.427 ' HB ' HH21 ' A' ' 59' ' ' ARG . 5.7 t -122.98 156.82 33.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.72 -179.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -85.0 -169.61 2.73 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.234 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.584 HG23 ' HG ' ' A' ' 29' ' ' LEU . 8.2 m -60.93 -46.29 96.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.571 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.584 ' HG ' HG23 ' A' ' 28' ' ' VAL . 24.8 mt -80.21 -20.4 44.77 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 111.636 0.235 . . . . 0.0 111.636 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.32 -16.38 32.2 Favored Glycine 0 CA--C 1.522 0.509 0 C-N-CA 120.716 -0.754 . . . . 0.0 113.52 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 61.0 t -101.4 108.38 23.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 117.192 0.496 . . . . 0.0 111.178 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.35 167.41 0.81 Allowed 'General case' 0 N--CA 1.461 0.119 0 CA-C-O 120.967 0.413 . . . . 0.0 111.336 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -130.36 76.29 1.71 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.834 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 mt -102.95 143.21 32.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.976 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 30.3 t70 45.52 83.48 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.946 178.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 52.0 m -109.66 130.28 55.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.211 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -156.99 -176.18 5.84 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.053 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -79.33 133.32 60.46 Favored Pre-proline 0 CA--C 1.533 0.304 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.685 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.458 ' HB3' ' HB2' ' A' ' 23' ' ' CYS . 93.5 Cg_endo -89.07 119.97 1.03 Allowed 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.72 2.28 . . . . 0.0 111.931 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -91.27 114.34 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.32 2.013 . . . . 0.0 113.105 -179.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.455 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.58 179.98 1.34 Allowed 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.939 178.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.6 m -106.72 88.47 2.76 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.2 mt -62.47 121.56 13.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.277 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.506 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.55 -34.44 3.61 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.553 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.454 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.0 p30 -162.89 -177.91 5.79 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.103 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.88 -61.25 2.33 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.245 -0.434 . . . . 0.0 112.011 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.7 m -59.55 -36.42 76.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.846 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.506 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.2 t60 -63.03 -33.33 75.19 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -67.73 -34.85 77.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.741 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -67.78 -42.3 81.87 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.055 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 57.0 m -63.26 -18.07 63.18 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.297 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.455 HG23 ' CB ' ' A' ' 41' ' ' ALA . 48.5 m -70.85 -40.68 72.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.486 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 32.6 m -86.66 -31.47 21.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.791 -179.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.53 -19.71 63.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.657 0.741 . . . . 0.0 109.542 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.49 -39.86 88.97 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.417 -1.265 . . . . 0.0 112.117 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 16.1 pt -101.41 1.25 10.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.43 40.66 5.34 Favored Glycine 0 CA--C 1.522 0.511 0 C-N-CA 120.282 -0.961 . . . . 0.0 113.289 179.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -143.41 -172.12 3.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.782 0.291 . . . . 0.0 110.826 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.427 HH21 ' HB ' ' A' ' 26' ' ' THR . 50.6 mtm180 -119.96 152.15 37.87 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.743 0.306 . . . . 0.0 111.119 -179.34 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -82.72 122.76 28.58 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.763 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.543 ' HD2' ' HB2' ' A' ' 24' ' ' CYS . 4.2 ptm180 -140.19 140.26 35.86 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-O 120.627 0.251 . . . . 0.0 110.564 -179.538 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -106.39 119.57 39.6 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 55.5 m -110.21 149.21 30.45 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 121.424 0.63 . . . . 0.0 112.254 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.577 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -101.39 149.3 6.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.543 179.725 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.2 mt -49.6 137.46 17.41 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.364 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 33.1 Cg_exo -60.63 134.97 57.51 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.604 2.203 . . . . 0.0 112.801 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.457 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.8 mm -130.57 106.19 12.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.51 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.2 119.79 4.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.982 0.42 . . . . 0.0 111.278 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 118.94 -8.13 12.76 Favored Glycine 0 CA--C 1.518 0.229 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.826 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.457 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 12.2 pt20 -139.24 168.5 19.69 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.477 0.656 . . . . 0.0 111.218 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -82.99 168.9 16.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.311 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.417 HG12 ' SG ' ' A' ' 74' ' ' CYS . 16.3 tt -83.4 124.81 39.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-O 120.922 0.391 . . . . 0.0 110.932 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.508 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.1 mm? -96.61 109.01 21.7 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.031 -179.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.417 ' SG ' HG12 ' A' ' 72' ' ' ILE . 64.2 m -144.76 131.96 20.57 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.122 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.1 pt20 -160.27 167.51 27.38 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.766 0.317 . . . . 0.0 110.941 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 49.4 m -82.86 137.47 43.73 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.87 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -83.67 136.22 7.23 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.378 2.052 . . . . 0.0 112.684 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 64.34 3.48 1.85 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.811 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.63 40.02 54.56 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.436 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.2 mt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.285 -0.864 . . . . 0.0 111.061 179.971 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.497 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 60.5 m . . . . . 0 N--CA 1.486 1.37 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 1' ' ' SER . 17.2 Cg_endo -58.2 119.77 7.24 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 121.964 1.776 . . . . 0.0 112.386 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -129.71 91.7 3.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.945 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -94.62 -20.77 19.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.166 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 11.2 ptm -110.54 -35.42 6.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.14 0.495 . . . . 0.0 110.345 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -75.12 -164.87 0.34 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.842 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.715 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -49.82 119.75 3.77 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.002 0.43 . . . . 0.0 111.222 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.423 ' HA ' ' OE1' ' A' ' 8' ' ' GLN . 4.7 tp60 -57.2 150.14 18.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.877 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.527 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -101.76 154.5 37.26 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.267 -179.796 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.527 ' HD2' HG22 ' A' ' 9' ' ' VAL . 72.0 Cg_exo -46.57 130.02 14.46 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.902 2.401 . . . . 0.0 112.648 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -63.83 157.79 23.65 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.231 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 94.1 m -136.62 92.71 14.74 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.674 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -73.1 166.96 28.6 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.602 2.202 . . . . 0.0 112.248 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.1 t 47.92 -162.58 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.408 0.623 . . . . 0.0 111.664 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.596 ' O ' ' O ' ' A' ' 16' ' ' GLY . 10.6 m -129.11 -156.08 0.74 Allowed 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.136 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.596 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -17.2 -147.7 0.0 OUTLIER Glycine 0 CA--C 1.533 1.182 0 N-CA-C 118.655 2.222 . . . . 0.0 118.655 -179.534 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.451 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.7 OUTLIER -22.15 -45.96 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -176.846 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.636 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 6.4 m-85 -69.26 -37.23 77.81 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.927 -0.709 . . . . 0.0 112.031 -177.363 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.92 -12.26 0.01 OUTLIER Glycine 0 CA--C 1.529 0.952 0 N-CA-C 116.545 1.378 . . . . 0.0 116.545 176.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.473 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 52.6 m -138.16 138.11 38.29 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.139 1.469 . . . . 0.0 112.839 -177.791 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -106.18 125.87 51.52 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.407 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.537 ' HA ' ' HG3' ' A' ' 39' ' ' PRO . 67.1 mm-40 -147.56 176.31 10.16 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.78 0.324 . . . . 0.0 111.525 -178.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.442 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 75.7 m -122.82 116.41 23.64 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.999 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.652 ' HB2' ' HD2' ' A' ' 61' ' ' ARG . 60.2 m -132.44 159.95 37.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.016 0.436 . . . . 0.0 111.431 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.431 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -83.47 167.57 17.32 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.893 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.4 t -123.78 156.67 35.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.597 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -87.73 -170.59 3.07 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.339 -179.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.562 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.5 m -60.61 -44.88 97.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.428 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.562 ' HG ' HG23 ' A' ' 28' ' ' VAL . 24.0 mt -80.55 -20.47 43.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.701 0.286 . . . . 0.0 111.279 -179.278 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.69 -18.97 31.54 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 120.827 -0.701 . . . . 0.0 113.792 178.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.4 t -101.81 108.49 23.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 117.286 0.543 . . . . 0.0 111.255 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -179.68 168.34 1.37 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.048 0.451 . . . . 0.0 111.377 179.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -128.97 82.79 2.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.756 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.431 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.0 mt -110.48 137.35 48.3 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.017 -178.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 48.02 84.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.874 178.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 51.4 m -109.6 129.94 55.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.631 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -151.55 163.86 38.1 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.413 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.402 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 7.2 p30 -57.92 133.12 83.42 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.473 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.537 ' HG3' ' HA ' ' A' ' 22' ' ' GLN . 97.5 Cg_endo -90.67 113.45 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.87 2.38 . . . . 0.0 112.302 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -90.5 113.3 0.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 121.919 1.746 . . . . 0.0 112.495 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.79 -178.42 1.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.632 178.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.6 m -110.17 88.37 2.74 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 177.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.8 mt -64.79 119.77 11.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.432 -178.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.41 ' H ' ' HB3' ' A' ' 48' ' ' HIS . . . -116.55 -40.69 3.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.761 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -152.82 -168.69 3.11 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.723 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.78 -39.37 94.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.993 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 46.6 m -71.04 -47.98 55.47 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.863 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.41 ' HB3' ' H ' ' A' ' 44' ' ' ALA . 2.1 t-160 -57.22 -31.22 65.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.081 0.467 . . . . 0.0 109.753 179.373 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -70.48 -39.56 74.15 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.077 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -62.99 -38.58 91.72 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 121.244 0.545 . . . . 0.0 109.912 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 56.9 m -68.29 -16.06 63.81 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.291 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 94.2 m -75.74 -43.31 47.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.549 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.436 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 68.5 m -85.88 -23.46 27.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.346 -179.372 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.83 -20.0 43.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.259 0.552 . . . . 0.0 110.467 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.22 -39.93 93.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.158 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.1 pt -100.4 9.39 8.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.54 42.95 5.65 Favored Glycine 0 CA--C 1.522 0.477 0 C-N-CA 120.415 -0.898 . . . . 0.0 114.108 178.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -146.21 -177.42 5.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.362 0.581 . . . . 0.0 111.081 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 49.1 mtm180 -116.99 151.56 36.48 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.991 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.436 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -80.99 122.24 27.05 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.665 -179.374 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.652 ' HD2' ' HB2' ' A' ' 24' ' ' CYS . 9.5 ptp180 -145.72 125.58 13.52 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.948 0.404 . . . . 0.0 110.135 179.23 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.582 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.0 t -92.41 107.36 19.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.785 -179.068 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 93.0 m -98.21 150.88 21.03 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 121.281 0.563 . . . . 0.0 111.842 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.636 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -98.27 150.14 4.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.876 179.833 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.413 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.4 mt -49.32 138.07 15.18 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.371 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.421 ' O ' HD13 ' A' ' 67' ' ' ILE . 29.4 Cg_exo -62.13 132.98 41.53 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 122.537 2.158 . . . . 0.0 112.581 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.496 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 49.8 mm -131.74 104.71 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.739 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.43 ' HA ' HD12 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -50.71 121.08 5.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.266 -179.905 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 118.51 -11.19 12.57 Favored Glycine 0 CA--C 1.517 0.182 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.77 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 12.5 pt20 -135.33 167.41 21.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.484 0.659 . . . . 0.0 111.347 -179.791 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -81.65 167.64 18.98 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.493 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.4 tt -83.79 124.5 39.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.045 0.45 . . . . 0.0 110.927 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.543 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.5 mm? -101.2 128.47 47.3 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.293 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -160.72 132.57 5.88 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.28 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -151.61 166.11 32.22 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.847 0.356 . . . . 0.0 110.685 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 54.0 m -95.28 138.04 22.0 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.498 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -81.73 137.61 10.15 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.23 1.953 . . . . 0.0 112.756 -179.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.04 2.53 1.05 Allowed 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.928 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.47 38.64 61.99 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.285 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 28.6 mt . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.201 -0.904 . . . . 0.0 111.187 -179.919 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.8 t . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.539 0.209 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -42.68 129.91 5.27 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.932 2.422 . . . . 0.0 112.714 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -111.36 82.6 1.63 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.921 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -106.29 -53.87 2.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.41 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 26.1 ttp -112.9 -8.59 13.69 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 122.091 0.948 . . . . 0.0 108.766 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.607 ' N ' ' CD ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -67.84 -156.81 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.908 -178.871 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.646 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.2 OUTLIER -46.41 121.63 3.54 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.106 0.479 . . . . 0.0 111.022 179.846 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 31.0 tp60 -55.97 148.24 17.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.843 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.548 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -94.65 153.75 40.14 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.97 -179.645 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.548 ' HD2' HG22 ' A' ' 9' ' ' VAL . 86.4 Cg_exo -44.18 125.0 5.33 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.937 2.425 . . . . 0.0 112.906 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -57.01 136.93 56.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.91 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 84.9 m -160.06 97.45 1.5 Allowed Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.184 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.458 ' O ' ' C ' ' A' ' 14' ' ' CYS . 41.5 Cg_endo -80.59 163.91 21.25 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.805 2.337 . . . . 0.0 112.521 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.458 ' C ' ' O ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER 13.63 108.65 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.07 0 O-C-N 124.41 1.068 . . . . 0.0 112.507 -179.874 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.1 m -94.42 116.7 29.1 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.2 -167.25 40.19 Favored Glycine 0 N--CA 1.439 -1.115 0 C-N-CA 120.565 -0.826 . . . . 0.0 113.244 -177.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.53 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.9 tm? -57.91 -37.08 73.38 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.571 -0.815 . . . . 0.0 110.656 178.079 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.769 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -82.93 -37.14 24.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.249 -177.978 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.28 -13.15 0.02 OUTLIER Glycine 0 CA--C 1.528 0.902 0 N-CA-C 115.558 0.983 . . . . 0.0 115.558 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.466 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 20.7 m -107.29 124.36 49.67 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 118.589 1.194 . . . . 0.0 112.202 -178.781 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -89.35 105.22 17.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.026 -179.249 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.451 ' HG2' HG22 ' A' ' 20' ' ' THR . 24.7 mm-40 -130.12 -179.18 5.08 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.082 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.581 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 83.6 m -129.85 117.44 20.2 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.03 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -135.48 160.38 38.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.084 0.468 . . . . 0.0 111.415 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.505 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -85.22 167.0 16.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.732 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.8 t -131.88 157.49 43.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.765 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -80.14 -170.37 2.46 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.059 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.565 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.9 m -63.58 -44.39 98.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.516 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.565 ' HG ' HG23 ' A' ' 28' ' ' VAL . 25.4 mt -79.53 -20.11 47.95 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -178.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.43 -17.56 31.0 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 120.636 -0.792 . . . . 0.0 113.873 179.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 40.1 t -101.4 108.07 22.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 117.493 0.647 . . . . 0.0 111.028 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 177.14 172.0 0.51 Allowed 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.248 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -135.82 96.78 3.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.834 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.505 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.1 mt -124.78 134.6 52.73 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.644 -178.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.7 t70 51.55 83.93 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.515 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.5 m -109.12 129.98 55.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.481 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -153.76 177.4 11.03 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.809 0.338 . . . . 0.0 111.357 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -74.98 137.47 72.87 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.45 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.581 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 65.4 Cg_endo -89.64 112.34 0.52 Allowed 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.83 2.354 . . . . 0.0 112.402 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -90.48 113.53 0.46 Allowed 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 121.897 1.731 . . . . 0.0 112.218 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.52 -177.7 1.03 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.812 179.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 34.7 m -108.0 88.04 2.64 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 177.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.5 mt -64.88 126.71 28.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.653 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.37 -40.34 2.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.864 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -150.27 -167.72 2.9 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.008 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.33 -41.69 76.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.24 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 42.3 m -69.74 -40.17 76.34 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.707 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -60.15 -33.68 72.51 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.445 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 24.9 t80 -67.65 -39.07 84.61 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.61 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -60.24 -38.77 84.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.297 0.57 . . . . 0.0 109.489 178.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 66.3 m -69.83 -22.39 63.29 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.167 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 70.9 m -67.99 -44.51 76.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.45 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.555 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 57.8 m -79.49 -26.25 41.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.296 -179.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.63 -20.37 56.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.454 0.645 . . . . 0.0 110.084 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.64 -37.71 88.52 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 114.881 -1.054 . . . . 0.0 112.097 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.2 pt -102.76 2.44 10.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -178.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.92 41.62 3.76 Favored Glycine 0 CA--C 1.523 0.532 0 C-N-CA 120.288 -0.958 . . . . 0.0 113.903 178.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -148.52 -178.31 6.26 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 117.219 0.509 . . . . 0.0 111.08 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -119.03 152.68 35.99 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.115 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.555 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -65.43 117.25 7.67 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.523 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 14.1 mtp180 -134.16 113.25 11.84 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.005 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.636 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 13.9 t -90.85 107.48 19.21 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.545 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 55.5 m -103.41 148.94 25.29 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -178.262 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.769 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -103.67 145.71 12.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.656 -179.784 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.432 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.8 mt -50.14 138.54 19.6 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.352 -179.624 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 32.2 Cg_exo -62.04 138.06 70.7 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.622 2.215 . . . . 0.0 112.483 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.462 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.4 mm -131.37 107.69 13.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.628 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -48.96 120.0 3.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.002 0.43 . . . . 0.0 111.273 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 117.88 -12.42 13.24 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.852 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 11.8 pt20 -134.93 167.35 21.07 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.606 0.717 . . . . 0.0 111.547 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -82.12 170.2 15.76 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.638 -1.164 . . . . 0.0 110.348 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.0 tt -82.81 127.56 39.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.941 0.401 . . . . 0.0 110.735 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.529 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.8 mm? -101.87 112.7 25.41 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 120.894 0.378 . . . . 0.0 111.259 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 77.8 m -147.22 129.08 15.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.859 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.38 169.86 22.22 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.788 0.327 . . . . 0.0 110.749 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 57.6 m -92.07 136.75 25.59 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.718 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -84.94 141.28 8.32 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.518 2.145 . . . . 0.0 113.077 -179.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.75 3.02 1.06 Allowed 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.883 179.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.62 38.4 67.93 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.357 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 38.6 mt . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.112 179.921 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.6 0.238 . . . . 0.0 110.915 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -57.17 101.57 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.703 2.268 . . . . 0.0 112.288 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.23 90.32 2.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.048 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -104.27 -27.83 11.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.194 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 23.7 mmt -107.63 -13.55 15.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.924 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -86.03 -159.41 0.46 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.539 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.729 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -48.23 116.94 1.72 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.144 0.497 . . . . 0.0 111.02 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -95.02 150.95 19.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.075 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.505 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.9 OUTLIER -101.58 154.26 37.37 Favored Pre-proline 0 CA--C 1.533 0.32 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.014 179.966 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.505 ' HD2' HG22 ' A' ' 9' ' ' VAL . 87.9 Cg_exo -44.61 130.37 9.46 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.891 2.394 . . . . 0.0 112.732 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -55.06 155.26 4.75 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.073 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 65.4 m -130.65 91.97 36.0 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.0 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.517 ' HB2' ' HB2' ' A' ' 21' ' ' ALA . 93.9 Cg_endo -70.48 177.35 6.17 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.772 2.315 . . . . 0.0 112.152 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.496 ' C ' ' O ' ' A' ' 13' ' ' PRO . 25.6 p -15.81 112.95 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.869 0.731 . . . . 0.0 112.318 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.3 m -95.22 117.67 30.66 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.29 -166.38 39.16 Favored Glycine 0 N--CA 1.44 -1.066 0 C-N-CA 120.549 -0.834 . . . . 0.0 113.326 -177.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.531 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.8 tm? -56.23 -37.39 69.65 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.523 -0.839 . . . . 0.0 110.714 178.033 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.79 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -82.65 -39.2 22.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.894 -178.204 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.76 -9.47 0.01 OUTLIER Glycine 0 CA--C 1.528 0.864 0 CA-C-N 115.072 -0.967 . . . . 0.0 115.469 176.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.56 HG22 ' HG2' ' A' ' 22' ' ' GLN . 24.7 m -109.81 123.0 48.79 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 118.382 1.091 . . . . 0.0 112.491 -178.216 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.517 ' HB2' ' HB2' ' A' ' 13' ' ' PRO . . . -86.85 102.51 14.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.793 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.56 ' HG2' HG22 ' A' ' 20' ' ' THR . 25.4 mm-40 -125.27 -170.01 2.09 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.819 -179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.5 t -144.08 121.14 11.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.792 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.09 159.82 41.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.932 0.396 . . . . 0.0 111.206 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -88.64 166.89 13.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.9 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.418 ' HB ' ' NH2' ' A' ' 59' ' ' ARG . 10.3 t -124.94 157.49 35.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.791 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -81.73 -169.78 2.51 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.184 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.55 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.4 m -63.43 -45.32 98.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.653 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.55 ' HG ' HG23 ' A' ' 28' ' ' VAL . 26.8 mt -77.79 -20.1 53.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.583 0.23 . . . . 0.0 111.474 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.87 -17.66 32.39 Favored Glycine 0 CA--C 1.522 0.53 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.567 179.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.415 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 43.9 t -101.99 107.99 22.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 117.301 0.55 . . . . 0.0 111.092 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 176.11 171.77 0.39 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.01 0.434 . . . . 0.0 111.326 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -136.16 86.45 2.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.53 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -110.59 136.4 49.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.873 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.4 t70 51.71 86.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.35 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -108.74 133.76 52.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.87 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -157.55 -178.51 7.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.927 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -82.89 138.75 43.08 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.965 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -88.89 113.1 0.64 Allowed 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.656 2.237 . . . . 0.0 111.991 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -90.59 114.15 0.46 Allowed 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 122.21 1.94 . . . . 0.0 112.639 -179.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.4 -178.22 1.11 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.721 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.9 m -108.05 88.72 2.8 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 177.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mt -63.61 123.0 17.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.358 -178.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.49 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.35 -33.86 3.78 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.739 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.485 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.2 p30 -163.04 -178.97 6.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.979 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.15 -59.63 3.98 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.943 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 44.5 m -60.84 -37.42 82.02 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.834 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.49 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.8 t60 -61.86 -31.29 71.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.054 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.439 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 17.8 t80 -72.07 -40.81 68.03 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.099 179.234 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.499 ' HB2' HD22 ' A' ' 80' ' ' LEU . 30.9 tt0 -62.12 -27.19 68.76 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.051 0.453 . . . . 0.0 110.0 178.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 31.2 t -76.43 -23.77 53.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.47 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 66.5 m -67.31 -38.38 84.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.889 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 3.9 m -85.04 -30.87 23.77 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.317 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.56 -19.7 61.45 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.517 0.675 . . . . 0.0 109.795 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.97 -38.01 89.55 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 114.702 -1.136 . . . . 0.0 112.1 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pt -106.87 6.72 9.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 112.627 0.602 . . . . 0.0 112.627 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.36 44.47 5.28 Favored Glycine 0 CA--C 1.523 0.59 0 C-N-CA 120.385 -0.912 . . . . 0.0 113.864 178.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -147.56 -177.93 5.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 117.346 0.573 . . . . 0.0 111.082 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.418 ' NH2' ' HB ' ' A' ' 26' ' ' THR . 30.6 mtm180 -117.83 155.8 29.48 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.276 -179.309 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.439 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -71.41 118.72 14.58 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.848 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.0 mmt180 -138.17 114.89 10.62 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.039 0.447 . . . . 0.0 111.859 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.613 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 28.7 t -89.82 111.11 22.03 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.591 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 63.6 m -107.92 149.3 28.5 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.79 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -101.64 143.09 15.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 114.937 -1.029 . . . . 0.0 110.475 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.7 mt -50.38 137.04 23.03 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.351 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.417 ' O ' HD13 ' A' ' 67' ' ' ILE . 38.9 Cg_exo -61.24 137.39 70.47 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.485 2.123 . . . . 0.0 112.415 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.47 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 47.8 mm -131.94 109.94 16.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.421 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 68' ' ' LEU . 2.1 pt? -48.18 117.21 1.83 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.292 0.567 . . . . 0.0 110.883 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 120.12 -10.66 10.9 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.487 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.47 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 11.7 pt20 -138.83 168.44 19.81 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.527 0.679 . . . . 0.0 111.219 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -88.03 168.95 12.38 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.822 -1.081 . . . . 0.0 110.306 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.2 tt -83.22 125.25 40.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.919 0.39 . . . . 0.0 110.701 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.583 ' HB2' HG11 ' A' ' 64' ' ' VAL . 3.9 mm? -97.82 111.39 23.7 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.321 -179.342 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 77.0 m -139.39 129.34 24.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.708 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -155.84 164.75 38.13 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.807 0.337 . . . . 0.0 110.926 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.415 ' CG2' ' HB2' ' A' ' 80' ' ' LEU . 92.7 m -100.4 121.98 51.44 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.84 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.99 127.36 23.02 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.413 2.075 . . . . 0.0 111.849 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.26 -115.1 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.099 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -141.26 37.3 1.65 Allowed Glycine 0 N--CA 1.438 -1.188 0 C-N-CA 120.852 -0.69 . . . . 0.0 113.739 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.499 HD22 ' HB2' ' A' ' 50' ' ' GLU . 20.3 mt . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.291 -0.862 . . . . 0.0 110.708 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.563 0.22 . . . . 0.0 110.976 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -57.83 97.05 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.619 2.213 . . . . 0.0 112.082 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -76.77 84.17 3.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.275 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -97.9 -41.21 8.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.706 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 14.4 ptm -104.42 -34.28 8.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.275 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -52.92 -75.59 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.872 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.01 113.12 7.16 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.076 0.465 . . . . 0.0 111.162 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -82.83 -30.33 28.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.789 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.572 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.7 OUTLIER -92.41 154.66 42.76 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.804 -179.947 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.572 ' HD2' HG22 ' A' ' 9' ' ' VAL . 86.7 Cg_exo -45.4 130.88 11.81 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.912 2.408 . . . . 0.0 112.61 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 30.2 t80 -51.45 142.98 12.69 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.212 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 86.1 m -139.14 94.54 9.76 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.159 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -74.74 166.77 28.58 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.635 2.223 . . . . 0.0 111.911 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.488 ' SG ' ' HA ' ' A' ' 21' ' ' ALA . 1.1 m 46.02 -160.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.967 0.413 . . . . 0.0 111.164 -179.286 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.593 ' O ' ' O ' ' A' ' 16' ' ' GLY . 95.5 p -119.47 -159.07 0.76 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.113 0.782 . . . . 0.0 113.113 -178.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.593 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -20.93 -149.8 0.0 OUTLIER Glycine 0 CA--C 1.529 0.95 0 N-CA-C 118.825 2.29 . . . . 0.0 118.825 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.574 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.7 tm? -23.27 -38.18 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 115.417 1.636 . . . . 0.0 115.417 -178.191 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.753 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 1.7 m-85 -67.97 -36.6 80.33 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.121 -0.631 . . . . 0.0 112.078 -177.113 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.36 -17.73 0.01 OUTLIER Glycine 0 CA--C 1.53 0.988 0 N-CA-C 115.416 0.927 . . . . 0.0 115.416 177.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.473 ' H ' ' C ' ' A' ' 18' ' ' TYR . 41.3 m -116.79 151.5 36.34 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 118.388 1.094 . . . . 0.0 112.0 -178.287 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.488 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . . . -116.63 111.43 19.85 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.773 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -135.11 -179.61 5.73 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.53 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.573 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 61.8 m -131.33 108.29 9.55 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.028 179.136 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.452 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 3.3 m -116.61 157.77 24.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.125 -179.007 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.468 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -88.06 165.46 15.14 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.2 t -128.54 157.05 42.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.926 0.393 . . . . 0.0 111.973 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -86.53 -170.22 2.99 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.026 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.536 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.3 m -61.09 -45.13 99.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.357 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.536 ' HG ' HG23 ' A' ' 28' ' ' VAL . 30.2 mt -77.81 -20.35 53.39 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 -179.013 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.38 -14.36 33.07 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 120.541 -0.838 . . . . 0.0 113.643 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.5 t -101.95 108.14 23.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 117.249 0.524 . . . . 0.0 111.033 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.91 152.1 0.34 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.958 0.409 . . . . 0.0 111.539 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -120.76 60.89 0.89 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.261 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.468 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.6 mt -88.57 138.25 31.59 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.364 -0.834 . . . . 0.0 112.433 -178.199 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.6 t70 39.64 81.22 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.552 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.452 ' HB2' ' HB3' ' A' ' 24' ' ' CYS . 37.0 t -128.89 152.17 48.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.056 0.455 . . . . 0.0 111.055 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -170.17 -172.94 1.4 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.05 -179.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -65.12 136.31 96.59 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.557 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.573 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.7 Cg_endo -90.39 114.69 0.5 Allowed 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.882 2.388 . . . . 0.0 112.483 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -91.35 113.76 0.38 Allowed 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.097 1.865 . . . . 0.0 112.255 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.65 -175.55 0.79 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.004 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.1 m -109.68 88.51 2.76 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.8 mt -64.95 123.5 19.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.115 -178.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.484 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.34 -31.36 4.38 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.484 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.7 p30 -164.68 -177.36 4.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.627 0.251 . . . . 0.0 111.137 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.558 ' HB1' HD21 ' A' ' 80' ' ' LEU . . . -52.72 -58.66 6.14 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.868 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 23.7 m -62.25 -37.1 84.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.894 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.484 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.9 t60 -61.52 -33.1 73.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.859 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.419 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 22.0 t80 -70.82 -40.04 72.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.165 179.24 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -64.03 -32.19 73.65 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.09 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.4 m -71.76 -24.29 61.74 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.21 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 52.2 m -66.86 -43.43 83.58 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.391 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.493 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 60.8 m -79.19 -26.78 42.6 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.477 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.62 -20.06 54.48 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.448 0.642 . . . . 0.0 110.372 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.09 -37.82 88.84 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.153 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.3 pt -104.5 4.97 10.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.18 42.08 4.12 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.381 -0.914 . . . . 0.0 113.953 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -148.81 -178.12 6.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 117.309 0.555 . . . . 0.0 111.278 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 77.0 mtp180 -118.46 162.5 18.24 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.056 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.493 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -76.27 119.35 20.04 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.129 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -138.36 110.18 7.17 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.947 0.403 . . . . 0.0 111.468 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.422 ' HB3' ' HB2' ' A' ' 18' ' ' TYR . 48.9 m -79.07 99.91 7.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.558 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 42.6 m -96.61 138.76 33.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.496 0.665 . . . . 0.0 111.874 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.753 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -96.88 146.92 6.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.497 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.7 mt -49.42 136.31 16.99 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.382 -179.377 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 33.2 Cg_exo -60.34 136.8 70.43 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.543 2.162 . . . . 0.0 112.929 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.483 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.9 mm -129.07 104.79 11.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.271 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.25 120.1 2.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.005 0.431 . . . . 0.0 111.235 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 117.01 -10.25 15.4 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.622 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.483 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 11.2 pt20 -137.85 168.36 19.86 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.585 0.707 . . . . 0.0 111.41 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -84.58 170.0 13.84 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.277 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.429 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.5 tt -82.99 126.32 40.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.965 0.412 . . . . 0.0 110.729 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.534 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.0 mm? -97.46 110.81 23.29 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.177 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.429 ' SG ' HG12 ' A' ' 72' ' ' ILE . 50.0 m -146.02 130.82 18.06 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.123 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -160.61 165.67 30.29 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.784 0.325 . . . . 0.0 110.754 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 50.4 m -81.01 136.55 50.38 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.961 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -87.37 137.6 4.35 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.619 2.212 . . . . 0.0 112.887 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.29 2.71 0.89 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.904 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.05 41.84 53.28 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.375 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.558 HD21 ' HB1' ' A' ' 46' ' ' ALA . 36.2 mt . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.24 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 65.9 p . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.545 0.212 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -57.3 132.91 53.91 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.667 2.244 . . . . 0.0 112.296 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.606 ' HB1' ' HB2' ' A' ' 6' ' ' GLU . . . -107.88 95.11 5.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.845 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -100.23 -27.87 13.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.434 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -110.03 -31.86 7.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.232 0.539 . . . . 0.0 110.585 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.606 ' HB2' ' HB1' ' A' ' 3' ' ' ALA . 27.6 mt-10 -51.12 -49.26 61.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.259 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -133.65 58.95 1.75 Allowed 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 122.301 1.048 . . . . 0.0 110.731 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -53.17 141.36 23.51 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 113.514 -1.675 . . . . 0.0 110.979 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.561 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -94.96 153.77 39.83 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.915 -179.85 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.561 ' HD2' HG22 ' A' ' 9' ' ' VAL . 85.5 Cg_exo -44.42 122.16 3.66 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.922 2.415 . . . . 0.0 112.752 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -54.51 147.96 13.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.063 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 29.8 m -86.7 113.99 55.77 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.037 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.434 ' O ' ' O ' ' A' ' 14' ' ' CYS . 72.9 Cg_exo -52.61 -179.52 0.03 OUTLIER 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.967 2.444 . . . . 0.0 113.356 179.534 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.434 ' O ' ' O ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER -37.32 170.83 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 122.018 0.913 . . . . 0.0 112.86 -178.989 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.582 ' O ' ' O ' ' A' ' 16' ' ' GLY . 1.8 m -101.13 -154.02 0.47 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.738 -1.119 . . . . 0.0 112.914 -176.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.582 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -13.32 -145.34 0.0 OUTLIER Glycine 0 CA--C 1.529 0.941 0 N-CA-C 118.355 2.102 . . . . 0.0 118.355 -179.097 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.438 HD22 ' HA ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -20.0 -47.62 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 -176.179 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.485 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 2.6 m-85 -69.85 -38.62 76.51 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.016 0.825 . . . . 0.0 111.369 -178.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 16' ' ' GLY . . . 56.23 -12.52 0.01 OUTLIER Glycine 0 CA--C 1.527 0.831 0 N-CA-C 116.092 1.197 . . . . 0.0 116.092 176.437 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.421 HG22 ' N ' ' A' ' 21' ' ' ALA . 21.2 m -135.31 155.41 50.67 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.849 1.325 . . . . 0.0 112.852 -177.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.424 ' HB1' ' CZ ' ' A' ' 49' ' ' PHE . . . -116.33 103.66 10.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.346 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -124.86 -169.51 2.0 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.872 0.368 . . . . 0.0 111.279 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.9 t -142.14 139.08 32.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.246 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -155.8 171.08 20.64 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.975 0.417 . . . . 0.0 111.181 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.36 168.59 10.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.802 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.1 t -133.9 157.79 45.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.79 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -81.91 -169.86 2.57 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.282 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.522 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.2 m -63.04 -45.08 99.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.737 -179.479 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.522 ' HG ' HG23 ' A' ' 28' ' ' VAL . 26.5 mt -78.38 -20.4 51.32 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.598 0.222 . . . . 0.0 111.598 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.27 -15.82 32.69 Favored Glycine 0 CA--C 1.522 0.491 0 C-N-CA 120.636 -0.793 . . . . 0.0 113.558 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.3 t -101.42 107.56 21.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 117.26 0.53 . . . . 0.0 110.932 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.99 166.62 0.93 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.069 0.462 . . . . 0.0 111.429 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -133.51 89.09 2.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.558 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -119.82 135.83 54.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.696 -178.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.7 t70 51.51 83.83 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.364 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.6 m -108.86 133.01 53.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.7 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -159.47 -179.03 7.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.141 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -78.49 140.3 59.89 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.005 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -90.69 113.86 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 122.906 2.404 . . . . 0.0 111.904 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -90.22 113.51 0.49 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 121.893 1.728 . . . . 0.0 112.845 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.422 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -176.16 -177.59 0.91 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.936 178.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.2 m -108.72 88.88 2.83 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 177.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.3 mt -64.2 124.93 22.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.678 -178.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.514 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.97 -33.01 3.83 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.862 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.473 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.5 p30 -163.5 -177.28 5.16 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.113 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.01 -59.23 4.59 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.929 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 23.0 m -61.82 -38.43 88.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.871 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.514 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.7 t60 -61.17 -32.26 71.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.03 0.443 . . . . 0.0 109.845 179.543 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.431 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 17.7 t80 -69.94 -37.03 75.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.12 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.66 -32.85 74.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.286 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.2 t -70.55 -20.54 62.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.508 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.422 HG23 ' CB ' ' A' ' 41' ' ' ALA . 54.4 m -68.45 -44.02 75.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.118 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 19.0 m -81.11 -28.44 35.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.493 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.85 -19.58 62.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.554 0.693 . . . . 0.0 109.717 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.49 -38.85 90.97 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 114.653 -1.158 . . . . 0.0 112.17 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.8 pt -105.27 8.39 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -179.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.63 38.78 10.24 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 120.438 -0.886 . . . . 0.0 113.452 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -139.21 -175.93 4.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.719 0.26 . . . . 0.0 110.866 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 77.3 mtp180 -120.46 155.36 33.7 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 121.008 0.433 . . . . 0.0 111.903 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.431 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -84.97 124.96 32.28 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.022 -179.46 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.541 ' HE ' ' HB3' ' A' ' 74' ' ' CYS . 13.8 ptm180 -149.49 125.16 10.41 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.131 0.491 . . . . 0.0 110.909 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 31.8 m -85.26 99.61 11.24 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.719 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 59.9 m -90.94 143.21 26.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.331 0.586 . . . . 0.0 111.265 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.528 ' CG1' ' HB2' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -99.77 146.38 8.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.662 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 7.0 mt -49.43 133.09 18.2 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.502 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 24.3 Cg_exo -64.27 139.76 67.45 Favored 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 122.615 2.21 . . . . 0.0 112.596 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 51.0 mm -129.08 109.55 18.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.231 179.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.26 109.16 0.17 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.827 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.46 -13.49 6.22 Favored Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.611 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -133.51 167.71 19.96 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.524 0.678 . . . . 0.0 111.227 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -83.22 169.61 15.57 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.654 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.8 tt -83.19 126.89 40.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.719 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.528 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.1 mm? -101.96 112.21 24.76 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.965 0.412 . . . . 0.0 111.284 -179.387 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.541 ' HB3' ' HE ' ' A' ' 61' ' ' ARG . 63.4 m -143.99 135.09 25.51 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.703 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -158.26 171.24 20.55 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.947 0.403 . . . . 0.0 111.013 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.5 m -99.08 137.01 20.38 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.696 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -87.67 142.16 5.76 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.545 2.163 . . . . 0.0 112.821 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.58 6.5 2.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.782 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.92 36.09 73.16 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.26 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 38.5 mt . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.008 179.902 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 71.6 p . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.625 0.25 . . . . 0.0 111.001 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -58.07 114.24 1.88 Allowed 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.566 2.177 . . . . 0.0 112.152 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -84.43 85.44 7.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.113 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -85.63 -25.77 26.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.013 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.0 ttt -111.49 -30.0 7.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.381 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -82.56 -164.62 0.87 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.877 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.669 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.2 OUTLIER -48.12 121.55 4.39 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.119 0.485 . . . . 0.0 111.183 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.427 ' CG ' ' N ' ' A' ' 9' ' ' VAL . 7.6 pt20 -50.05 -48.92 52.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.515 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.627 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.5 OUTLIER -64.11 154.82 81.22 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.899 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.627 ' HD2' HG22 ' A' ' 9' ' ' VAL . 81.0 Cg_exo -44.25 133.57 9.07 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.926 2.417 . . . . 0.0 112.767 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.09 145.87 24.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.131 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 81.8 m -133.72 93.11 21.59 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.003 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.595 ' HG2' ' HA ' ' A' ' 20' ' ' THR . 74.0 Cg_endo -67.95 170.33 14.49 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.255 1.97 . . . . 0.0 111.69 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.4 t 49.27 -161.25 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.147 0.498 . . . . 0.0 110.778 -178.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.592 ' O ' ' O ' ' A' ' 16' ' ' GLY . 87.5 p -120.25 -156.35 0.66 Allowed 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.529 -178.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.592 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -17.01 -146.92 0.0 OUTLIER Glycine 0 CA--C 1.53 0.981 0 N-CA-C 118.349 2.1 . . . . 0.0 118.349 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.524 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.1 tm? -22.03 -41.41 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 115.19 1.552 . . . . 0.0 115.19 -177.474 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.613 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 2.0 m-85 -69.13 -36.91 78.0 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.093 -0.643 . . . . 0.0 111.947 -177.64 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.87 -14.09 0.02 OUTLIER Glycine 0 CA--C 1.528 0.853 0 N-CA-C 115.495 0.958 . . . . 0.0 115.495 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.595 ' HA ' ' HG2' ' A' ' 13' ' ' PRO . 28.2 m -140.26 144.89 36.7 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 118.471 1.135 . . . . 0.0 112.215 -178.426 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.433 ' HB1' ' CZ ' ' A' ' 49' ' ' PHE . . . -108.59 112.56 24.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.707 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.46 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 16.8 mm-40 -131.32 -175.91 3.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.0 0.429 . . . . 0.0 111.216 -179.388 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.569 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 71.0 m -127.56 109.97 12.25 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.032 179.336 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.536 ' HB2' ' HD3' ' A' ' 61' ' ' ARG . 59.2 m -127.59 155.92 43.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.094 0.474 . . . . 0.0 111.416 -179.08 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -86.42 165.41 16.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.584 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.7 t -126.43 157.22 39.16 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.478 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -80.78 -170.34 2.61 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.106 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.547 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.0 m -62.93 -45.53 98.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -179.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.547 ' HG ' HG23 ' A' ' 28' ' ' VAL . 28.0 mt -78.46 -20.17 51.53 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.647 0.261 . . . . 0.0 111.615 -178.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.29 -16.11 32.45 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.631 -0.795 . . . . 0.0 113.784 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.3 t -101.49 108.11 22.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 117.163 0.481 . . . . 0.0 111.191 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.21 167.17 0.78 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 121.106 0.479 . . . . 0.0 111.492 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -133.04 85.94 2.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.464 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -114.2 141.9 46.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.983 -178.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 46.8 82.1 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.863 178.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 34.2 m -110.0 129.64 55.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.929 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -153.18 -178.07 6.71 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.056 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -78.28 134.86 62.28 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.553 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.569 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.1 Cg_endo -89.61 114.61 0.6 Allowed 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.832 2.355 . . . . 0.0 112.053 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -90.7 112.87 0.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 121.885 1.724 . . . . 0.0 112.342 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -176.0 -176.55 0.83 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.756 179.231 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 42.6 m -111.22 88.58 2.82 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.3 mt -61.44 122.03 14.17 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.397 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.464 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.4 -32.84 4.0 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.94 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.469 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.1 p30 -165.41 -178.92 5.21 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 120.756 0.312 . . . . 0.0 111.307 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.14 -60.14 3.25 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 112.007 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 32.0 m -60.97 -36.57 79.76 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.857 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.469 ' HB3' ' H ' ' A' ' 45' ' ' ASN . 1.6 t60 -62.76 -31.73 72.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.77 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.435 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 13.2 t80 -70.17 -38.66 75.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.958 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -64.55 -34.67 78.8 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.426 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.2 t -72.92 -13.06 61.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.061 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 87.1 m -80.3 -40.83 26.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.232 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.451 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 72.8 m -85.93 -25.43 26.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.261 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.4 -19.91 52.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.363 0.602 . . . . 0.0 110.357 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.7 -37.72 88.56 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.051 -0.977 . . . . 0.0 112.278 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.1 pt -103.28 7.33 9.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.58 40.97 5.22 Favored Glycine 0 CA--C 1.522 0.493 0 C-N-CA 120.408 -0.901 . . . . 0.0 114.041 178.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -146.77 -179.03 6.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.344 0.572 . . . . 0.0 111.142 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 44.0 mtp180 -116.81 153.55 32.27 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.111 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.451 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -77.32 121.22 23.42 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.569 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.558 HH21 ' HB2' ' A' ' 74' ' ' CYS . 13.4 ptm180 -155.6 115.58 3.71 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 121.23 0.538 . . . . 0.0 110.551 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 20' ' ' THR . 33.5 m -79.11 103.21 8.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.745 -179.062 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 23.4 m -94.12 123.94 37.82 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 121.435 0.636 . . . . 0.0 111.572 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.665 HG11 ' HB2' ' A' ' 73' ' ' LEU . 1.5 p -72.85 148.05 9.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.182 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.437 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 7.9 mt -51.88 137.32 35.5 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.931 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 31.2 Cg_exo -60.37 124.78 15.84 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.386 2.057 . . . . 0.0 112.369 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.48 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.0 mm -124.85 101.67 9.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.565 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -48.33 120.21 3.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.14 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.2 -12.18 11.41 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.63 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 12.0 pt20 -135.27 168.45 19.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.396 0.617 . . . . 0.0 111.137 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -84.35 166.25 17.56 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.252 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.454 HG12 ' SG ' ' A' ' 74' ' ' CYS . 15.9 tt -83.31 126.91 40.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.807 0.337 . . . . 0.0 110.575 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.665 ' HB2' HG11 ' A' ' 64' ' ' VAL . 4.0 mm? -99.55 102.22 13.68 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.589 -179.234 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.558 ' HB2' HH21 ' A' ' 61' ' ' ARG . 44.3 m -137.81 131.63 31.44 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.803 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -160.32 163.44 33.32 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.745 0.307 . . . . 0.0 111.218 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.6 m -99.99 116.79 64.31 Favored Pre-proline 0 CA--C 1.532 0.274 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.11 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.21 136.73 61.84 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.663 2.242 . . . . 0.0 112.722 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.25 1.67 0.74 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.05 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.83 38.79 65.65 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.252 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 36.0 mt . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.155 -0.926 . . . . 0.0 111.104 179.934 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 62.6 p . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.613 0.244 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -57.6 97.32 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.705 2.27 . . . . 0.0 112.336 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -102.82 82.84 2.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.212 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.9 -32.22 14.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.906 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.0 ptt? -106.16 -32.59 8.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.207 0.527 . . . . 0.0 110.043 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -76.05 -165.23 0.45 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.683 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.541 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -55.41 119.56 5.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.972 0.415 . . . . 0.0 110.773 179.658 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 10.2 pm0 -57.69 145.68 33.49 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.967 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.551 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -91.97 153.82 43.46 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.81 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.551 ' HD2' HG22 ' A' ' 9' ' ' VAL . 84.9 Cg_exo -44.16 125.77 5.87 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.829 2.352 . . . . 0.0 112.521 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -54.5 147.04 14.81 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.084 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 51.4 m -128.99 91.35 42.93 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.226 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.461 ' O ' ' O ' ' A' ' 14' ' ' CYS . 50.1 Cg_exo -51.41 168.06 0.32 Allowed 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.435 2.09 . . . . 0.0 112.643 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.461 ' O ' ' O ' ' A' ' 13' ' ' PRO . 42.3 t 35.42 108.53 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.317 -0.856 . . . . 0.0 113.161 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.8 p -95.42 115.32 27.26 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 171.31 -165.72 38.77 Favored Glycine 0 N--CA 1.44 -1.074 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.272 -177.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.532 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.7 tm? -61.67 -36.37 80.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.631 -0.784 . . . . 0.0 110.337 177.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.808 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -81.58 -36.01 29.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.256 -178.167 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.79 -11.56 0.02 OUTLIER Glycine 0 CA--C 1.529 0.919 0 N-CA-C 115.859 1.104 . . . . 0.0 115.859 177.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.602 HG22 ' HG2' ' A' ' 22' ' ' GLN . 16.3 m -111.3 126.96 55.46 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 118.792 1.296 . . . . 0.0 112.613 -178.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -96.55 101.35 12.95 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.816 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.602 ' HG2' HG22 ' A' ' 20' ' ' THR . 28.1 mm-40 -128.52 -174.74 3.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.935 0.397 . . . . 0.0 111.145 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.615 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 64.3 m -134.8 114.75 12.93 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.123 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.82 161.42 32.98 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.983 0.421 . . . . 0.0 111.164 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.494 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -87.94 166.34 14.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.675 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.0 t -131.05 157.64 42.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.814 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.11 -169.59 2.47 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.103 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.503 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.9 m -62.0 -47.14 94.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.747 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.503 ' HG ' HG23 ' A' ' 28' ' ' VAL . 33.2 mt -76.91 -19.99 56.74 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -178.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.98 -12.23 31.88 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.353 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.582 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.4 p -100.64 108.72 23.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 117.137 0.469 . . . . 0.0 111.255 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 172.72 153.72 0.08 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.881 -179.571 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -123.88 67.26 1.03 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.632 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.494 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.0 mt -90.3 135.76 33.48 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.466 -178.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 52.23 83.44 0.06 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.39 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.7 m -108.91 134.0 52.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.537 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -160.62 -178.28 6.77 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.838 0.351 . . . . 0.0 111.319 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 -81.33 136.82 49.08 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.725 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.615 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 68.4 Cg_endo -90.51 117.08 0.59 Allowed 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 123.034 2.489 . . . . 0.0 112.746 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -91.31 113.41 0.37 Allowed 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.052 1.835 . . . . 0.0 112.227 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.89 -178.57 1.06 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.833 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.9 m -109.27 88.09 2.65 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 177.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.0 mt -63.08 124.4 21.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.408 -178.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -117.8 -40.33 3.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.981 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -151.08 -168.41 3.09 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.985 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.89 -44.32 81.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.2 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.5 m -68.35 -39.22 81.94 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.552 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -60.25 -34.99 74.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.787 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.418 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 21.4 t80 -68.42 -39.07 81.73 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.932 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -61.78 -39.57 92.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.23 0.538 . . . . 0.0 109.746 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.1 m -68.09 -24.33 65.04 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.171 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 90.4 m -68.56 -43.52 76.45 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.304 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.531 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 59.0 m -78.74 -26.13 44.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.102 -179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.63 -19.93 54.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.4 0.619 . . . . 0.0 110.139 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.05 -37.29 86.89 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.983 -1.008 . . . . 0.0 112.043 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.3 pt -105.39 8.74 9.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 -178.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.67 42.72 5.67 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 120.413 -0.899 . . . . 0.0 114.015 178.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -147.83 -178.55 6.33 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 117.336 0.568 . . . . 0.0 111.192 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -120.31 153.15 36.82 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.338 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.531 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -67.99 117.67 10.16 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.704 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.3 mmm180 -136.02 115.24 12.48 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.988 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.708 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 23.0 t -93.29 109.28 20.81 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.554 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 76.7 m -104.67 148.67 26.31 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.22 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.808 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -99.02 148.32 6.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.761 179.861 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.424 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.2 mt -49.48 140.74 13.38 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.395 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.466 ' O ' HD13 ' A' ' 67' ' ' ILE . 33.0 Cg_exo -59.52 137.98 81.03 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.674 2.249 . . . . 0.0 112.495 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.466 HD13 ' O ' ' A' ' 66' ' ' PRO . 31.1 mm -131.97 108.56 14.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.308 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.414 HD12 ' HA ' ' A' ' 68' ' ' LEU . 0.7 OUTLIER -52.72 121.46 7.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.001 0.429 . . . . 0.0 111.406 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 114.76 -4.58 22.76 Favored Glycine 0 C--N 1.33 0.212 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.682 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 14.2 pt20 -148.67 165.4 31.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.324 0.583 . . . . 0.0 111.189 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -81.37 169.9 16.66 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.648 -179.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.3 tt -82.74 123.65 38.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.116 0.484 . . . . 0.0 110.502 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.526 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.1 mm? -90.52 110.93 22.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.254 -179.171 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 67.2 m -138.15 132.33 31.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.143 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.81 168.64 26.83 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.815 0.34 . . . . 0.0 110.611 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.0 m -96.73 137.25 21.42 Favored Pre-proline 0 CA--C 1.532 0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.761 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -83.48 139.49 9.07 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.418 2.079 . . . . 0.0 112.958 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.06 3.37 1.25 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.038 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.35 38.51 87.3 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.249 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 31.5 mt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.235 179.965 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.9 m . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.725 0.297 . . . . 0.0 110.791 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.23 103.07 0.14 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.668 2.245 . . . . 0.0 112.529 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.58 82.5 1.64 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.825 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -111.07 -33.87 6.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.498 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 9.0 ptp -103.17 -38.13 7.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.013 0.435 . . . . 0.0 110.689 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -77.52 -161.28 0.22 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.833 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.521 ' HD3' ' H ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -47.04 122.66 4.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.131 0.491 . . . . 0.0 111.156 179.891 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -52.79 140.89 22.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.184 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.466 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.9 OUTLIER -98.75 153.69 37.77 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.924 179.893 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.466 ' HD2' HG22 ' A' ' 9' ' ' VAL . 73.4 Cg_exo -47.77 122.92 7.65 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.83 2.353 . . . . 0.0 112.473 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -68.31 148.51 50.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.89 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 98.6 m -132.55 89.68 35.34 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.006 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.714 ' HG2' ' HA ' ' A' ' 20' ' ' THR . 93.2 Cg_endo -75.09 166.46 29.05 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.48 2.12 . . . . 0.0 111.814 179.246 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.6 t 48.54 -163.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.24 0.543 . . . . 0.0 111.093 -178.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.599 ' O ' ' O ' ' A' ' 16' ' ' GLY . 88.7 p -115.16 -156.4 0.6 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.588 -178.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.599 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -17.58 -148.35 0.0 OUTLIER Glycine 0 CA--C 1.529 0.933 0 N-CA-C 118.701 2.241 . . . . 0.0 118.701 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.491 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -23.23 -41.41 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -177.232 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.592 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 5.3 m-85 -68.3 -36.74 79.8 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 119.895 -0.722 . . . . 0.0 111.497 -177.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.2 -12.13 0.01 OUTLIER Glycine 0 CA--C 1.526 0.742 0 N-CA-C 115.644 1.018 . . . . 0.0 115.644 176.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.714 ' HA ' ' HG2' ' A' ' 13' ' ' PRO . 26.9 m -137.91 143.34 40.77 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 118.631 1.216 . . . . 0.0 112.451 -178.143 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.434 ' HB1' ' CZ ' ' A' ' 49' ' ' PHE . . . -110.6 106.39 15.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.554 179.531 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.477 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 20.0 mm-40 -126.18 -176.55 3.68 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.834 0.35 . . . . 0.0 111.309 -179.21 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.506 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 72.6 m -124.64 111.8 16.04 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.159 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.577 ' HB2' ' HD3' ' A' ' 61' ' ' ARG . 63.6 m -128.61 153.84 46.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.208 0.527 . . . . 0.0 111.566 -179.265 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.437 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -84.88 166.81 16.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.667 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.5 t -133.96 158.23 44.03 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.742 -179.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -77.99 -169.93 1.74 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.369 -179.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.536 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.3 m -64.25 -46.61 92.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.722 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.536 ' HG ' HG23 ' A' ' 28' ' ' VAL . 30.7 mt -75.91 -19.94 58.41 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -178.787 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.75 -15.29 31.76 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 120.589 -0.815 . . . . 0.0 113.625 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.4 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 40.4 t -101.49 107.83 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 117.28 0.54 . . . . 0.0 111.006 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 176.17 158.46 0.27 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.315 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -127.48 89.92 3.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.78 179.33 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.437 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.9 mt -116.73 141.91 47.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.798 -178.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.6 t70 48.9 83.3 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.679 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 35.8 m -112.78 131.1 55.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.018 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -161.66 -179.51 7.33 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.878 0.37 . . . . 0.0 111.099 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -73.26 133.16 81.28 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.271 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.506 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 63.7 Cg_endo -90.14 124.11 1.14 Allowed 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.807 2.338 . . . . 0.0 112.14 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -90.85 113.32 0.41 Allowed 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 121.88 1.72 . . . . 0.0 112.34 -179.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.75 -179.69 1.24 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.615 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 48.3 m -109.66 88.03 2.65 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 177.453 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.4 mt -61.84 120.73 11.29 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.201 -178.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.497 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.33 -33.39 3.89 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.904 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.476 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.1 p30 -165.14 -178.76 5.27 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.738 0.304 . . . . 0.0 111.288 -179.722 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.22 -60.71 2.57 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.213 -0.449 . . . . 0.0 112.1 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 22.0 m -60.1 -37.25 79.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.825 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.497 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.6 t60 -62.02 -32.63 73.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.929 179.411 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.439 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 11.0 t80 -69.51 -39.19 77.7 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.881 178.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -63.53 -38.39 90.96 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.009 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.9 m -67.16 -15.48 63.74 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.377 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 91.5 m -79.34 -41.4 27.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.517 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.455 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 74.8 m -86.04 -22.99 26.94 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.251 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.93 -20.02 42.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.388 0.613 . . . . 0.0 110.361 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.1 -37.78 88.68 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.054 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.6 pt -104.42 11.17 8.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.21 43.75 6.51 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.5 -0.857 . . . . 0.0 114.185 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -144.34 179.89 6.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 117.399 0.599 . . . . 0.0 111.136 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -115.32 145.6 42.33 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.195 -179.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.455 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -72.25 123.69 23.49 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.344 -179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.577 ' HD3' ' HB2' ' A' ' 24' ' ' CYS . 13.9 ptm180 -155.86 126.29 6.74 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.929 0.395 . . . . 0.0 110.507 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.406 ' HB3' ' O ' ' A' ' 20' ' ' THR . 25.5 m -90.45 100.74 13.53 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.961 -179.017 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.533 ' HA ' ' HB2' ' A' ' 74' ' ' CYS . 9.2 m -98.32 115.34 28.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.247 0.546 . . . . 0.0 112.234 -178.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.626 HG12 ' O ' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -65.64 146.25 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.466 179.212 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.5 mt -49.81 135.31 20.24 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.261 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -62.43 136.96 62.16 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.506 2.138 . . . . 0.0 112.574 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.491 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 51.2 mm -129.12 104.54 11.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.482 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.59 119.5 2.46 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.035 0.445 . . . . 0.0 111.16 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.43 -12.14 11.22 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.553 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 11.6 pt20 -135.21 168.46 19.11 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.486 0.66 . . . . 0.0 111.207 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -82.24 166.12 19.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.308 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.3 tt -83.53 124.65 39.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-O 120.951 0.405 . . . . 0.0 111.072 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.626 ' O ' HG12 ' A' ' 64' ' ' VAL . 3.7 mm? -101.19 109.42 21.3 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.849 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.533 ' HB2' ' HA ' ' A' ' 63' ' ' CYS . 51.3 t -161.78 133.65 5.59 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.515 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -160.95 171.88 17.91 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.099 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 74.4 m -77.7 136.97 62.88 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.665 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -84.09 134.41 6.04 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.398 2.066 . . . . 0.0 112.887 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.37 2.29 1.13 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.024 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 73.5 42.17 41.77 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.463 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 28.2 mt . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.148 179.907 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 67.6 p . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.615 0.245 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.01 89.83 0.06 OUTLIER 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.733 2.289 . . . . 0.0 112.453 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -92.67 90.79 7.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.017 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -102.49 -34.94 8.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.354 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 11.5 ttp -111.04 -29.11 8.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.715 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -76.19 -166.04 0.56 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.954 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.744 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -47.05 113.01 0.59 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.31 0.576 . . . . 0.0 111.226 -179.839 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.605 ' HG2' ' N ' ' A' ' 9' ' ' VAL . 0.9 OUTLIER -53.83 -47.81 70.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.443 -0.798 . . . . 0.0 111.595 179.826 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.605 ' N ' ' HG2' ' A' ' 8' ' ' GLN . 0.8 OUTLIER -97.55 153.2 38.42 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.155 179.848 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.532 ' HD2' HG22 ' A' ' 9' ' ' VAL . 52.9 Cg_exo -50.04 123.47 10.94 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.95 2.433 . . . . 0.0 112.539 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -67.48 153.04 44.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.701 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 65.7 m -155.34 101.89 2.24 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.263 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.446 ' O ' ' O ' ' A' ' 14' ' ' CYS . 65.3 Cg_endo -76.12 166.37 27.96 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.732 2.288 . . . . 0.0 112.352 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.446 ' O ' ' O ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER 17.44 106.87 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.124 0 O-C-N 124.336 1.022 . . . . 0.0 112.237 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -93.73 116.95 29.46 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.0 -166.18 39.02 Favored Glycine 0 N--CA 1.439 -1.128 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.996 -177.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.523 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.7 tm? -59.05 -36.73 75.53 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.596 -0.802 . . . . 0.0 110.686 178.07 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.758 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -82.29 -37.58 25.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.141 -178.106 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.07 -12.34 0.02 OUTLIER Glycine 0 CA--C 1.529 0.911 0 N-CA-C 115.586 0.994 . . . . 0.0 115.586 177.296 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.529 HG22 ' HG2' ' A' ' 22' ' ' GLN . 17.9 m -109.1 123.87 49.88 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 118.625 1.212 . . . . 0.0 112.194 -178.664 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.2 102.29 14.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.931 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.529 ' HG2' HG22 ' A' ' 20' ' ' THR . 26.2 mm-40 -128.41 -174.22 3.17 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.051 0.453 . . . . 0.0 111.249 -179.28 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.571 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 70.9 m -128.03 116.14 19.56 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.031 179.327 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.556 ' HB2' ' HD3' ' A' ' 61' ' ' ARG . 78.2 m -129.77 158.49 39.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.068 0.461 . . . . 0.0 111.407 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.32 165.71 12.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.569 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.2 t -125.55 157.39 37.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.78 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -81.48 -170.1 2.62 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.224 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.529 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.3 m -62.65 -47.1 94.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.529 ' HG ' HG23 ' A' ' 28' ' ' VAL . 29.1 mt -77.65 -20.28 54.04 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.587 0.232 . . . . 0.0 111.531 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.21 -17.47 31.65 Favored Glycine 0 CA--C 1.522 0.483 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.696 179.018 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.415 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 49.0 t -101.61 108.07 22.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 117.276 0.538 . . . . 0.0 111.142 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 175.45 170.9 0.32 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.058 0.456 . . . . 0.0 111.328 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -133.28 95.05 3.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.58 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mt -120.53 140.52 51.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.892 -178.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.6 t70 48.1 82.53 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.795 178.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 47.1 m -113.13 129.79 56.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.821 179.405 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.76 -178.28 7.14 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.979 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -73.92 136.94 76.4 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.496 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.571 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.1 Cg_endo -89.47 117.17 0.75 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.826 2.35 . . . . 0.0 112.276 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -90.52 112.74 0.43 Allowed 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 121.765 1.643 . . . . 0.0 112.561 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -176.28 -176.35 0.77 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.647 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.6 m -110.84 88.54 2.8 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.425 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -63.09 124.32 20.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.382 -178.419 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.474 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.73 -33.72 3.73 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.75 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.476 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.8 p30 -163.2 -178.6 6.08 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.157 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.13 -59.68 3.92 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.333 -0.394 . . . . 0.0 112.005 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 35.0 m -61.54 -36.1 79.64 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.975 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.476 ' HB3' ' H ' ' A' ' 45' ' ' ASN . 1.9 t60 -62.44 -32.95 73.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.824 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.49 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 18.3 t80 -70.34 -39.56 74.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.944 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -60.63 -36.85 79.66 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.27 0.557 . . . . 0.0 109.773 178.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 51.1 m -67.34 -22.73 65.58 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.479 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 75.6 m -70.07 -43.77 70.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.551 -179.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.538 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 81.0 m -83.02 -24.94 32.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.189 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.96 -19.92 56.75 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.414 0.626 . . . . 0.0 110.115 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.97 -38.86 92.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.891 -1.049 . . . . 0.0 112.137 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.8 pt -101.76 9.91 8.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.41 39.47 6.33 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.554 -0.831 . . . . 0.0 114.225 178.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -146.41 -177.47 5.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 117.161 0.481 . . . . 0.0 111.131 179.378 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 58.3 mtt180 -119.97 154.96 33.73 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.682 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.538 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -65.9 119.61 11.62 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.364 -179.546 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.556 ' HD3' ' HB2' ' A' ' 24' ' ' CYS . 39.6 mtp180 -135.93 118.29 15.7 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.161 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.664 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 14.2 t -96.19 107.04 19.32 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.556 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 54.3 m -102.8 146.94 27.5 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.365 0.602 . . . . 0.0 112.548 -178.393 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.758 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -97.76 143.85 12.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.55 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.9 mt -49.66 139.55 15.64 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.212 -179.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 31.5 Cg_exo -59.28 132.8 48.71 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.54 2.16 . . . . 0.0 112.5 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.468 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 51.1 mm -129.55 106.94 14.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.763 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.21 120.47 5.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.301 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.07 -12.53 11.46 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.635 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.468 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 12.6 pt20 -135.44 167.25 21.42 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.504 0.668 . . . . 0.0 111.299 -179.771 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -81.84 169.87 16.36 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.218 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.1 tt -82.8 125.71 40.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.895 0.378 . . . . 0.0 110.928 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.559 ' HB2' HG11 ' A' ' 64' ' ' VAL . 3.8 mm? -101.61 113.01 25.76 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.01 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 72.5 m -146.45 129.12 16.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.048 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -160.87 170.13 21.28 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 120.867 0.365 . . . . 0.0 110.986 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 85.4 m -92.61 136.41 25.24 Favored Pre-proline 0 CA--C 1.532 0.28 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.001 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -86.89 144.36 7.3 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.685 2.257 . . . . 0.0 112.599 -179.626 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 68.36 -0.94 2.02 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.759 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.11 35.7 64.26 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.578 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 42.1 mt . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.253 -0.879 . . . . 0.0 111.172 179.934 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 59.3 m . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.209 0.052 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_exo -41.1 140.01 1.38 Allowed 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.802 2.335 . . . . 0.0 112.782 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.51 ' HB1' ' HB2' ' A' ' 6' ' ' GLU . . . -128.26 91.82 3.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.139 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -98.77 -37.43 9.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.808 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 23.8 mmt -110.04 -8.08 14.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.773 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.51 ' HB2' ' HB1' ' A' ' 3' ' ' ALA . 30.7 mt-10 -78.43 -113.99 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.676 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.406 ' HD3' ' C ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER 43.7 82.0 0.03 OUTLIER 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.888 0.851 . . . . 0.0 110.852 -179.842 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -92.54 120.67 33.22 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.074 -1.421 . . . . 0.0 110.849 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.629 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.5 OUTLIER -66.55 153.5 93.12 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.919 -179.795 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.629 ' HD2' HG22 ' A' ' 9' ' ' VAL . 73.1 Cg_exo -47.1 120.9 4.63 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.857 2.371 . . . . 0.0 112.85 179.84 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -78.6 151.17 32.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.756 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 91.6 m -59.71 111.98 4.64 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.831 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.36 176.49 0.11 Allowed 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.646 2.231 . . . . 0.0 112.713 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 14.6 p -39.46 114.89 0.45 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.541 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.6 p -97.59 116.89 30.68 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 173.35 -155.17 21.92 Favored Glycine 0 N--CA 1.435 -1.387 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.57 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.483 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.8 tm? -62.96 -42.45 99.83 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.762 0.425 . . . . 0.0 111.225 178.478 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.802 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -78.1 -38.15 44.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.179 0.514 . . . . 0.0 112.028 -178.222 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.9 -8.92 0.02 OUTLIER Glycine 0 CA--C 1.527 0.785 0 CA-C-N 115.148 -0.933 . . . . 0.0 115.288 176.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.429 HG22 ' HG2' ' A' ' 22' ' ' GLN . 89.9 m -112.54 123.05 49.44 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 118.491 1.145 . . . . 0.0 112.546 -178.483 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.1 118.49 27.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.081 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.429 ' HG2' HG22 ' A' ' 20' ' ' THR . 77.5 mm-40 -146.52 167.79 22.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.858 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.508 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 60.8 m -117.45 113.29 21.83 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.09 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.09 156.35 49.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.018 0.437 . . . . 0.0 111.269 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.519 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -80.56 166.35 21.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.747 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.4 t -131.02 157.68 42.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.927 -179.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -82.17 -169.6 2.48 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.237 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.566 HG23 ' HG ' ' A' ' 29' ' ' LEU . 8.5 m -62.65 -46.16 97.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.612 -179.438 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.566 ' HG ' HG23 ' A' ' 28' ' ' VAL . 29.3 mt -78.42 -20.12 51.77 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 -178.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.43 -15.36 32.56 Favored Glycine 0 CA--C 1.52 0.402 0 C-N-CA 120.633 -0.794 . . . . 0.0 113.575 179.241 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.5 t -101.53 108.13 22.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 117.244 0.522 . . . . 0.0 111.181 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 177.68 168.39 0.68 Allowed 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.264 179.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.412 ' HB2' HD13 ' A' ' 72' ' ' ILE . 10.1 t70 -134.42 90.38 2.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.731 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.1 mt -118.6 135.91 54.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.605 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 51.9 84.08 0.05 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.349 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -109.29 134.96 51.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.863 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.7 164.24 36.09 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.182 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -60.92 136.01 93.24 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.914 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.508 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.7 Cg_endo -90.16 109.66 0.4 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.825 2.35 . . . . 0.0 112.3 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -91.21 113.88 0.39 Allowed 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.124 1.883 . . . . 0.0 112.741 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.417 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.47 -177.44 1.0 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.788 178.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.3 m -109.09 88.65 2.78 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.0 mt -65.61 120.16 12.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.352 -178.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -117.32 -40.58 3.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.791 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -151.99 -169.09 3.26 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.969 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.46 -48.48 77.53 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.423 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 27.8 m -66.75 -42.05 86.83 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.679 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -60.04 -32.82 71.27 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.173 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.535 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 13.9 t80 -68.54 -38.88 81.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.866 178.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -62.45 -37.39 85.7 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.143 0.497 . . . . 0.0 109.769 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.0 m -69.6 -13.37 62.28 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.616 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.417 HG23 ' CB ' ' A' ' 41' ' ' ALA . 49.8 m -75.08 -44.89 44.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.436 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.504 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 60.4 m -84.99 -25.52 27.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.974 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.3 -20.16 59.27 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.519 0.676 . . . . 0.0 109.921 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.46 -38.57 90.22 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.733 -1.121 . . . . 0.0 112.145 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.1 pt -100.98 -0.93 10.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.98 39.69 2.83 Favored Glycine 0 CA--C 1.521 0.446 0 C-N-CA 120.284 -0.96 . . . . 0.0 113.963 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -149.8 -177.21 5.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 117.057 0.428 . . . . 0.0 110.906 179.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 53.5 mtt180 -118.76 154.82 32.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.843 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.535 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -70.37 116.62 10.92 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.256 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.8 mmm180 -133.56 118.42 18.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.038 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.673 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 34.7 t -94.32 108.62 20.5 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.42 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.568 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 65.5 m -105.82 146.01 30.45 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.399 0.619 . . . . 0.0 112.551 -178.312 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.802 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -95.18 146.95 6.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.39 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.4 mt -49.49 135.64 17.78 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.369 -179.184 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 30.8 Cg_exo -62.32 136.47 59.85 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.571 2.18 . . . . 0.0 112.452 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.5 mm -129.92 109.02 17.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.417 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.54 109.29 0.29 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.058 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.97 -11.62 6.19 Favored Glycine 0 C--N 1.333 0.384 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.882 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -135.8 167.87 20.36 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.484 0.659 . . . . 0.0 111.41 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -81.39 166.95 19.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.301 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.412 HD13 ' HB2' ' A' ' 33' ' ' ASP . 17.9 tt -83.3 124.32 39.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 121.037 0.446 . . . . 0.0 110.803 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.529 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.0 mm? -97.68 110.39 22.96 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.224 -179.425 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 68.2 m -141.15 130.83 24.11 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.595 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 85.1 mt-30 -154.78 161.18 41.6 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.781 0.324 . . . . 0.0 110.874 -179.385 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 71.4 m -100.56 123.52 45.79 Favored Pre-proline 0 CA--C 1.533 0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.127 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -67.21 140.79 54.77 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.563 2.175 . . . . 0.0 112.714 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.11 2.32 1.04 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.061 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.68 35.07 73.41 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.408 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.3 mt . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.996 179.897 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 74.4 p . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.532 0.206 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -57.59 117.46 4.17 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.621 2.214 . . . . 0.0 112.16 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.55 ' HB1' ' HB2' ' A' ' 6' ' ' GLU . . . -140.21 91.98 2.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.228 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -99.65 -22.68 15.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.094 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.2 ptp -104.58 -34.42 8.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.439 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.575 ' HB2' ' HD3' ' A' ' 7' ' ' ARG . 23.0 mt-10 -60.51 -51.81 67.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.05 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.575 ' HD3' ' HB2' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -164.26 91.58 0.62 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.665 0.745 . . . . 0.0 110.801 179.675 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -48.83 145.31 3.9 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.226 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.563 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -97.71 155.14 37.52 Favored Pre-proline 0 CA--C 1.532 0.28 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.737 179.908 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.563 ' HD2' HG22 ' A' ' 9' ' ' VAL . 88.4 Cg_exo -44.84 131.78 10.44 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.672 2.248 . . . . 0.0 112.7 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -54.6 149.72 10.37 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.085 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 87.8 m -125.21 99.47 34.03 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.189 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.402 ' O ' ' C ' ' A' ' 14' ' ' CYS . 59.4 Cg_exo -53.1 176.7 0.07 OUTLIER 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.723 2.282 . . . . 0.0 113.169 179.625 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.402 ' C ' ' O ' ' A' ' 13' ' ' PRO . 0.5 OUTLIER -30.38 111.92 0.08 Allowed 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.723 -179.947 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.8 p -96.27 115.57 27.64 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.12 -155.08 22.94 Favored Glycine 0 N--CA 1.436 -1.31 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.397 -177.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.5 tm? -67.16 -40.13 86.6 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.899 0.381 . . . . 0.0 110.717 177.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.759 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.2 OUTLIER -75.23 -37.97 60.84 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.268 0.556 . . . . 0.0 111.422 -178.8 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.75 -9.44 0.02 OUTLIER Glycine 0 CA--C 1.524 0.651 0 CA-C-N 114.922 -1.035 . . . . 0.0 114.945 177.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.526 HG22 ' HG2' ' A' ' 22' ' ' GLN . 6.0 m -109.56 142.36 40.76 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 118.16 0.98 . . . . 0.0 112.212 -178.333 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -113.74 100.64 8.61 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.484 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.563 ' NE2' ' HA ' ' A' ' 38' ' ' ASN . 6.1 mm-40 -134.23 -177.74 4.72 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.919 0.39 . . . . 0.0 111.349 -178.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.511 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 56.9 m -126.34 106.82 9.78 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 178.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.438 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 2.0 m -109.08 154.46 22.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.604 -178.617 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -91.0 166.97 12.73 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.699 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.3 t -131.86 158.25 41.82 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -179.274 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.93 -169.63 2.09 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.198 -179.608 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.536 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.1 m -63.56 -46.34 95.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.676 -179.5 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.536 ' HG ' HG23 ' A' ' 28' ' ' VAL . 34.3 mt -76.25 -19.65 58.13 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -178.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.97 -13.29 31.81 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.566 -0.826 . . . . 0.0 113.497 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.416 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 61.1 t -101.45 108.05 22.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 117.132 0.466 . . . . 0.0 111.108 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 176.13 163.4 0.37 Allowed 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.406 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -134.56 65.95 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.431 179.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 mt -93.15 138.38 31.62 Favored 'General case' 0 C--O 1.226 -0.159 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.567 -178.081 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 43.95 83.42 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.769 177.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.438 ' HB2' ' HB3' ' A' ' 24' ' ' CYS . 21.0 t -133.33 136.38 45.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.91 0.386 . . . . 0.0 110.66 179.451 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -164.1 -174.87 3.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.503 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.563 ' HA ' ' NE2' ' A' ' 22' ' ' GLN . 6.3 p30 -58.43 126.35 78.67 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.702 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.511 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 68.4 Cg_endo -90.57 134.37 1.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 122.751 2.301 . . . . 0.0 112.293 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -91.66 113.76 0.36 Allowed 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.207 1.938 . . . . 0.0 112.839 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.406 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.63 -178.63 1.12 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.021 179.029 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.0 m -110.33 88.47 2.77 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 177.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.9 mt -64.56 120.15 11.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.41 -178.402 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -115.36 -40.94 3.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.78 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -152.01 -169.02 3.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.806 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.11 -41.56 94.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.221 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.1 m -70.61 -44.47 67.17 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.759 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -58.56 -34.88 71.53 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.177 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.447 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 13.5 t80 -67.32 -38.33 84.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.581 178.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -60.66 -40.51 92.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.222 0.535 . . . . 0.0 109.761 178.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.6 m -66.3 -23.85 66.45 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.442 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.406 HG23 ' CB ' ' A' ' 41' ' ' ALA . 66.4 m -63.97 -45.93 86.9 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.501 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 61.1 m -80.11 -28.75 38.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.25 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.92 -20.08 61.82 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.579 0.704 . . . . 0.0 109.948 -179.101 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.45 -36.61 84.72 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.876 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.3 pt -108.71 1.08 9.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -179.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.84 43.46 2.64 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 120.324 -0.941 . . . . 0.0 114.306 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -148.83 174.64 12.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 117.468 0.634 . . . . 0.0 110.923 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.437 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 11.7 ptm180 -119.01 142.18 48.04 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.766 0.317 . . . . 0.0 110.992 -179.682 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.447 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -60.51 125.77 24.92 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.167 -179.181 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.468 ' HB2' ' SG ' ' A' ' 74' ' ' CYS . 8.6 ptm180 -153.63 127.87 9.12 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.125 179.117 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.42 ' HB2' ' CD2' ' A' ' 18' ' ' TYR . 6.4 m -95.02 105.11 17.0 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.846 -178.294 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 3.9 m -105.58 136.24 45.52 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.12 0.486 . . . . 0.0 111.934 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.759 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -85.29 148.4 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.922 179.911 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.7 mt -49.5 137.7 16.59 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.126 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 37.2 Cg_exo -60.79 137.12 70.74 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 122.458 2.105 . . . . 0.0 112.464 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.462 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 51.1 mm -129.56 106.1 13.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.565 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.412 ' HA ' HD12 ' A' ' 68' ' ' LEU . 0.6 OUTLIER -47.63 120.69 3.47 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.379 -179.716 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 116.21 -11.93 16.91 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.718 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 11.1 pt20 -138.6 169.51 17.67 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.492 0.663 . . . . 0.0 111.335 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -84.4 165.34 18.27 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.968 179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.9 tt -83.66 122.97 38.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.206 0.527 . . . . 0.0 110.938 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.619 ' O ' HG12 ' A' ' 64' ' ' VAL . 4.1 mm? -92.53 115.33 28.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.571 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.468 ' SG ' ' HB2' ' A' ' 61' ' ' ARG . 51.7 t -161.03 137.63 8.59 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.572 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -160.34 167.39 27.54 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.199 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 84.1 m -87.79 137.11 31.95 Favored Pre-proline 0 CA--C 1.531 0.229 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.83 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -84.21 141.24 9.1 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 122.496 2.131 . . . . 0.0 112.902 -179.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.98 1.03 1.06 Allowed 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.05 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.02 37.92 64.07 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.32 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 37.1 mt . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.145 -179.951 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 53.0 m . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.493 0.187 . . . . 0.0 111.048 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.05 90.66 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.649 2.232 . . . . 0.0 112.296 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.23 89.24 3.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.911 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -98.07 -44.81 6.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.3 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -103.87 -2.04 26.84 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.294 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -86.21 -72.49 0.49 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.984 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.61 117.27 8.11 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 120.983 0.42 . . . . 0.0 110.918 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -56.41 145.76 26.46 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.745 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.659 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.5 OUTLIER -84.3 152.87 61.96 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.694 179.912 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.659 ' HD2' HG22 ' A' ' 9' ' ' VAL . 82.8 Cg_exo -43.81 127.09 6.22 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.862 2.375 . . . . 0.0 112.564 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 31.0 t80 -52.77 153.04 3.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.294 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 44.9 m -118.9 95.63 49.41 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.047 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -52.55 176.65 0.06 OUTLIER 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.795 2.33 . . . . 0.0 113.191 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -37.08 109.01 0.09 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.738 -179.772 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.6 p -95.34 115.5 27.52 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 178.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.46 -154.81 22.05 Favored Glycine 0 N--CA 1.436 -1.334 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.772 -177.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.463 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.6 tm? -66.32 -40.8 90.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.169 -0.515 . . . . 0.0 110.896 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.781 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -76.04 -37.84 57.86 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.495 0.664 . . . . 0.0 111.117 -179.055 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.87 -8.23 0.02 OUTLIER Glycine 0 CA--C 1.525 0.665 0 CA-C-N 114.733 -1.121 . . . . 0.0 114.8 177.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.536 HG22 ' HG2' ' A' ' 22' ' ' GLN . 23.3 m -108.72 142.98 38.44 Favored 'General case' 0 N--CA 1.457 -0.087 0 CA-C-N 118.016 0.908 . . . . 0.0 112.194 -178.572 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.445 ' O ' ' HG3' ' A' ' 39' ' ' PRO . . . -107.9 101.72 10.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.038 179.241 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.536 ' HG2' HG22 ' A' ' 20' ' ' THR . 27.8 mm-40 -126.33 -179.28 4.67 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 121.137 0.494 . . . . 0.0 111.505 -179.12 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.596 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 77.4 m -133.86 117.44 16.82 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.84 179.347 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.08 -179.04 5.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.843 0.354 . . . . 0.0 111.083 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.476 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -111.32 165.66 11.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.815 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.1 t -129.77 157.08 43.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.8 -179.519 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.07 -170.18 2.9 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.092 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.556 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.4 m -61.76 -45.97 97.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.672 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.556 ' HG ' HG23 ' A' ' 28' ' ' VAL . 30.3 mt -77.5 -20.08 54.87 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.59 -13.22 32.82 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.561 -0.828 . . . . 0.0 113.424 179.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.412 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 22.5 t -101.16 107.83 22.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 117.255 0.527 . . . . 0.0 110.957 179.575 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.412 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 174.46 154.36 0.13 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.177 179.761 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -123.55 59.54 1.11 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.76 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.476 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 3.3 mt -81.46 135.64 35.63 Favored 'General case' 0 C--O 1.227 -0.108 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.849 -178.745 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.0 t70 51.0 83.23 0.05 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.78 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.6 m -109.28 132.09 54.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.379 179.302 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.07 -177.1 6.31 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.892 0.377 . . . . 0.0 111.647 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -77.7 138.14 62.54 Favored Pre-proline 0 CA--C 1.532 0.27 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.357 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.596 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 62.6 Cg_endo -90.72 110.75 0.37 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.021 2.481 . . . . 0.0 112.993 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -91.5 113.69 0.37 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.002 1.802 . . . . 0.0 112.032 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.14 -178.38 1.19 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.985 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.2 m -110.53 88.68 2.83 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.3 mt -63.52 122.08 15.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.274 -178.439 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.507 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.36 -33.4 3.88 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.753 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.475 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.1 p30 -162.88 -178.05 5.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.073 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.62 -61.51 2.15 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.102 -179.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 34.2 m -60.81 -35.93 77.75 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.956 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.507 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.7 t60 -62.19 -32.93 73.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.016 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.493 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 29.3 t80 -71.08 -39.97 71.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.142 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -61.39 -35.63 78.05 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.219 0.533 . . . . 0.0 109.735 178.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.2 m -67.71 -24.0 65.34 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.195 179.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 51.6 m -65.03 -45.66 84.54 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.439 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.547 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 38.3 m -81.73 -26.17 34.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.14 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.27 -20.2 59.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.452 0.644 . . . . 0.0 110.151 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.59 -36.88 85.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.062 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.5 pt -107.48 14.2 8.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -179.064 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.34 41.9 8.22 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.421 -0.895 . . . . 0.0 113.546 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.1 mt-30 -143.71 -178.81 6.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 117.034 0.417 . . . . 0.0 111.074 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.449 ' HD3' HH21 ' A' ' 61' ' ' ARG . 99.2 mtt180 -122.99 151.59 41.7 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.406 -179.338 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.547 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -66.91 120.05 12.94 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.326 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.449 HH21 ' HD3' ' A' ' 59' ' ' ARG . 13.9 mmt180 -138.9 125.74 20.96 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.964 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 22.4 m -100.03 99.94 10.74 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.401 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 4.0 m -104.07 141.11 36.79 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -177.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.781 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.4 OUTLIER -97.77 144.11 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.181 179.255 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.1 mt -53.25 135.08 50.92 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.753 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -66.82 141.06 57.79 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.545 2.163 . . . . 0.0 112.74 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.443 ' O ' ' C ' ' A' ' 68' ' ' LEU . 1.8 mp -112.68 102.99 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.443 ' C ' ' O ' ' A' ' 67' ' ' ILE . 0.3 OUTLIER -30.32 108.67 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.928 0.394 . . . . 0.0 111.206 -179.675 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 121.78 -8.89 9.93 Favored Glycine 0 C--N 1.333 0.395 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.374 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -135.67 170.21 16.33 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.516 0.674 . . . . 0.0 111.339 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -85.9 169.9 12.85 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.33 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.3 tt -83.28 126.66 40.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.076 0.465 . . . . 0.0 111.024 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.561 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.9 mm? -98.43 119.78 37.72 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.113 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.438 ' SG ' ' HB3' ' A' ' 61' ' ' ARG . 41.8 t -161.56 137.81 8.11 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.47 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -160.81 170.74 20.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.82 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.9 m -89.88 137.25 28.4 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.826 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -86.8 142.77 6.84 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.693 2.262 . . . . 0.0 112.787 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 66.65 -1.32 1.34 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.92 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.18 36.52 63.85 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.452 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.1 mt . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.229 179.969 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 56.6 m . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.607 0.242 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -56.78 113.45 1.47 Allowed 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.664 2.243 . . . . 0.0 112.351 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.47 ' HB1' ' HB2' ' A' ' 6' ' ' GLU . . . -146.06 104.01 3.79 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.322 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -95.54 -28.66 14.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.933 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 9.8 ttm -110.87 -28.98 8.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.105 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.47 ' HB2' ' HB1' ' A' ' 3' ' ' ALA . 19.8 mt-10 -81.15 -158.42 0.21 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.584 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.69 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -49.18 119.69 3.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.989 179.859 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -51.95 139.03 23.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.93 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.578 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -88.81 154.71 50.33 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.946 -179.823 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.578 ' HD2' HG22 ' A' ' 9' ' ' VAL . 82.4 Cg_exo -43.55 123.97 3.99 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.884 2.389 . . . . 0.0 112.51 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -57.81 157.43 7.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.075 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 84.7 m -117.02 126.18 27.67 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.072 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_exo -58.2 176.78 0.33 Allowed 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.52 2.147 . . . . 0.0 112.433 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -42.41 126.06 3.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.927 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.4 p -103.87 116.04 31.55 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 173.13 -154.89 21.59 Favored Glycine 0 N--CA 1.434 -1.443 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.743 -177.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.478 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.5 tm? -65.56 -40.63 93.02 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.31 -0.445 . . . . 0.0 110.96 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.783 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -77.43 -39.04 48.29 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.233 0.539 . . . . 0.0 111.645 -178.347 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.4 -12.91 0.01 OUTLIER Glycine 0 CA--C 1.528 0.87 0 N-CA-C 115.919 1.128 . . . . 0.0 115.919 176.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.426 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 25.6 m -110.73 129.11 55.92 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 118.78 1.29 . . . . 0.0 112.683 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.38 115.99 28.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.431 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.499 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 18.9 mm-40 -135.53 -178.24 5.03 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.03 0.443 . . . . 0.0 111.366 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.545 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 98.1 m -138.02 100.42 4.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.837 179.192 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 4.5 t -118.89 177.88 4.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.903 -179.136 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.423 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -104.08 166.94 10.09 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.8 -179.819 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.2 t -129.19 157.8 40.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.674 -179.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.417 ' H ' ' HB3' ' A' ' 32' ' ' ALA . 1.5 p-10 -77.64 -170.02 1.68 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.051 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.538 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.8 m -65.19 -44.67 95.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.516 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.538 ' HG ' HG23 ' A' ' 28' ' ' VAL . 31.3 mt -76.6 -19.36 57.93 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.88 -16.86 30.46 Favored Glycine 0 CA--C 1.521 0.465 0 C-N-CA 120.541 -0.838 . . . . 0.0 113.79 179.214 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 66.2 t -101.48 107.68 21.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 117.464 0.632 . . . . 0.0 111.074 179.562 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.417 ' HB3' ' H ' ' A' ' 27' ' ' ASP . . . 175.74 168.42 0.38 Allowed 'General case' 0 C--O 1.231 0.113 0 CA-C-O 121.091 0.472 . . . . 0.0 111.389 179.488 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -135.24 65.41 1.56 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.58 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.423 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.6 mt -87.57 132.23 34.13 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.119 -178.619 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.9 t70 51.17 84.75 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.562 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 86.8 m -108.12 129.72 55.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.121 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -148.17 -178.98 6.6 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.861 0.362 . . . . 0.0 111.433 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -73.79 137.94 76.76 Favored Pre-proline 0 CA--C 1.531 0.246 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.75 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.545 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 63.8 Cg_endo -90.88 109.73 0.34 Allowed 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 123.044 2.496 . . . . 0.0 112.609 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -91.01 113.73 0.4 Allowed 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 121.948 1.765 . . . . 0.0 112.387 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.27 177.27 1.9 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.887 178.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.1 m -106.99 88.11 2.66 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 177.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mt -61.8 122.71 16.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.252 -178.373 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.487 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.59 -31.72 4.22 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 116.232 -0.44 . . . . 0.0 112.074 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.472 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.0 p30 -166.24 -179.53 5.12 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.708 0.289 . . . . 0.0 111.337 -179.46 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.98 -59.17 4.14 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.026 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.6 m -60.26 -36.64 78.27 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.792 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.487 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.8 t60 -62.49 -33.81 75.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.861 179.295 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -69.05 -34.48 75.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.184 179.232 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -70.29 -24.06 62.97 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.626 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 29.5 t -85.43 -12.76 51.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.315 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 60.4 m -72.15 -44.17 63.52 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.756 0.312 . . . . 0.0 111.284 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.492 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 48.2 m -84.67 -25.48 28.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.069 -179.781 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.45 -20.06 57.42 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.471 0.653 . . . . 0.0 110.176 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.2 -36.53 82.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.946 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.5 pt -105.36 -4.5 9.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 112.951 0.722 . . . . 0.0 112.951 -178.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 103.98 39.59 2.46 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 120.272 -0.966 . . . . 0.0 114.133 178.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -143.94 -178.89 6.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 117.265 0.533 . . . . 0.0 111.069 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -114.95 149.77 36.79 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.327 -179.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.492 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -76.22 121.15 22.49 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.831 -179.24 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.499 HH21 ' HB2' ' A' ' 74' ' ' CYS . 11.9 ptm180 -146.08 125.62 13.26 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.692 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.648 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 10.6 t -88.95 118.16 28.47 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.539 -179.631 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.608 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 40.6 m -109.76 148.1 32.04 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -178.304 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.783 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -99.91 149.21 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 115.041 -0.982 . . . . 0.0 111.061 -179.556 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.422 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.1 mt -49.37 136.84 16.42 Favored Pre-proline 0 CA--C 1.531 0.228 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.422 -179.622 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 27.2 Cg_exo -63.18 133.36 40.42 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.562 2.175 . . . . 0.0 112.642 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.3 mm -129.38 106.8 14.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.664 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.748 HD22 ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -50.86 110.83 0.46 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 121.563 0.696 . . . . 0.0 111.529 -179.763 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.27 -15.58 5.79 Favored Glycine 0 C--N 1.335 0.51 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.548 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -132.37 168.3 18.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.441 0.639 . . . . 0.0 111.176 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -84.27 167.1 16.93 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.258 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.413 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.0 tt -83.14 125.03 40.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.001 0.429 . . . . 0.0 110.919 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.575 ' HB2' HG11 ' A' ' 64' ' ' VAL . 3.9 mm? -96.28 110.73 22.99 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.164 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.499 ' HB2' HH21 ' A' ' 61' ' ' ARG . 57.4 m -145.93 135.98 23.65 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.226 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -159.83 166.67 29.85 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.699 0.285 . . . . 0.0 110.851 179.252 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.2 m -91.89 135.99 26.75 Favored Pre-proline 0 CA--C 1.531 0.246 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.986 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -88.12 143.47 5.75 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.795 2.33 . . . . 0.0 112.817 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 64.94 4.05 2.32 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.853 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.35 33.69 68.51 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.351 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 47.4 mt . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.183 -0.913 . . . . 0.0 111.078 179.981 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 78.3 p . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.599 0.238 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -57.41 102.19 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.581 2.187 . . . . 0.0 112.199 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -80.37 91.87 5.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.192 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.05 -52.67 4.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.02 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.9 ttt -112.9 -7.7 13.73 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 122.031 0.919 . . . . 0.0 108.815 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.611 ' N ' ' CD ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -66.33 -164.6 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.256 -1.338 . . . . 0.0 110.904 -178.825 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.607 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -52.13 118.88 3.8 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.056 0.455 . . . . 0.0 110.946 -179.921 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -54.38 133.38 45.37 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.78 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.612 HG13 ' HD2' ' A' ' 10' ' ' PRO . 3.6 t -93.82 141.01 23.19 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.925 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.612 ' HD2' HG13 ' A' ' 9' ' ' VAL . 79.8 Cg_exo -32.55 121.42 0.1 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.856 3.037 . . . . 0.0 113.209 -179.173 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -82.55 140.44 33.28 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.324 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 54.6 m -139.44 99.91 7.76 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.232 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.67 ' HB2' ' H ' ' A' ' 21' ' ' ALA . 37.3 Cg_exo -56.13 171.24 0.87 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.071 1.847 . . . . 0.0 111.649 179.26 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.449 ' SG ' ' N ' ' A' ' 15' ' ' SER . 3.4 p 44.98 -154.5 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.2 0.524 . . . . 0.0 111.101 -179.762 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.583 ' O ' ' O ' ' A' ' 16' ' ' GLY . 4.2 m -113.3 -157.85 0.63 Allowed 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -178.505 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.583 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -19.49 -149.69 0.0 OUTLIER Glycine 0 CA--C 1.531 1.079 0 N-CA-C 119.086 2.394 . . . . 0.0 119.086 -179.283 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.507 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -22.79 -41.09 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 115.757 1.762 . . . . 0.0 115.757 -177.252 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.705 ' HB2' ' SG ' ' A' ' 62' ' ' CYS . 2.8 m-85 -68.59 -36.67 79.03 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 118.679 0.672 . . . . 0.0 111.485 -177.451 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.3 -20.33 0.01 OUTLIER Glycine 0 CA--C 1.533 1.204 0 N-CA-C 117.981 1.952 . . . . 0.0 117.981 175.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.481 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 76.9 m -130.04 120.58 24.93 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 120.064 1.932 . . . . 0.0 113.539 -177.791 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.67 ' H ' ' HB2' ' A' ' 13' ' ' PRO . . . -69.13 120.58 15.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.291 -179.506 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.44 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 20.4 mm-40 -138.46 -175.39 4.11 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.89 0.376 . . . . 0.0 110.781 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.8 t -145.91 134.04 21.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.608 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.7 m -148.38 162.26 39.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.015 0.436 . . . . 0.0 111.392 -179.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -96.32 170.35 9.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.297 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.1 t -130.59 157.94 41.34 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.709 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -82.09 -169.96 2.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.212 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.549 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.6 m -63.02 -43.5 99.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.623 -179.472 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.549 ' HG ' HG23 ' A' ' 28' ' ' VAL . 29.4 mt -78.37 -19.92 52.37 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.77 -14.54 31.99 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.395 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.405 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 51.6 t -101.71 107.94 22.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 117.239 0.52 . . . . 0.0 111.127 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 176.4 145.38 0.09 Allowed 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.283 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -116.62 60.96 0.73 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.758 179.449 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.8 mt -84.91 153.23 22.99 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.577 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.1 t70 41.37 79.74 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.785 178.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 54.4 m -109.31 131.45 55.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.71 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -162.45 -174.8 4.18 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.931 0.395 . . . . 0.0 111.369 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.8 p-10 -78.99 133.05 62.0 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.883 -179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 22' ' ' GLN . 92.5 Cg_endo -85.27 117.88 1.89 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.665 2.244 . . . . 0.0 111.78 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -91.1 114.34 0.41 Allowed 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 122.229 1.953 . . . . 0.0 113.036 -179.128 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.447 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.62 178.02 1.65 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.915 178.71 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 31.7 m -106.86 88.42 2.74 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mt -63.95 124.3 21.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.59 -178.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.1 -40.52 2.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.855 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -151.91 -167.34 2.75 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.997 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.16 -45.29 77.46 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.364 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 42.4 m -67.83 -40.98 83.69 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.497 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -61.15 -32.7 72.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.549 179.115 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -68.82 -37.32 79.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.167 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -67.1 -27.45 67.36 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.526 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.6 t -82.37 -13.85 56.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.936 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.447 HG23 ' CB ' ' A' ' 41' ' ' ALA . 42.8 m -69.91 -40.07 75.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.91 0.386 . . . . 0.0 111.176 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 12.2 m -88.58 -29.31 20.11 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.293 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.31 -19.95 62.26 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.706 0.765 . . . . 0.0 109.579 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.12 -38.02 89.34 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.884 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.7 pt -103.13 -1.35 9.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -179.254 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.4 44.1 3.3 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 120.331 -0.938 . . . . 0.0 113.519 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -146.03 -172.98 4.04 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 117.227 0.514 . . . . 0.0 111.089 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 19.3 ptt180 -119.37 141.89 48.65 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 -178.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -72.05 123.24 22.4 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.213 -179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.484 HH21 ' HB2' ' A' ' 74' ' ' CYS . 14.2 ptm180 -158.55 126.15 5.06 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.337 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.705 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 18.7 t -85.43 145.36 27.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.404 -179.268 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 21.6 m -125.5 147.38 49.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.327 0.584 . . . . 0.0 111.723 -179.326 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.638 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -101.52 147.4 8.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.251 179.79 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.46 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 7.9 mt -49.32 133.12 17.41 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.29 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 23.9 Cg_exo -63.65 139.05 67.56 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.622 2.214 . . . . 0.0 112.521 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.429 HD13 ' O ' ' A' ' 66' ' ' PRO . 46.0 mm -131.6 110.42 17.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.394 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.81 109.49 0.29 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.878 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.84 -13.74 5.8 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.588 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -133.39 167.65 20.03 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.473 0.654 . . . . 0.0 111.31 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -83.53 168.56 16.32 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.77 -1.104 . . . . 0.0 110.181 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.439 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.8 tt -83.32 125.56 40.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.867 0.365 . . . . 0.0 110.615 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.524 ' HB2' HG11 ' A' ' 64' ' ' VAL . 3.9 mm? -98.28 105.85 18.05 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.83 0.348 . . . . 0.0 111.328 -179.344 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.484 ' HB2' HH21 ' A' ' 61' ' ' ARG . 48.5 m -146.89 133.63 20.0 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.099 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -161.03 166.76 27.66 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-O 120.823 0.344 . . . . 0.0 110.825 179.408 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.2 m -80.34 137.38 52.33 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.803 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -89.86 142.69 4.03 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.797 2.331 . . . . 0.0 112.757 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.23 4.47 1.64 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.613 179.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.46 36.7 58.99 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.537 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.6 mt . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.875 179.94 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.564 0.221 . . . . 0.0 110.976 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -58.76 119.58 6.92 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.566 2.178 . . . . 0.0 112.384 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -113.54 87.95 2.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.961 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -107.28 -48.11 3.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.333 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 86.9 mmm -112.15 4.22 17.76 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 121.849 0.833 . . . . 0.0 109.301 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.585 ' N ' ' CD ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -75.8 -34.83 60.18 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.219 -1.355 . . . . 0.0 111.15 -178.586 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.64 62.19 1.22 Allowed 'General case' 0 CA--C 1.508 -0.638 0 CA-C-O 122.225 1.012 . . . . 0.0 109.987 178.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.42 ' CG ' ' N ' ' A' ' 9' ' ' VAL . 9.0 pt20 -45.44 -50.4 12.59 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 113.245 -1.798 . . . . 0.0 111.497 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.592 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.7 OUTLIER -74.39 154.95 87.95 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.882 179.823 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.592 ' HD2' HG22 ' A' ' 9' ' ' VAL . 84.5 Cg_exo -45.18 123.96 5.73 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.725 2.283 . . . . 0.0 112.586 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -63.67 156.21 27.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.99 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 59.8 m -137.17 91.3 14.78 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.088 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.422 ' O ' ' O ' ' A' ' 14' ' ' CYS . 69.0 Cg_endo -75.1 170.13 21.07 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.898 2.399 . . . . 0.0 112.781 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 21' ' ' ALA . 51.3 t 31.16 104.97 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.1 p -96.22 115.81 28.01 Favored 'General case' 0 C--O 1.232 0.147 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 170.94 -166.56 39.74 Favored Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 120.582 -0.818 . . . . 0.0 113.26 -177.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.518 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.8 tm? -60.06 -37.51 80.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.823 -0.688 . . . . 0.0 110.27 177.554 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.77 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -79.43 -36.07 39.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.565 -178.653 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 59.02 -11.7 0.02 OUTLIER Glycine 0 CA--C 1.525 0.698 0 N-CA-C 115.507 0.963 . . . . 0.0 115.507 177.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.545 HG22 ' HG2' ' A' ' 22' ' ' GLN . 28.0 m -119.15 120.59 37.56 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 118.602 1.201 . . . . 0.0 112.38 -178.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.512 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . . . -86.77 107.2 18.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.313 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.545 ' HG2' HG22 ' A' ' 20' ' ' THR . 29.7 mm-40 -126.14 -169.45 2.02 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.092 0.472 . . . . 0.0 111.724 -178.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 4.4 t -143.67 138.04 28.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.747 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.8 t -157.15 173.47 16.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.932 0.396 . . . . 0.0 111.215 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.98 166.23 11.54 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.691 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.6 t -125.67 156.99 38.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.681 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -84.76 -169.81 2.82 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.194 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.548 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.6 m -61.42 -44.81 99.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.557 -179.545 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.548 ' HG ' HG23 ' A' ' 28' ' ' VAL . 27.0 mt -79.74 -20.27 46.77 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.037 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.35 -15.42 32.72 Favored Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.596 -0.812 . . . . 0.0 113.485 179.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 31.0 t -101.77 108.1 22.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 117.241 0.52 . . . . 0.0 111.124 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 179.52 168.0 1.11 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.044 0.45 . . . . 0.0 111.451 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -132.84 64.21 1.62 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.609 179.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -91.51 131.33 37.03 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.526 -178.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 52.14 83.23 0.06 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.956 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 56.4 m -108.08 131.9 54.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.338 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -153.65 -178.03 6.76 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.879 0.371 . . . . 0.0 111.29 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -77.96 140.51 62.38 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.633 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -90.72 111.17 0.38 Allowed 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.953 2.436 . . . . 0.0 111.909 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -90.71 113.78 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 121.903 1.736 . . . . 0.0 112.866 -179.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.439 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.99 -178.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.651 178.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.8 m -107.01 88.28 2.7 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.427 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.4 mt -62.51 122.85 16.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.482 -178.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.486 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.77 -33.62 3.75 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.764 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 0.465 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 6.9 p30 -163.48 -179.16 6.3 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.134 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.08 -60.03 3.33 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.289 -0.414 . . . . 0.0 112.025 -179.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 23.2 m -60.11 -37.78 81.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.756 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' HIS . . . . . 0.486 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.6 t60 -61.27 -33.11 73.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.904 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.411 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 18.3 t80 -68.78 -33.6 74.14 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.042 179.137 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -69.29 -41.58 76.6 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.025 178.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.1 m -64.36 -17.47 63.75 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.237 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.439 HG23 ' CB ' ' A' ' 41' ' ' ALA . 50.8 m -71.37 -42.1 68.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.443 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 23.0 m -84.59 -30.43 25.01 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.657 -179.394 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.83 -19.71 63.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.635 0.731 . . . . 0.0 109.631 -179.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -68.56 -39.72 80.92 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.286 -179.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 23.4 pt -100.57 1.41 10.51 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.24 39.56 5.67 Favored Glycine 0 CA--C 1.522 0.516 0 C-N-CA 120.294 -0.955 . . . . 0.0 113.443 179.078 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -145.96 -174.13 4.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.814 0.307 . . . . 0.0 110.807 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 23.9 mtm180 -119.73 156.45 30.53 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.89 0.376 . . . . 0.0 111.184 -179.416 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.411 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -85.49 122.87 30.25 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.645 -179.064 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -144.14 129.67 19.04 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.947 0.404 . . . . 0.0 110.546 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.689 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.9 t -98.5 109.67 22.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.732 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.539 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 91.9 m -101.07 145.75 28.34 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.308 0.575 . . . . 0.0 112.493 -178.419 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.77 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -95.25 148.42 5.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.495 179.704 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.431 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.5 mt -49.24 140.64 12.38 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.398 -179.361 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.501 ' O ' HD13 ' A' ' 67' ' ' ILE . 34.1 Cg_exo -59.79 139.65 89.47 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.734 2.289 . . . . 0.0 112.327 -179.873 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.501 HD13 ' O ' ' A' ' 66' ' ' PRO . 30.2 mm -131.95 110.12 16.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.476 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.48 111.89 0.8 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.092 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 122.65 -2.96 10.17 Favored Glycine 0 C--N 1.335 0.485 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.089 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -149.7 165.42 32.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.269 0.557 . . . . 0.0 111.163 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -78.87 169.85 17.59 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.577 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.406 HG23 ' O ' ' A' ' 72' ' ' ILE . 17.2 tt -82.85 121.69 36.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.152 0.501 . . . . 0.0 110.613 179.732 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.537 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.7 mm? -90.49 124.64 35.16 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.466 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -160.27 135.84 8.22 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.217 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -159.51 162.37 35.48 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.741 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 53.1 m -82.82 136.31 44.74 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.862 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -85.74 140.88 7.26 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.577 2.184 . . . . 0.0 112.653 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.12 3.69 1.36 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.664 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.94 38.04 60.31 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.485 179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 35.6 mt . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.232 -0.889 . . . . 0.0 111.049 179.992 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.496 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 57.8 m . . . . . 0 N--CA 1.486 1.361 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 1' ' ' SER . 17.8 Cg_endo -59.35 112.46 1.24 Allowed 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 122.059 1.839 . . . . 0.0 112.369 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.58 98.92 3.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.163 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -106.15 -30.36 9.28 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.979 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 24.3 mmt -108.74 -4.09 17.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.778 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -98.39 -164.02 1.1 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.67 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.691 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -50.47 119.86 4.12 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.03 0.443 . . . . 0.0 111.329 -179.835 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -52.17 145.28 10.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.085 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.593 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -90.88 154.34 45.38 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.921 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.593 ' HD2' HG22 ' A' ' 9' ' ' VAL . 86.3 Cg_exo -44.68 126.35 7.1 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.92 2.414 . . . . 0.0 112.687 179.774 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -55.25 157.12 3.74 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.974 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 40.5 m -130.57 91.81 36.73 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.138 -179.673 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.493 ' HB2' ' HB2' ' A' ' 21' ' ' ALA . 89.7 Cg_endo -72.9 177.24 7.94 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.916 2.411 . . . . 0.0 112.521 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.488 ' C ' ' O ' ' A' ' 13' ' ' PRO . 23.1 p -15.98 115.17 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 O-C-N 123.969 0.793 . . . . 0.0 112.241 -179.605 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.0 p -95.32 117.96 31.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.27 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.25 -166.79 39.65 Favored Glycine 0 N--CA 1.441 -1.031 0 C-N-CA 120.551 -0.833 . . . . 0.0 113.161 -177.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.523 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.7 tm? -56.86 -37.21 70.99 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.764 -0.718 . . . . 0.0 110.591 177.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.746 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -80.91 -38.9 27.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.404 0.621 . . . . 0.0 111.375 -178.551 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.72 -8.18 0.01 OUTLIER Glycine 0 CA--C 1.527 0.805 0 CA-C-N 114.671 -1.149 . . . . 0.0 115.739 176.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.541 HG22 ' HG2' ' A' ' 22' ' ' GLN . 18.1 m -115.69 126.12 53.7 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 118.658 1.229 . . . . 0.0 112.996 -178.024 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.493 ' HB2' ' HB2' ' A' ' 13' ' ' PRO . . . -87.43 104.89 16.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.087 179.051 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.541 ' HG2' HG22 ' A' ' 20' ' ' THR . 29.4 mm-40 -128.25 -169.41 2.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.126 0.488 . . . . 0.0 111.69 -178.524 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.9 t -139.68 140.73 36.94 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.974 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -161.86 155.86 21.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.085 0.469 . . . . 0.0 111.285 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.521 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -79.5 166.46 21.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.594 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.0 t -134.74 158.21 44.72 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.426 ' HB3' ' HB2' ' A' ' 32' ' ' ALA . 1.6 p-10 -77.33 -168.89 1.23 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.007 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.588 HG23 ' HG ' ' A' ' 29' ' ' LEU . 11.0 m -65.24 -44.67 95.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.632 -179.627 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.588 ' HG ' HG23 ' A' ' 28' ' ' VAL . 29.1 mt -78.16 -19.29 54.28 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -178.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.77 -15.44 31.62 Favored Glycine 0 CA--C 1.521 0.416 0 C-N-CA 120.541 -0.838 . . . . 0.0 113.697 179.335 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.5 t -101.68 108.14 23.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 117.302 0.551 . . . . 0.0 111.181 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.426 ' HB2' ' HB3' ' A' ' 27' ' ' ASP . . . 179.51 171.33 1.0 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.124 0.488 . . . . 0.0 111.322 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -139.41 93.45 2.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.769 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.521 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 1.7 mt -125.08 134.67 52.41 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.548 -178.623 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.3 t70 52.94 86.24 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.198 179.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 m -108.46 133.93 51.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.964 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -156.32 -178.09 7.07 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.937 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -83.31 138.21 42.06 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.541 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -90.1 114.56 0.54 Allowed 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.814 2.343 . . . . 0.0 111.928 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -90.44 114.0 0.48 Allowed 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 121.982 1.788 . . . . 0.0 112.783 -179.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.42 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.48 -179.28 1.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.532 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.6 m -108.2 88.12 2.66 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 177.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -61.41 123.18 17.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.284 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.64 -40.61 2.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.906 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -152.92 -168.36 3.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.045 179.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.501 ' HB1' ' HG ' ' A' ' 80' ' ' LEU . . . -64.94 -44.05 90.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.257 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 41.3 m -70.4 -41.94 72.31 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.798 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -60.49 -33.85 73.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.118 0.485 . . . . 0.0 109.856 179.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -69.27 -35.76 76.41 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.975 179.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -67.02 -32.12 73.13 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.216 179.064 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.5 t -76.2 -12.89 60.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.776 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.42 HG23 ' CB ' ' A' ' 41' ' ' ALA . 52.4 m -73.81 -40.93 63.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.075 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 7.4 m -86.16 -31.95 21.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.51 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.8 -19.93 63.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.659 0.742 . . . . 0.0 109.825 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.03 -39.22 93.04 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.925 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.4 pt -103.34 0.79 10.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -179.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.18 43.13 3.09 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.318 -0.944 . . . . 0.0 113.58 178.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -150.63 -175.03 4.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 117.097 0.448 . . . . 0.0 110.995 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -120.66 153.99 36.12 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.976 0.417 . . . . 0.0 111.122 -179.51 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.59 126.2 30.56 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.241 -179.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -149.64 155.41 40.2 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.044 0.45 . . . . 0.0 110.925 179.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.626 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 33.6 t -121.44 104.76 9.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.18 -179.575 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' CYS . . . . . 0.543 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 5.0 m -109.95 145.0 37.65 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.197 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.746 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.3 OUTLIER -90.81 146.02 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.742 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.463 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.5 mt -49.95 138.65 18.38 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.451 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 27.3 Cg_exo -62.65 138.53 70.29 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.589 2.193 . . . . 0.0 112.556 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.41 HD13 ' O ' ' A' ' 66' ' ' PRO . 50.3 mm -130.82 108.4 15.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.658 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.65 109.98 0.33 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.266 -179.718 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.14 -12.46 6.42 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.643 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -136.95 168.9 18.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.416 0.627 . . . . 0.0 111.25 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -82.22 166.82 19.26 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.113 179.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.6 tt -83.44 124.49 39.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 121.065 0.459 . . . . 0.0 110.995 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.619 ' O ' HG12 ' A' ' 64' ' ' VAL . 4.0 mm? -98.94 113.7 25.98 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.705 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 43.6 t -161.55 138.67 8.65 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.623 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLN . . . . . 0.434 HE21 ' HE2' ' A' ' 18' ' ' TYR . 4.7 pp0? -159.93 163.3 34.34 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.95 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.3 m -90.2 126.62 56.29 Favored Pre-proline 0 CA--C 1.531 0.218 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.182 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -53.57 108.89 0.3 Allowed 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.679 2.252 . . . . 0.0 113.178 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.82 34.06 18.39 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.55 179.234 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 62.49 20.95 61.92 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.924 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.685 HD13 ' O ' ' A' ' 80' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.775 -0.631 . . . . 0.0 111.063 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 54.0 m . . . . . 0 N--CA 1.485 1.296 0 CA-C-O 120.615 0.245 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -57.4 110.52 0.62 Allowed 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.689 2.26 . . . . 0.0 112.229 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.552 ' HB1' ' HB2' ' A' ' 6' ' ' GLU . . . -102.06 99.35 9.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.308 -179.73 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -96.26 -22.35 17.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.828 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 15.0 ptm -110.61 -38.84 5.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.622 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.552 ' HB2' ' HB1' ' A' ' 3' ' ' ALA . 19.1 mt-10 -63.16 -43.16 99.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.277 -179.723 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.2 ptm180 -166.71 86.67 0.3 Allowed 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.775 0.798 . . . . 0.0 110.731 -179.833 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -51.11 144.56 8.92 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.86 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.609 HG13 ' HD2' ' A' ' 10' ' ' PRO . 4.0 t -86.29 141.31 34.72 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.004 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.609 ' HD2' HG13 ' A' ' 9' ' ' VAL . 68.4 Cg_exo -31.3 121.45 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 124.006 3.137 . . . . 0.0 113.366 -179.176 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -47.95 144.55 3.5 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.028 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 97.6 m -156.74 97.38 2.13 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.359 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -78.47 166.14 24.43 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.673 2.249 . . . . 0.0 112.387 179.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 48.15 -163.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.318 0.58 . . . . 0.0 111.946 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.585 ' O ' ' O ' ' A' ' 16' ' ' GLY . 14.0 m -133.36 -157.57 0.82 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.711 -179.014 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . 0.585 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -19.42 -149.78 0.0 OUTLIER Glycine 0 CA--C 1.532 1.096 0 N-CA-C 119.084 2.394 . . . . 0.0 119.084 -179.368 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.2 tm? -23.21 -43.13 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -177.395 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.726 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 3.7 m-85 -68.55 -35.92 78.08 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.207 -0.597 . . . . 0.0 112.208 -176.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.31 -10.98 0.01 OUTLIER Glycine 0 CA--C 1.527 0.816 0 N-CA-C 115.554 0.982 . . . . 0.0 115.554 176.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.425 ' H ' ' C ' ' A' ' 18' ' ' TYR . 32.5 m -125.13 145.9 49.73 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 118.591 1.196 . . . . 0.0 112.162 -178.163 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -111.73 109.15 18.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.794 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -129.07 -172.03 2.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.153 0.501 . . . . 0.0 111.673 -178.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 36' ' ' CYS . 2.1 t -135.93 105.59 6.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.79 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.458 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 2.3 m -126.76 151.8 47.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.964 0.411 . . . . 0.0 111.712 -178.468 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -89.32 166.37 13.8 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.046 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.9 t -121.76 157.21 31.51 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -179.263 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -86.18 -170.26 3.01 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.418 -179.185 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.553 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.4 m -61.1 -45.12 99.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.407 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.553 ' HG ' HG23 ' A' ' 28' ' ' VAL . 24.0 mt -79.9 -20.72 45.14 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.606 0.241 . . . . 0.0 111.446 -179.094 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.63 -18.07 32.65 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 120.674 -0.774 . . . . 0.0 113.7 179.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.427 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 39.5 t -101.96 107.72 22.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 117.497 0.649 . . . . 0.0 111.058 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.427 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 174.81 171.16 0.25 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.029 0.442 . . . . 0.0 111.401 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -133.15 85.71 2.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.585 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 mt -109.03 137.01 47.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.043 -178.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.6 t70 41.63 81.23 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.075 178.607 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.458 ' HB2' ' HB3' ' A' ' 24' ' ' CYS . 49.1 t -128.03 139.76 52.36 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.342 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -155.71 -173.19 4.43 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.243 -179.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -64.93 133.1 95.66 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.85 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -90.46 110.04 0.38 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.89 2.393 . . . . 0.0 111.922 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -90.75 115.13 0.47 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.24 1.96 . . . . 0.0 112.887 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.414 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.05 -179.14 1.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.784 178.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 34.9 m -105.87 88.52 2.83 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 177.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.15 123.18 19.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.449 -178.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.9 -40.64 2.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.826 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -151.49 -168.23 3.03 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.037 179.67 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.64 -49.8 71.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.415 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.8 m -65.17 -40.81 94.8 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.806 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -60.65 -32.34 71.51 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.814 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.49 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 18.5 t80 -69.37 -37.95 77.83 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.938 178.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.0 -41.19 97.57 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.954 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.4 m -64.44 -20.06 65.93 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.416 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.414 HG23 ' CB ' ' A' ' 41' ' ' ALA . 51.8 m -69.52 -39.18 77.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.534 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.401 ' HB3' ' C ' ' A' ' 58' ' ' GLN . 2.5 m -87.72 -32.6 19.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.816 -179.305 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.21 -19.37 63.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.674 0.749 . . . . 0.0 109.686 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.5 -39.11 88.51 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.399 -1.273 . . . . 0.0 112.446 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.9 pt -105.85 3.03 10.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.71 42.7 3.06 Favored Glycine 0 CA--C 1.523 0.563 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.784 178.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.401 ' C ' ' HB3' ' A' ' 53' ' ' CYS . 36.8 mt-30 -151.32 -174.56 4.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 117.041 0.421 . . . . 0.0 110.717 179.411 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.2 mtp180 -125.47 153.79 43.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.798 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.49 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -67.66 118.83 11.46 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.005 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -130.48 123.79 30.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.855 0.359 . . . . 0.0 110.52 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.678 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 3.4 t -96.31 107.68 20.07 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 57.8 m -105.78 151.03 24.98 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.538 0.685 . . . . 0.0 112.635 -178.36 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.726 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -105.3 150.33 8.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.483 179.569 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.484 HD12 ' HD2' ' A' ' 66' ' ' PRO . 1.2 tp -50.35 122.76 15.83 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.137 -179.324 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.484 ' HD2' HD12 ' A' ' 65' ' ' LEU . 24.3 Cg_exo -65.31 139.53 60.28 Favored 'Trans proline' 0 C--N 1.355 0.921 0 C-N-CA 122.481 2.121 . . . . 0.0 112.516 -179.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.438 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 48.2 mm -131.38 112.63 21.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.486 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -46.93 108.91 0.16 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.792 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.94 -14.56 5.71 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.525 -179.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 12.8 pt20 -129.07 166.55 19.03 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.534 0.683 . . . . 0.0 111.265 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -82.49 162.21 22.13 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.225 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.408 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.0 tt -83.35 121.02 35.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.138 0.494 . . . . 0.0 111.004 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.52 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.9 mm? -95.13 107.92 20.01 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.959 -179.581 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.408 ' SG ' HG12 ' A' ' 72' ' ' ILE . 69.7 m -144.79 130.35 18.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.11 -179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -160.37 161.91 33.24 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.879 0.371 . . . . 0.0 110.86 179.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.5 m -85.97 135.24 37.72 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.163 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -86.04 142.42 7.59 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.736 2.29 . . . . 0.0 112.644 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 65.17 1.54 1.58 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.842 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.14 36.57 64.0 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.405 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.7 mt . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.253 -0.879 . . . . 0.0 111.012 179.801 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.463 0.18 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 80.0 p -95.08 115.83 27.93 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.07 -154.63 22.02 Favored Glycine 0 N--CA 1.436 -1.314 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.733 -177.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.478 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.5 tm? -65.58 -40.49 92.78 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.327 -0.436 . . . . 0.0 110.783 177.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.764 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -76.54 -36.96 57.38 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.442 0.639 . . . . 0.0 111.595 -178.804 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.64 -8.92 0.02 OUTLIER Glycine 0 CA--C 1.525 0.671 0 CA-C-N 114.763 -1.108 . . . . 0.0 114.794 177.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.423 ' H ' ' C ' ' A' ' 18' ' ' TYR . 7.6 m -112.61 154.59 25.79 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 118.174 0.987 . . . . 0.0 111.929 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.88 107.57 12.86 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.256 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.507 ' HA ' ' HG3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -137.71 -169.86 2.63 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -179.195 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.516 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 60.1 m -134.28 119.84 19.22 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.501 -179.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.495 ' HB3' ' HD3' ' A' ' 61' ' ' ARG . 1.1 t -128.43 -179.8 5.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.958 0.408 . . . . 0.0 110.927 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.508 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -115.2 164.71 13.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.873 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.7 t -130.46 157.68 41.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.512 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.407 ' H ' ' HB3' ' A' ' 32' ' ' ALA . 0.8 OUTLIER -80.56 -170.67 2.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.545 -179.194 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.529 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.7 m -62.63 -47.0 95.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.721 -179.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.529 ' HG ' HG23 ' A' ' 28' ' ' VAL . 32.5 mt -76.2 -19.68 58.18 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.39 -13.39 33.31 Favored Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.702 -0.761 . . . . 0.0 113.451 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.602 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.6 p -100.36 108.18 22.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 117.156 0.478 . . . . 0.0 111.103 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.542 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 172.58 161.27 0.12 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.637 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -131.24 63.07 1.61 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.632 179.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.508 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 3.8 mt -82.59 135.54 35.04 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.83 -178.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.1 t70 50.37 81.62 0.06 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.679 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -109.34 129.56 55.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.461 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -166.25 172.64 10.93 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.102 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -66.52 145.2 98.93 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.444 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.516 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 57.1 Cg_endo -91.19 121.37 0.69 Allowed 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.864 2.376 . . . . 0.0 112.657 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -90.7 112.11 0.4 Allowed 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 121.684 1.589 . . . . 0.0 112.025 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -176.63 -175.83 0.67 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.748 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 36.5 m -109.05 88.27 2.69 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -64.35 123.98 20.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.555 -178.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.474 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.6 -33.35 3.84 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.955 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.465 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 6.9 p30 -163.86 -179.5 6.35 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.099 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.59 -58.46 6.27 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -179.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.4 m -60.3 -35.79 76.39 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.804 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.474 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.9 t60 -62.43 -34.5 76.9 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.981 179.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.409 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 25.7 t80 -70.15 -35.96 74.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.394 179.181 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -67.01 -31.23 71.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.063 0.458 . . . . 0.0 110.138 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.8 t -76.59 -17.74 59.03 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.389 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 60.0 m -73.35 -42.5 62.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.988 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.4 m -80.79 -26.77 36.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.223 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.22 -20.1 55.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.437 0.637 . . . . 0.0 110.302 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.88 -36.08 80.23 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.923 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.4 pt -108.96 11.42 8.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 84.3 41.6 7.87 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.489 -0.862 . . . . 0.0 113.393 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -140.95 177.93 7.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.855 0.327 . . . . 0.0 110.878 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -117.2 162.95 17.04 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.878 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.409 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -85.98 118.42 25.45 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.746 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.593 HH21 ' HB3' ' A' ' 74' ' ' CYS . 12.9 ptm180 -147.55 125.74 12.2 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.164 0.507 . . . . 0.0 110.211 179.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.472 ' HB2' ' CD2' ' A' ' 18' ' ' TYR . 5.5 m -85.88 106.22 16.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.261 -178.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.415 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 65.2 m -98.0 142.61 29.51 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.229 0.538 . . . . 0.0 111.904 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.764 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -93.83 144.3 9.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.444 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.448 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.5 mt -49.43 137.14 16.59 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.535 -178.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 37.9 Cg_exo -61.42 138.13 74.38 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.71 2.273 . . . . 0.0 112.617 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 51.3 mm -130.3 108.17 15.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.375 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.65 109.36 0.31 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.12 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.68 -13.68 5.84 Favored Glycine 0 C--N 1.333 0.38 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.773 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -135.16 168.48 19.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.451 0.643 . . . . 0.0 111.161 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -81.29 169.3 17.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.294 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 20.2 tt -84.09 132.27 31.94 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-O 120.813 0.34 . . . . 0.0 110.876 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.553 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.5 mm? -109.82 132.15 54.41 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.789 0.328 . . . . 0.0 110.622 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.593 ' HB3' HH21 ' A' ' 61' ' ' ARG . 0.5 OUTLIER -160.14 135.39 8.05 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.339 179.406 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -153.11 163.13 40.43 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.63 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.458 HG23 ' HD2' ' A' ' 77' ' ' PRO . 54.4 m -96.38 139.47 21.72 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.654 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . 0.458 ' HD2' HG23 ' A' ' 76' ' ' THR . 64.1 Cg_endo -75.49 125.22 8.86 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.28 1.987 . . . . 0.0 113.144 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 57.19 23.83 9.09 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.801 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 63.62 33.76 88.12 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.559 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.6 tp . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.282 -179.552 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.39 0 CA-C-O 120.987 0.422 . . . . 0.0 110.675 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 75.3 p -98.29 117.13 31.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.532 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 173.77 -155.22 21.56 Favored Glycine 0 N--CA 1.434 -1.47 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.744 -178.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.496 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.4 tm? -66.75 -38.64 87.02 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.216 -0.492 . . . . 0.0 110.966 178.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.749 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -79.07 -39.24 34.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.833 -178.252 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.79 -11.5 0.01 OUTLIER Glycine 0 CA--C 1.528 0.855 0 CA-C-N 114.97 -1.014 . . . . 0.0 115.285 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.517 HG22 ' HG2' ' A' ' 22' ' ' GLN . 6.6 m -105.94 131.14 53.61 Favored 'General case' 0 N--CA 1.46 0.074 0 CA-C-N 118.383 1.091 . . . . 0.0 112.372 -178.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -100.98 99.53 10.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.544 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.517 ' HG2' HG22 ' A' ' 20' ' ' THR . 24.1 mm-40 -126.31 -174.57 3.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.88 0.371 . . . . 0.0 111.003 -179.34 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.585 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 58.3 m -135.51 107.76 7.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.298 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.14 151.56 51.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.886 0.374 . . . . 0.0 111.143 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.41 169.65 16.72 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.593 -178.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.4 t -126.35 158.13 36.67 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.635 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -76.87 -169.86 1.43 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.451 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.543 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.6 m -65.74 -46.04 90.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.699 -179.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.543 ' HG ' HG23 ' A' ' 28' ' ' VAL . 30.6 mt -75.46 -19.8 59.22 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -178.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.82 -18.33 29.29 Favored Glycine 0 CA--C 1.521 0.464 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.765 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.41 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 46.8 t -101.51 107.81 22.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 117.603 0.702 . . . . 0.0 111.033 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 175.94 172.74 0.35 Allowed 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.049 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -141.38 84.23 1.9 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.91 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.7 mt -104.38 134.95 46.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.682 -178.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 51.53 84.14 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.006 178.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.5 t -122.76 137.77 54.82 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.826 0.346 . . . . 0.0 111.005 179.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -159.76 -178.4 7.04 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -65.85 124.62 88.07 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.825 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.585 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 93.7 Cg_endo -85.84 122.17 2.23 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.506 2.137 . . . . 0.0 112.087 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -91.25 113.73 0.39 Allowed 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.113 1.875 . . . . 0.0 112.508 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.53 179.12 1.5 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 179.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 32.1 m -106.89 88.07 2.66 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.5 mt -63.36 121.2 13.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.411 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.483 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.62 -34.46 3.59 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.71 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.47 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.1 p30 -162.77 -179.18 6.64 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.238 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.88 -59.84 3.7 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.937 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.6 m -60.27 -36.33 77.57 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.745 -179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.483 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.7 t60 -62.78 -32.44 73.61 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.947 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.533 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 13.8 t80 -71.34 -38.65 71.64 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.103 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.08 -31.86 73.1 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 121.058 0.456 . . . . 0.0 110.149 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.3 t -75.51 -13.38 60.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.958 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 74.2 m -78.06 -44.04 27.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.077 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.492 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 36.2 m -82.95 -26.94 30.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.986 -179.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.49 -20.18 58.92 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.501 0.667 . . . . 0.0 110.186 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.81 -37.24 86.95 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.744 -1.117 . . . . 0.0 112.077 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.0 pt -106.01 11.29 8.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.42 40.36 6.07 Favored Glycine 0 CA--C 1.522 0.492 0 C-N-CA 120.493 -0.861 . . . . 0.0 114.235 178.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -148.44 -178.1 6.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 117.263 0.531 . . . . 0.0 111.059 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -122.98 154.81 37.93 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.168 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.533 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -69.57 119.91 14.55 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.689 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -139.6 125.3 19.44 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.563 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.602 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 15.4 t -98.72 99.54 10.66 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.503 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 3.8 m -109.1 141.37 41.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.257 0.551 . . . . 0.0 112.33 -177.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.749 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.3 OUTLIER -87.48 144.12 9.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.457 179.873 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.4 mt -49.52 136.43 17.62 Favored Pre-proline 0 N--CA 1.462 0.165 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.359 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 37.5 Cg_exo -61.1 133.92 49.81 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.497 2.132 . . . . 0.0 112.531 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.4 mm -128.17 106.14 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.6 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.18 110.98 0.38 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.18 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.49 -13.97 5.87 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.464 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -138.18 166.86 23.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.41 0.624 . . . . 0.0 111.144 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -80.46 164.63 22.89 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.288 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.5 tt -83.43 125.2 40.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.05 0.452 . . . . 0.0 110.952 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.626 ' O ' HG12 ' A' ' 64' ' ' VAL . 4.0 mm? -100.66 115.73 30.92 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.9 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 42.2 t -161.27 140.45 10.18 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.251 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -160.7 168.24 25.26 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.384 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 72.9 m -100.69 124.65 41.54 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.325 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -69.45 141.2 45.85 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.403 2.069 . . . . 0.0 112.72 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.47 -0.85 0.64 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.246 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.9 36.84 65.39 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.397 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 28.6 mt . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.191 -0.909 . . . . 0.0 111.193 179.849 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.1 t . . . . . 0 C--O 1.232 0.158 0 CA-C-O 121.148 0.499 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.624 ' O ' ' O ' ' A' ' 16' ' ' GLY . 87.6 p -134.18 -156.99 0.77 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.392 -179.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.624 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -18.52 -147.71 0.0 OUTLIER Glycine 0 CA--C 1.532 1.146 0 N-CA-C 118.251 2.06 . . . . 0.0 118.251 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.481 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -22.85 -42.07 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 115.402 1.63 . . . . 0.0 115.402 -177.675 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.577 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 5.7 m-85 -69.37 -36.46 76.84 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.275 -0.57 . . . . 0.0 112.264 -177.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.69 -14.43 0.01 OUTLIER Glycine 0 CA--C 1.531 1.034 0 N-CA-C 115.708 1.043 . . . . 0.0 115.708 177.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.434 ' H ' ' C ' ' A' ' 18' ' ' TYR . 23.3 m -129.54 153.92 47.55 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 118.576 1.188 . . . . 0.0 112.175 -178.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -115.31 114.97 25.88 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.976 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -132.63 -169.88 2.33 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.128 0.489 . . . . 0.0 111.646 -178.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.458 ' HB2' ' HB3' ' A' ' 39' ' ' PRO . 5.6 t -147.27 131.11 17.05 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.115 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.543 ' HB2' ' HD2' ' A' ' 61' ' ' ARG . 36.7 m -147.34 165.83 28.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.967 0.413 . . . . 0.0 111.498 -179.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.35 168.77 10.86 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.385 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.427 ' HB ' HH21 ' A' ' 59' ' ' ARG . 5.7 t -122.98 156.82 33.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.72 -179.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -85.0 -169.61 2.73 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.234 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.584 HG23 ' HG ' ' A' ' 29' ' ' LEU . 8.2 m -60.93 -46.29 96.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.571 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.584 ' HG ' HG23 ' A' ' 28' ' ' VAL . 24.8 mt -80.21 -20.4 44.77 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 111.636 0.235 . . . . 0.0 111.636 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.32 -16.38 32.2 Favored Glycine 0 CA--C 1.522 0.509 0 C-N-CA 120.716 -0.754 . . . . 0.0 113.52 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 61.0 t -101.4 108.38 23.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 117.192 0.496 . . . . 0.0 111.178 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.35 167.41 0.81 Allowed 'General case' 0 N--CA 1.461 0.119 0 CA-C-O 120.967 0.413 . . . . 0.0 111.336 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -130.36 76.29 1.71 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.834 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 mt -102.95 143.21 32.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.976 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 30.3 t70 45.52 83.48 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.946 178.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 52.0 m -109.66 130.28 55.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.211 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -156.99 -176.18 5.84 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.053 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -79.33 133.32 60.46 Favored Pre-proline 0 CA--C 1.533 0.304 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.685 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.458 ' HB3' ' HB2' ' A' ' 23' ' ' CYS . 93.5 Cg_endo -89.07 119.97 1.03 Allowed 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.72 2.28 . . . . 0.0 111.931 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -91.27 114.34 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.32 2.013 . . . . 0.0 113.105 -179.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.455 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.58 179.98 1.34 Allowed 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.939 178.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.6 m -106.72 88.47 2.76 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.2 mt -62.47 121.56 13.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.277 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.506 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.55 -34.44 3.61 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.553 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.454 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.0 p30 -162.89 -177.91 5.79 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.103 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.88 -61.25 2.33 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.245 -0.434 . . . . 0.0 112.011 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.7 m -59.55 -36.42 76.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.846 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.506 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.2 t60 -63.03 -33.33 75.19 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -67.73 -34.85 77.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.741 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -67.78 -42.3 81.87 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.055 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 57.0 m -63.26 -18.07 63.18 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.297 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.455 HG23 ' CB ' ' A' ' 41' ' ' ALA . 48.5 m -70.85 -40.68 72.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.486 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 32.6 m -86.66 -31.47 21.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.791 -179.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.53 -19.71 63.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.657 0.741 . . . . 0.0 109.542 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.49 -39.86 88.97 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.417 -1.265 . . . . 0.0 112.117 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 16.1 pt -101.41 1.25 10.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.43 40.66 5.34 Favored Glycine 0 CA--C 1.522 0.511 0 C-N-CA 120.282 -0.961 . . . . 0.0 113.289 179.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -143.41 -172.12 3.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.782 0.291 . . . . 0.0 110.826 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.427 HH21 ' HB ' ' A' ' 26' ' ' THR . 50.6 mtm180 -119.96 152.15 37.87 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.743 0.306 . . . . 0.0 111.119 -179.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -82.72 122.76 28.58 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.763 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.543 ' HD2' ' HB2' ' A' ' 24' ' ' CYS . 4.2 ptm180 -140.19 140.26 35.86 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-O 120.627 0.251 . . . . 0.0 110.564 -179.538 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -106.39 119.57 39.6 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 55.5 m -110.21 149.21 30.45 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 121.424 0.63 . . . . 0.0 112.254 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.577 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -101.39 149.3 6.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.543 179.725 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.2 mt -49.6 137.46 17.41 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.364 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 33.1 Cg_exo -60.63 134.97 57.51 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.604 2.203 . . . . 0.0 112.801 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.457 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.8 mm -130.57 106.19 12.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.51 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.2 119.79 4.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.982 0.42 . . . . 0.0 111.278 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 118.94 -8.13 12.76 Favored Glycine 0 CA--C 1.518 0.229 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.826 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.457 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.9 pt20 -139.24 168.5 19.69 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.477 0.656 . . . . 0.0 111.218 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -82.99 168.9 16.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.311 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.417 HG12 ' SG ' ' A' ' 74' ' ' CYS . 16.3 tt -83.4 124.81 39.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-O 120.922 0.391 . . . . 0.0 110.932 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.508 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.1 mm? -96.61 109.01 21.7 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.031 -179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.417 ' SG ' HG12 ' A' ' 72' ' ' ILE . 64.2 m -144.76 131.96 20.57 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.122 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -160.27 167.51 27.38 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.766 0.317 . . . . 0.0 110.941 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 49.4 m -82.86 137.47 43.73 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.87 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -83.67 136.22 7.23 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.378 2.052 . . . . 0.0 112.684 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 64.34 3.48 1.85 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.811 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.63 40.02 54.56 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.436 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.2 mt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.285 -0.864 . . . . 0.0 111.061 179.971 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.1 t . . . . . 0 CA--C 1.52 -0.187 0 CA-C-O 121.408 0.623 . . . . 0.0 111.664 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.596 ' O ' ' O ' ' A' ' 16' ' ' GLY . 10.6 m -129.11 -156.08 0.74 Allowed 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.136 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.596 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -17.2 -147.7 0.0 OUTLIER Glycine 0 CA--C 1.533 1.182 0 N-CA-C 118.655 2.222 . . . . 0.0 118.655 -179.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.451 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.7 OUTLIER -22.15 -45.96 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -176.846 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.636 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 6.4 m-85 -69.26 -37.23 77.81 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.927 -0.709 . . . . 0.0 112.031 -177.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.92 -12.26 0.01 OUTLIER Glycine 0 CA--C 1.529 0.952 0 N-CA-C 116.545 1.378 . . . . 0.0 116.545 176.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.473 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 52.6 m -138.16 138.11 38.29 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.139 1.469 . . . . 0.0 112.839 -177.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -106.18 125.87 51.52 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.407 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.537 ' HA ' ' HG3' ' A' ' 39' ' ' PRO . 67.1 mm-40 -147.56 176.31 10.16 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.78 0.324 . . . . 0.0 111.525 -178.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.442 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 75.7 m -122.82 116.41 23.64 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.999 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.652 ' HB2' ' HD2' ' A' ' 61' ' ' ARG . 60.2 m -132.44 159.95 37.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.016 0.436 . . . . 0.0 111.431 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.431 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -83.47 167.57 17.32 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.893 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.4 t -123.78 156.67 35.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.597 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -87.73 -170.59 3.07 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.339 -179.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.562 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.5 m -60.61 -44.88 97.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.428 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.562 ' HG ' HG23 ' A' ' 28' ' ' VAL . 24.0 mt -80.55 -20.47 43.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.701 0.286 . . . . 0.0 111.279 -179.278 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.69 -18.97 31.54 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 120.827 -0.701 . . . . 0.0 113.792 178.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.4 t -101.81 108.49 23.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 117.286 0.543 . . . . 0.0 111.255 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -179.68 168.34 1.37 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.048 0.451 . . . . 0.0 111.377 179.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -128.97 82.79 2.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.756 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.431 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.0 mt -110.48 137.35 48.3 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.017 -178.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 48.02 84.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.874 178.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 51.4 m -109.6 129.94 55.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.631 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -151.55 163.86 38.1 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.413 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.402 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 7.2 p30 -57.92 133.12 83.42 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.473 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.537 ' HG3' ' HA ' ' A' ' 22' ' ' GLN . 97.5 Cg_endo -90.67 113.45 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.87 2.38 . . . . 0.0 112.302 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -90.5 113.3 0.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 121.919 1.746 . . . . 0.0 112.495 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.79 -178.42 1.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.632 178.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.6 m -110.17 88.37 2.74 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 177.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.8 mt -64.79 119.77 11.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.432 -178.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.41 ' H ' ' HB3' ' A' ' 48' ' ' HIS . . . -116.55 -40.69 3.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.761 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -152.82 -168.69 3.11 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.723 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.78 -39.37 94.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.993 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 46.6 m -71.04 -47.98 55.47 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.863 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.41 ' HB3' ' H ' ' A' ' 44' ' ' ALA . 2.1 t-160 -57.22 -31.22 65.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.081 0.467 . . . . 0.0 109.753 179.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -70.48 -39.56 74.15 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.077 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -62.99 -38.58 91.72 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 121.244 0.545 . . . . 0.0 109.912 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 56.9 m -68.29 -16.06 63.81 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.291 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 94.2 m -75.74 -43.31 47.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.549 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.436 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 68.5 m -85.88 -23.46 27.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.346 -179.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.83 -20.0 43.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.259 0.552 . . . . 0.0 110.467 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.22 -39.93 93.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.158 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.1 pt -100.4 9.39 8.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.54 42.95 5.65 Favored Glycine 0 CA--C 1.522 0.477 0 C-N-CA 120.415 -0.898 . . . . 0.0 114.108 178.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -146.21 -177.42 5.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.362 0.581 . . . . 0.0 111.081 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 49.1 mtm180 -116.99 151.56 36.48 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.991 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.436 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -80.99 122.24 27.05 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.665 -179.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.652 ' HD2' ' HB2' ' A' ' 24' ' ' CYS . 9.5 ptp180 -145.72 125.58 13.52 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.948 0.404 . . . . 0.0 110.135 179.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.582 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.0 t -92.41 107.36 19.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.785 -179.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 93.0 m -98.21 150.88 21.03 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 121.281 0.563 . . . . 0.0 111.842 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.636 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -98.27 150.14 4.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.876 179.833 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.413 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.4 mt -49.32 138.07 15.18 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.371 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.421 ' O ' HD13 ' A' ' 67' ' ' ILE . 29.4 Cg_exo -62.13 132.98 41.53 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 122.537 2.158 . . . . 0.0 112.581 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.496 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 49.8 mm -131.74 104.71 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.739 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.43 ' HA ' HD12 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -50.71 121.08 5.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.266 -179.905 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 118.51 -11.19 12.57 Favored Glycine 0 CA--C 1.517 0.182 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.77 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 3.0 pt20 -135.33 167.41 21.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.484 0.659 . . . . 0.0 111.347 -179.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -81.65 167.64 18.98 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.493 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.4 tt -83.79 124.5 39.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.045 0.45 . . . . 0.0 110.927 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.543 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.5 mm? -101.2 128.47 47.3 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.293 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -160.72 132.57 5.88 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.28 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -151.61 166.11 32.22 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.847 0.356 . . . . 0.0 110.685 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 54.0 m -95.28 138.04 22.0 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.498 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -81.73 137.61 10.15 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.23 1.953 . . . . 0.0 112.756 -179.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.04 2.53 1.05 Allowed 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.928 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.47 38.64 61.99 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.285 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 28.6 mt . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.201 -0.904 . . . . 0.0 111.187 -179.919 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.1 m -94.42 116.7 29.1 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.2 -167.25 40.19 Favored Glycine 0 N--CA 1.439 -1.115 0 C-N-CA 120.565 -0.826 . . . . 0.0 113.244 -177.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.53 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.9 tm? -57.91 -37.08 73.38 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.571 -0.815 . . . . 0.0 110.656 178.079 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.769 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -82.93 -37.14 24.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.249 -177.978 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.28 -13.15 0.02 OUTLIER Glycine 0 CA--C 1.528 0.902 0 N-CA-C 115.558 0.983 . . . . 0.0 115.558 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.466 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 20.7 m -107.29 124.36 49.67 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 118.589 1.194 . . . . 0.0 112.202 -178.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -89.35 105.22 17.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.026 -179.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.451 ' HG2' HG22 ' A' ' 20' ' ' THR . 24.7 mm-40 -130.12 -179.18 5.08 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.082 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.581 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 83.6 m -129.85 117.44 20.2 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.03 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -135.48 160.38 38.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.084 0.468 . . . . 0.0 111.415 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.505 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -85.22 167.0 16.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.732 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.8 t -131.88 157.49 43.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.765 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -80.14 -170.37 2.46 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.059 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.565 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.9 m -63.58 -44.39 98.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.516 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.565 ' HG ' HG23 ' A' ' 28' ' ' VAL . 25.4 mt -79.53 -20.11 47.95 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -178.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.43 -17.56 31.0 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 120.636 -0.792 . . . . 0.0 113.873 179.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 40.1 t -101.4 108.07 22.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 117.493 0.647 . . . . 0.0 111.028 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 177.14 172.0 0.51 Allowed 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.248 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -135.82 96.78 3.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.834 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.505 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.1 mt -124.78 134.6 52.73 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.644 -178.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.7 t70 51.55 83.93 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.515 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.5 m -109.12 129.98 55.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.481 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -153.76 177.4 11.03 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.809 0.338 . . . . 0.0 111.357 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -74.98 137.47 72.87 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.45 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.581 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 65.4 Cg_endo -89.64 112.34 0.52 Allowed 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.83 2.354 . . . . 0.0 112.402 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -90.48 113.53 0.46 Allowed 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 121.897 1.731 . . . . 0.0 112.218 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.52 -177.7 1.03 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.812 179.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 34.7 m -108.0 88.04 2.64 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 177.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.5 mt -64.88 126.71 28.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.653 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.37 -40.34 2.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.864 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -150.27 -167.72 2.9 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.008 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.33 -41.69 76.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.24 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 42.3 m -69.74 -40.17 76.34 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.707 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -60.15 -33.68 72.51 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.445 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 24.9 t80 -67.65 -39.07 84.61 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.61 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -60.24 -38.77 84.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.297 0.57 . . . . 0.0 109.489 178.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 66.3 m -69.83 -22.39 63.29 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.167 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 70.9 m -67.99 -44.51 76.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.45 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.555 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 57.8 m -79.49 -26.25 41.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.296 -179.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.63 -20.37 56.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.454 0.645 . . . . 0.0 110.084 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.64 -37.71 88.52 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 114.881 -1.054 . . . . 0.0 112.097 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.2 pt -102.76 2.44 10.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -178.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.92 41.62 3.76 Favored Glycine 0 CA--C 1.523 0.532 0 C-N-CA 120.288 -0.958 . . . . 0.0 113.903 178.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -148.52 -178.31 6.26 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 117.219 0.509 . . . . 0.0 111.08 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -119.03 152.68 35.99 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.115 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.555 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -65.43 117.25 7.67 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.523 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 14.1 mtp180 -134.16 113.25 11.84 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.005 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.636 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 13.9 t -90.85 107.48 19.21 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.545 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 55.5 m -103.41 148.94 25.29 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -178.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.769 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -103.67 145.71 12.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.656 -179.784 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.432 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.8 mt -50.14 138.54 19.6 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.352 -179.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 32.2 Cg_exo -62.04 138.06 70.7 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.622 2.215 . . . . 0.0 112.483 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.462 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.4 mm -131.37 107.69 13.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.628 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -48.96 120.0 3.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.002 0.43 . . . . 0.0 111.273 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 117.88 -12.42 13.24 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.852 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.7 pt20 -134.93 167.35 21.07 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.606 0.717 . . . . 0.0 111.547 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -82.12 170.2 15.76 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.638 -1.164 . . . . 0.0 110.348 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.0 tt -82.81 127.56 39.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.941 0.401 . . . . 0.0 110.735 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.529 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.8 mm? -101.87 112.7 25.41 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 120.894 0.378 . . . . 0.0 111.259 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 77.8 m -147.22 129.08 15.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.859 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.38 169.86 22.22 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.788 0.327 . . . . 0.0 110.749 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 57.6 m -92.07 136.75 25.59 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.718 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -84.94 141.28 8.32 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.518 2.145 . . . . 0.0 113.077 -179.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.75 3.02 1.06 Allowed 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.883 179.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.62 38.4 67.93 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.357 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 38.6 mt . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.112 179.921 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 25.6 p . . . . . 0 N--CA 1.467 0.383 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.3 m -95.22 117.67 30.66 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.29 -166.38 39.16 Favored Glycine 0 N--CA 1.44 -1.066 0 C-N-CA 120.549 -0.834 . . . . 0.0 113.326 -177.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.531 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.8 tm? -56.23 -37.39 69.65 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.523 -0.839 . . . . 0.0 110.714 178.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.79 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -82.65 -39.2 22.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.894 -178.204 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.76 -9.47 0.01 OUTLIER Glycine 0 CA--C 1.528 0.864 0 CA-C-N 115.072 -0.967 . . . . 0.0 115.469 176.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.56 HG22 ' HG2' ' A' ' 22' ' ' GLN . 24.7 m -109.81 123.0 48.79 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 118.382 1.091 . . . . 0.0 112.491 -178.216 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -86.85 102.51 14.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.793 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.56 ' HG2' HG22 ' A' ' 20' ' ' THR . 25.4 mm-40 -125.27 -170.01 2.09 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.819 -179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.5 t -144.08 121.14 11.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.792 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.09 159.82 41.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.932 0.396 . . . . 0.0 111.206 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -88.64 166.89 13.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.9 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.418 ' HB ' ' NH2' ' A' ' 59' ' ' ARG . 10.3 t -124.94 157.49 35.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.791 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -81.73 -169.78 2.51 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.184 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.55 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.4 m -63.43 -45.32 98.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.653 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.55 ' HG ' HG23 ' A' ' 28' ' ' VAL . 26.8 mt -77.79 -20.1 53.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.583 0.23 . . . . 0.0 111.474 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.87 -17.66 32.39 Favored Glycine 0 CA--C 1.522 0.53 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.567 179.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.415 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 43.9 t -101.99 107.99 22.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 117.301 0.55 . . . . 0.0 111.092 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 176.11 171.77 0.39 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.01 0.434 . . . . 0.0 111.326 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -136.16 86.45 2.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.53 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -110.59 136.4 49.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.873 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.4 t70 51.71 86.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.35 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -108.74 133.76 52.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.87 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -157.55 -178.51 7.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.927 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -82.89 138.75 43.08 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.965 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -88.89 113.1 0.64 Allowed 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.656 2.237 . . . . 0.0 111.991 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -90.59 114.15 0.46 Allowed 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 122.21 1.94 . . . . 0.0 112.639 -179.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.4 -178.22 1.11 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.721 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.9 m -108.05 88.72 2.8 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 177.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mt -63.61 123.0 17.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.358 -178.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.49 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.35 -33.86 3.78 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.739 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.485 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.2 p30 -163.04 -178.97 6.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.979 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.15 -59.63 3.98 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.943 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 44.5 m -60.84 -37.42 82.02 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.834 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.49 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.8 t60 -61.86 -31.29 71.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.054 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.439 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 17.8 t80 -72.07 -40.81 68.03 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.099 179.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.499 ' HB2' HD22 ' A' ' 80' ' ' LEU . 30.9 tt0 -62.12 -27.19 68.76 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.051 0.453 . . . . 0.0 110.0 178.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 31.2 t -76.43 -23.77 53.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.47 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 66.5 m -67.31 -38.38 84.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.889 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 3.9 m -85.04 -30.87 23.77 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.317 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.56 -19.7 61.45 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.517 0.675 . . . . 0.0 109.795 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.97 -38.01 89.55 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 114.702 -1.136 . . . . 0.0 112.1 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pt -106.87 6.72 9.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 112.627 0.602 . . . . 0.0 112.627 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.36 44.47 5.28 Favored Glycine 0 CA--C 1.523 0.59 0 C-N-CA 120.385 -0.912 . . . . 0.0 113.864 178.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -147.56 -177.93 5.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 117.346 0.573 . . . . 0.0 111.082 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.418 ' NH2' ' HB ' ' A' ' 26' ' ' THR . 30.6 mtm180 -117.83 155.8 29.48 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.276 -179.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.439 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -71.41 118.72 14.58 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.848 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.0 mmt180 -138.17 114.89 10.62 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.039 0.447 . . . . 0.0 111.859 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.613 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 28.7 t -89.82 111.11 22.03 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.591 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 63.6 m -107.92 149.3 28.5 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.79 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -101.64 143.09 15.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 114.937 -1.029 . . . . 0.0 110.475 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.7 mt -50.38 137.04 23.03 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.351 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.417 ' O ' HD13 ' A' ' 67' ' ' ILE . 38.9 Cg_exo -61.24 137.39 70.47 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.485 2.123 . . . . 0.0 112.415 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.47 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 47.8 mm -131.94 109.94 16.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.421 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 68' ' ' LEU . 2.1 pt? -48.18 117.21 1.83 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.292 0.567 . . . . 0.0 110.883 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 120.12 -10.66 10.9 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.487 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.47 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.4 pt20 -138.83 168.44 19.81 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.527 0.679 . . . . 0.0 111.219 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -88.03 168.95 12.38 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.822 -1.081 . . . . 0.0 110.306 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.2 tt -83.22 125.25 40.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.919 0.39 . . . . 0.0 110.701 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.583 ' HB2' HG11 ' A' ' 64' ' ' VAL . 3.9 mm? -97.82 111.39 23.7 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.321 -179.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 77.0 m -139.39 129.34 24.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.708 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -155.84 164.75 38.13 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.807 0.337 . . . . 0.0 110.926 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.415 ' CG2' ' HB2' ' A' ' 80' ' ' LEU . 92.7 m -100.4 121.98 51.44 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.84 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.99 127.36 23.02 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.413 2.075 . . . . 0.0 111.849 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.26 -115.1 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.099 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -141.26 37.3 1.65 Allowed Glycine 0 N--CA 1.438 -1.188 0 C-N-CA 120.852 -0.69 . . . . 0.0 113.739 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.499 HD22 ' HB2' ' A' ' 50' ' ' GLU . 20.3 mt . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.291 -0.862 . . . . 0.0 110.708 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.488 ' SG ' ' HA ' ' A' ' 21' ' ' ALA . 1.1 m . . . . . 0 CA--C 1.52 -0.208 0 CA-C-O 120.967 0.413 . . . . 0.0 111.164 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.593 ' O ' ' O ' ' A' ' 16' ' ' GLY . 95.5 p -119.47 -159.07 0.76 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.113 0.782 . . . . 0.0 113.113 -178.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.593 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -20.93 -149.8 0.0 OUTLIER Glycine 0 CA--C 1.529 0.95 0 N-CA-C 118.825 2.29 . . . . 0.0 118.825 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.574 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.7 tm? -23.27 -38.18 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 115.417 1.636 . . . . 0.0 115.417 -178.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.753 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 1.7 m-85 -67.97 -36.6 80.33 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.121 -0.631 . . . . 0.0 112.078 -177.113 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.36 -17.73 0.01 OUTLIER Glycine 0 CA--C 1.53 0.988 0 N-CA-C 115.416 0.927 . . . . 0.0 115.416 177.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.473 ' H ' ' C ' ' A' ' 18' ' ' TYR . 41.3 m -116.79 151.5 36.34 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 118.388 1.094 . . . . 0.0 112.0 -178.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.488 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . . . -116.63 111.43 19.85 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.773 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -135.11 -179.61 5.73 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.53 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.573 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 61.8 m -131.33 108.29 9.55 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.028 179.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.452 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 3.3 m -116.61 157.77 24.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.125 -179.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.468 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -88.06 165.46 15.14 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.2 t -128.54 157.05 42.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.926 0.393 . . . . 0.0 111.973 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -86.53 -170.22 2.99 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.026 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.536 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.3 m -61.09 -45.13 99.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.357 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.536 ' HG ' HG23 ' A' ' 28' ' ' VAL . 30.2 mt -77.81 -20.35 53.39 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 -179.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.38 -14.36 33.07 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 120.541 -0.838 . . . . 0.0 113.643 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.5 t -101.95 108.14 23.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 117.249 0.524 . . . . 0.0 111.033 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.91 152.1 0.34 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.958 0.409 . . . . 0.0 111.539 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -120.76 60.89 0.89 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.261 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.468 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.6 mt -88.57 138.25 31.59 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.364 -0.834 . . . . 0.0 112.433 -178.199 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.6 t70 39.64 81.22 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.552 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.452 ' HB2' ' HB3' ' A' ' 24' ' ' CYS . 37.0 t -128.89 152.17 48.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.056 0.455 . . . . 0.0 111.055 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -170.17 -172.94 1.4 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.05 -179.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -65.12 136.31 96.59 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.557 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.573 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.7 Cg_endo -90.39 114.69 0.5 Allowed 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.882 2.388 . . . . 0.0 112.483 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -91.35 113.76 0.38 Allowed 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.097 1.865 . . . . 0.0 112.255 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.65 -175.55 0.79 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.004 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.1 m -109.68 88.51 2.76 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.8 mt -64.95 123.5 19.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.115 -178.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.484 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.34 -31.36 4.38 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.484 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.7 p30 -164.68 -177.36 4.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.627 0.251 . . . . 0.0 111.137 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.558 ' HB1' HD21 ' A' ' 80' ' ' LEU . . . -52.72 -58.66 6.14 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.868 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 23.7 m -62.25 -37.1 84.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.894 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.484 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.9 t60 -61.52 -33.1 73.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.859 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.419 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 22.0 t80 -70.82 -40.04 72.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.165 179.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -64.03 -32.19 73.65 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.09 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.4 m -71.76 -24.29 61.74 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.21 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 52.2 m -66.86 -43.43 83.58 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.391 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.493 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 60.8 m -79.19 -26.78 42.6 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.477 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.62 -20.06 54.48 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.448 0.642 . . . . 0.0 110.372 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.09 -37.82 88.84 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.153 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.3 pt -104.5 4.97 10.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.18 42.08 4.12 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.381 -0.914 . . . . 0.0 113.953 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -148.81 -178.12 6.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 117.309 0.555 . . . . 0.0 111.278 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 77.0 mtp180 -118.46 162.5 18.24 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.056 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.493 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -76.27 119.35 20.04 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.129 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -138.36 110.18 7.17 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.947 0.403 . . . . 0.0 111.468 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.422 ' HB3' ' HB2' ' A' ' 18' ' ' TYR . 48.9 m -79.07 99.91 7.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.558 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 42.6 m -96.61 138.76 33.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.496 0.665 . . . . 0.0 111.874 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.753 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -96.88 146.92 6.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.497 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.7 mt -49.42 136.31 16.99 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.382 -179.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 33.2 Cg_exo -60.34 136.8 70.43 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.543 2.162 . . . . 0.0 112.929 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.483 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.9 mm -129.07 104.79 11.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.271 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.25 120.1 2.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.005 0.431 . . . . 0.0 111.235 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 117.01 -10.25 15.4 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.622 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.483 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.5 pt20 -137.85 168.36 19.86 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.585 0.707 . . . . 0.0 111.41 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -84.58 170.0 13.84 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.277 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.429 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.5 tt -82.99 126.32 40.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.965 0.412 . . . . 0.0 110.729 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.534 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.0 mm? -97.46 110.81 23.29 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.177 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.429 ' SG ' HG12 ' A' ' 72' ' ' ILE . 50.0 m -146.02 130.82 18.06 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.123 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -160.61 165.67 30.29 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.784 0.325 . . . . 0.0 110.754 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 50.4 m -81.01 136.55 50.38 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.961 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -87.37 137.6 4.35 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.619 2.212 . . . . 0.0 112.887 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.29 2.71 0.89 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.904 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.05 41.84 53.28 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.375 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.558 HD21 ' HB1' ' A' ' 46' ' ' ALA . 36.2 mt . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.24 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.463 0.18 0 CA-C-O 122.018 0.913 . . . . 0.0 112.86 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.582 ' O ' ' O ' ' A' ' 16' ' ' GLY . 1.8 m -101.13 -154.02 0.47 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.738 -1.119 . . . . 0.0 112.914 -176.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.582 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -13.32 -145.34 0.0 OUTLIER Glycine 0 CA--C 1.529 0.941 0 N-CA-C 118.355 2.102 . . . . 0.0 118.355 -179.097 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.438 HD22 ' HA ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -20.0 -47.62 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 -176.179 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.485 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 2.6 m-85 -69.85 -38.62 76.51 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.016 0.825 . . . . 0.0 111.369 -178.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 16' ' ' GLY . . . 56.23 -12.52 0.01 OUTLIER Glycine 0 CA--C 1.527 0.831 0 N-CA-C 116.092 1.197 . . . . 0.0 116.092 176.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.421 HG22 ' N ' ' A' ' 21' ' ' ALA . 21.2 m -135.31 155.41 50.67 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.849 1.325 . . . . 0.0 112.852 -177.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.424 ' HB1' ' CZ ' ' A' ' 49' ' ' PHE . . . -116.33 103.66 10.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.346 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -124.86 -169.51 2.0 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.872 0.368 . . . . 0.0 111.279 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.9 t -142.14 139.08 32.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.246 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -155.8 171.08 20.64 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.975 0.417 . . . . 0.0 111.181 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.36 168.59 10.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.802 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.1 t -133.9 157.79 45.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.79 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -81.91 -169.86 2.57 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.282 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.522 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.2 m -63.04 -45.08 99.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.737 -179.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.522 ' HG ' HG23 ' A' ' 28' ' ' VAL . 26.5 mt -78.38 -20.4 51.32 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.598 0.222 . . . . 0.0 111.598 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.27 -15.82 32.69 Favored Glycine 0 CA--C 1.522 0.491 0 C-N-CA 120.636 -0.793 . . . . 0.0 113.558 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.3 t -101.42 107.56 21.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 117.26 0.53 . . . . 0.0 110.932 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.99 166.62 0.93 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.069 0.462 . . . . 0.0 111.429 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -133.51 89.09 2.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.558 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -119.82 135.83 54.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.696 -178.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.7 t70 51.51 83.83 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.364 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.6 m -108.86 133.01 53.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.7 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -159.47 -179.03 7.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.141 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -78.49 140.3 59.89 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.005 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -90.69 113.86 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 122.906 2.404 . . . . 0.0 111.904 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -90.22 113.51 0.49 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 121.893 1.728 . . . . 0.0 112.845 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.422 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -176.16 -177.59 0.91 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.936 178.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.2 m -108.72 88.88 2.83 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 177.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.3 mt -64.2 124.93 22.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.678 -178.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.514 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.97 -33.01 3.83 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.862 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.473 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.5 p30 -163.5 -177.28 5.16 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.113 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.01 -59.23 4.59 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.929 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 23.0 m -61.82 -38.43 88.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.871 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.514 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.7 t60 -61.17 -32.26 71.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.03 0.443 . . . . 0.0 109.845 179.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.431 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 17.7 t80 -69.94 -37.03 75.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.12 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.66 -32.85 74.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.286 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.2 t -70.55 -20.54 62.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.508 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.422 HG23 ' CB ' ' A' ' 41' ' ' ALA . 54.4 m -68.45 -44.02 75.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.118 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 19.0 m -81.11 -28.44 35.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.493 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.85 -19.58 62.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.554 0.693 . . . . 0.0 109.717 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.49 -38.85 90.97 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 114.653 -1.158 . . . . 0.0 112.17 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.8 pt -105.27 8.39 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -179.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.63 38.78 10.24 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 120.438 -0.886 . . . . 0.0 113.452 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -139.21 -175.93 4.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.719 0.26 . . . . 0.0 110.866 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 77.3 mtp180 -120.46 155.36 33.7 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 121.008 0.433 . . . . 0.0 111.903 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.431 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -84.97 124.96 32.28 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.022 -179.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.541 ' HE ' ' HB3' ' A' ' 74' ' ' CYS . 13.8 ptm180 -149.49 125.16 10.41 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.131 0.491 . . . . 0.0 110.909 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 31.8 m -85.26 99.61 11.24 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.719 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 59.9 m -90.94 143.21 26.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.331 0.586 . . . . 0.0 111.265 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.528 ' CG1' ' HB2' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -99.77 146.38 8.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.662 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 7.0 mt -49.43 133.09 18.2 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.502 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 24.3 Cg_exo -64.27 139.76 67.45 Favored 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 122.615 2.21 . . . . 0.0 112.596 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 51.0 mm -129.08 109.55 18.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.231 179.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.26 109.16 0.17 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.827 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.46 -13.49 6.22 Favored Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.611 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -133.51 167.71 19.96 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.524 0.678 . . . . 0.0 111.227 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -83.22 169.61 15.57 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.654 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.8 tt -83.19 126.89 40.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.719 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.528 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.1 mm? -101.96 112.21 24.76 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.965 0.412 . . . . 0.0 111.284 -179.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.541 ' HB3' ' HE ' ' A' ' 61' ' ' ARG . 63.4 m -143.99 135.09 25.51 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.703 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -158.26 171.24 20.55 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.947 0.403 . . . . 0.0 111.013 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.5 m -99.08 137.01 20.38 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.696 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -87.67 142.16 5.76 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.545 2.163 . . . . 0.0 112.821 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.58 6.5 2.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.782 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.92 36.09 73.16 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.26 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 38.5 mt . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.008 179.902 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.4 t . . . . . 0 CA--C 1.52 -0.211 0 CA-C-O 121.147 0.498 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.592 ' O ' ' O ' ' A' ' 16' ' ' GLY . 87.5 p -120.25 -156.35 0.66 Allowed 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.529 -178.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.592 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -17.01 -146.92 0.0 OUTLIER Glycine 0 CA--C 1.53 0.981 0 N-CA-C 118.349 2.1 . . . . 0.0 118.349 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.524 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.1 tm? -22.03 -41.41 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 115.19 1.552 . . . . 0.0 115.19 -177.474 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.613 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 2.0 m-85 -69.13 -36.91 78.0 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.093 -0.643 . . . . 0.0 111.947 -177.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.87 -14.09 0.02 OUTLIER Glycine 0 CA--C 1.528 0.853 0 N-CA-C 115.495 0.958 . . . . 0.0 115.495 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.454 ' H ' ' C ' ' A' ' 18' ' ' TYR . 28.2 m -140.26 144.89 36.7 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 118.471 1.135 . . . . 0.0 112.215 -178.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.433 ' HB1' ' CZ ' ' A' ' 49' ' ' PHE . . . -108.59 112.56 24.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.707 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.46 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 16.8 mm-40 -131.32 -175.91 3.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.0 0.429 . . . . 0.0 111.216 -179.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.569 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 71.0 m -127.56 109.97 12.25 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.032 179.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.536 ' HB2' ' HD3' ' A' ' 61' ' ' ARG . 59.2 m -127.59 155.92 43.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.094 0.474 . . . . 0.0 111.416 -179.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -86.42 165.41 16.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.584 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.7 t -126.43 157.22 39.16 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.478 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -80.78 -170.34 2.61 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.106 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.547 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.0 m -62.93 -45.53 98.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.547 ' HG ' HG23 ' A' ' 28' ' ' VAL . 28.0 mt -78.46 -20.17 51.53 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.647 0.261 . . . . 0.0 111.615 -178.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.29 -16.11 32.45 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.631 -0.795 . . . . 0.0 113.784 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.3 t -101.49 108.11 22.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 117.163 0.481 . . . . 0.0 111.191 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.21 167.17 0.78 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 121.106 0.479 . . . . 0.0 111.492 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -133.04 85.94 2.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.464 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -114.2 141.9 46.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.983 -178.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 46.8 82.1 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.863 178.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 34.2 m -110.0 129.64 55.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.929 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -153.18 -178.07 6.71 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.056 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -78.28 134.86 62.28 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.553 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.569 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.1 Cg_endo -89.61 114.61 0.6 Allowed 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.832 2.355 . . . . 0.0 112.053 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -90.7 112.87 0.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 121.885 1.724 . . . . 0.0 112.342 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -176.0 -176.55 0.83 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.756 179.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 42.6 m -111.22 88.58 2.82 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.3 mt -61.44 122.03 14.17 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.397 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.464 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.4 -32.84 4.0 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.94 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.469 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.1 p30 -165.41 -178.92 5.21 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 120.756 0.312 . . . . 0.0 111.307 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.14 -60.14 3.25 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 112.007 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 32.0 m -60.97 -36.57 79.76 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.857 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.469 ' HB3' ' H ' ' A' ' 45' ' ' ASN . 1.6 t60 -62.76 -31.73 72.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.77 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.435 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 13.2 t80 -70.17 -38.66 75.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.958 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -64.55 -34.67 78.8 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.426 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.2 t -72.92 -13.06 61.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.061 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 87.1 m -80.3 -40.83 26.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.232 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.451 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 72.8 m -85.93 -25.43 26.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.261 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.4 -19.91 52.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.363 0.602 . . . . 0.0 110.357 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.7 -37.72 88.56 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.051 -0.977 . . . . 0.0 112.278 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.1 pt -103.28 7.33 9.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.58 40.97 5.22 Favored Glycine 0 CA--C 1.522 0.493 0 C-N-CA 120.408 -0.901 . . . . 0.0 114.041 178.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -146.77 -179.03 6.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.344 0.572 . . . . 0.0 111.142 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 44.0 mtp180 -116.81 153.55 32.27 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.111 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.451 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -77.32 121.22 23.42 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.569 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.558 HH21 ' HB2' ' A' ' 74' ' ' CYS . 13.4 ptm180 -155.6 115.58 3.71 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 121.23 0.538 . . . . 0.0 110.551 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 20' ' ' THR . 33.5 m -79.11 103.21 8.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.745 -179.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 23.4 m -94.12 123.94 37.82 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 121.435 0.636 . . . . 0.0 111.572 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.665 HG11 ' HB2' ' A' ' 73' ' ' LEU . 1.5 p -72.85 148.05 9.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.182 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.437 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 7.9 mt -51.88 137.32 35.5 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.931 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 31.2 Cg_exo -60.37 124.78 15.84 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.386 2.057 . . . . 0.0 112.369 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.48 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.0 mm -124.85 101.67 9.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.565 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -48.33 120.21 3.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.14 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.2 -12.18 11.41 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.63 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.8 pt20 -135.27 168.45 19.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.396 0.617 . . . . 0.0 111.137 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -84.35 166.25 17.56 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.252 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.454 HG12 ' SG ' ' A' ' 74' ' ' CYS . 15.9 tt -83.31 126.91 40.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.807 0.337 . . . . 0.0 110.575 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.665 ' HB2' HG11 ' A' ' 64' ' ' VAL . 4.0 mm? -99.55 102.22 13.68 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.589 -179.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.558 ' HB2' HH21 ' A' ' 61' ' ' ARG . 44.3 m -137.81 131.63 31.44 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.803 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -160.32 163.44 33.32 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.745 0.307 . . . . 0.0 111.218 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.6 m -99.99 116.79 64.31 Favored Pre-proline 0 CA--C 1.532 0.274 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.11 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.21 136.73 61.84 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.663 2.242 . . . . 0.0 112.722 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.25 1.67 0.74 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.05 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.83 38.79 65.65 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.252 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 36.0 mt . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.155 -0.926 . . . . 0.0 111.104 179.934 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.3 t . . . . . 0 N--CA 1.472 0.662 0 N-CA-C 113.161 0.8 . . . . 0.0 113.161 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.8 p -95.42 115.32 27.26 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 171.31 -165.72 38.77 Favored Glycine 0 N--CA 1.44 -1.074 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.272 -177.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.532 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.7 tm? -61.67 -36.37 80.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.631 -0.784 . . . . 0.0 110.337 177.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.808 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -81.58 -36.01 29.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.256 -178.167 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.79 -11.56 0.02 OUTLIER Glycine 0 CA--C 1.529 0.919 0 N-CA-C 115.859 1.104 . . . . 0.0 115.859 177.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.602 HG22 ' HG2' ' A' ' 22' ' ' GLN . 16.3 m -111.3 126.96 55.46 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 118.792 1.296 . . . . 0.0 112.613 -178.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -96.55 101.35 12.95 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.816 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.602 ' HG2' HG22 ' A' ' 20' ' ' THR . 28.1 mm-40 -128.52 -174.74 3.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.935 0.397 . . . . 0.0 111.145 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.615 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 64.3 m -134.8 114.75 12.93 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.123 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.82 161.42 32.98 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.983 0.421 . . . . 0.0 111.164 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.494 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -87.94 166.34 14.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.675 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.0 t -131.05 157.64 42.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.814 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.11 -169.59 2.47 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.103 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.503 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.9 m -62.0 -47.14 94.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.747 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.503 ' HG ' HG23 ' A' ' 28' ' ' VAL . 33.2 mt -76.91 -19.99 56.74 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -178.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.98 -12.23 31.88 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.353 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.582 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.4 p -100.64 108.72 23.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 117.137 0.469 . . . . 0.0 111.255 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 172.72 153.72 0.08 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.881 -179.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -123.88 67.26 1.03 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.632 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.494 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.0 mt -90.3 135.76 33.48 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.466 -178.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 52.23 83.44 0.06 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.39 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.7 m -108.91 134.0 52.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.537 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -160.62 -178.28 6.77 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.838 0.351 . . . . 0.0 111.319 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 -81.33 136.82 49.08 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.725 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.615 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 68.4 Cg_endo -90.51 117.08 0.59 Allowed 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 123.034 2.489 . . . . 0.0 112.746 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -91.31 113.41 0.37 Allowed 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.052 1.835 . . . . 0.0 112.227 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.89 -178.57 1.06 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.833 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.9 m -109.27 88.09 2.65 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 177.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.0 mt -63.08 124.4 21.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.408 -178.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -117.8 -40.33 3.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.981 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -151.08 -168.41 3.09 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.985 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.89 -44.32 81.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.2 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.5 m -68.35 -39.22 81.94 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.552 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -60.25 -34.99 74.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.787 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.418 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 21.4 t80 -68.42 -39.07 81.73 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.932 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -61.78 -39.57 92.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.23 0.538 . . . . 0.0 109.746 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.1 m -68.09 -24.33 65.04 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.171 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 90.4 m -68.56 -43.52 76.45 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.304 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.531 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 59.0 m -78.74 -26.13 44.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.102 -179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.63 -19.93 54.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.4 0.619 . . . . 0.0 110.139 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.05 -37.29 86.89 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.983 -1.008 . . . . 0.0 112.043 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.3 pt -105.39 8.74 9.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 -178.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.67 42.72 5.67 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 120.413 -0.899 . . . . 0.0 114.015 178.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -147.83 -178.55 6.33 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 117.336 0.568 . . . . 0.0 111.192 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -120.31 153.15 36.82 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.338 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.531 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -67.99 117.67 10.16 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.704 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.3 mmm180 -136.02 115.24 12.48 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.988 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.708 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 23.0 t -93.29 109.28 20.81 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.554 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 76.7 m -104.67 148.67 26.31 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.808 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -99.02 148.32 6.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.761 179.861 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.424 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.2 mt -49.48 140.74 13.38 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.395 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.466 ' O ' HD13 ' A' ' 67' ' ' ILE . 33.0 Cg_exo -59.52 137.98 81.03 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.674 2.249 . . . . 0.0 112.495 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.466 HD13 ' O ' ' A' ' 66' ' ' PRO . 31.1 mm -131.97 108.56 14.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.308 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.414 HD12 ' HA ' ' A' ' 68' ' ' LEU . 0.7 OUTLIER -52.72 121.46 7.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.001 0.429 . . . . 0.0 111.406 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 114.76 -4.58 22.76 Favored Glycine 0 C--N 1.33 0.212 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.682 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 14.2 pt20 -148.67 165.4 31.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.324 0.583 . . . . 0.0 111.189 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -81.37 169.9 16.66 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.648 -179.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.3 tt -82.74 123.65 38.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.116 0.484 . . . . 0.0 110.502 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.526 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.1 mm? -90.52 110.93 22.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.254 -179.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 67.2 m -138.15 132.33 31.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.143 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.81 168.64 26.83 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.815 0.34 . . . . 0.0 110.611 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.0 m -96.73 137.25 21.42 Favored Pre-proline 0 CA--C 1.532 0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.761 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -83.48 139.49 9.07 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.418 2.079 . . . . 0.0 112.958 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.06 3.37 1.25 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.038 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.35 38.51 87.3 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.249 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 31.5 mt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.235 179.965 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.6 t . . . . . 0 CA--C 1.52 -0.192 0 CA-C-O 121.24 0.543 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.599 ' O ' ' O ' ' A' ' 16' ' ' GLY . 88.7 p -115.16 -156.4 0.6 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.588 -178.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.599 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -17.58 -148.35 0.0 OUTLIER Glycine 0 CA--C 1.529 0.933 0 N-CA-C 118.701 2.241 . . . . 0.0 118.701 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.491 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -23.23 -41.41 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -177.232 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.592 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 5.3 m-85 -68.3 -36.74 79.8 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 119.895 -0.722 . . . . 0.0 111.497 -177.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.2 -12.13 0.01 OUTLIER Glycine 0 CA--C 1.526 0.742 0 N-CA-C 115.644 1.018 . . . . 0.0 115.644 176.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.437 HG22 ' HG2' ' A' ' 22' ' ' GLN . 26.9 m -137.91 143.34 40.77 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 118.631 1.216 . . . . 0.0 112.451 -178.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.434 ' HB1' ' CZ ' ' A' ' 49' ' ' PHE . . . -110.6 106.39 15.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.554 179.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.477 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 20.0 mm-40 -126.18 -176.55 3.68 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.834 0.35 . . . . 0.0 111.309 -179.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.506 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 72.6 m -124.64 111.8 16.04 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.159 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.577 ' HB2' ' HD3' ' A' ' 61' ' ' ARG . 63.6 m -128.61 153.84 46.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.208 0.527 . . . . 0.0 111.566 -179.265 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.437 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -84.88 166.81 16.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.667 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.5 t -133.96 158.23 44.03 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.742 -179.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -77.99 -169.93 1.74 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.369 -179.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.536 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.3 m -64.25 -46.61 92.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.722 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.536 ' HG ' HG23 ' A' ' 28' ' ' VAL . 30.7 mt -75.91 -19.94 58.41 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -178.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.75 -15.29 31.76 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 120.589 -0.815 . . . . 0.0 113.625 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.4 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 40.4 t -101.49 107.83 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 117.28 0.54 . . . . 0.0 111.006 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 176.17 158.46 0.27 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.315 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -127.48 89.92 3.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.78 179.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.437 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.9 mt -116.73 141.91 47.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.798 -178.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.6 t70 48.9 83.3 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.679 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 35.8 m -112.78 131.1 55.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.018 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -161.66 -179.51 7.33 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.878 0.37 . . . . 0.0 111.099 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -73.26 133.16 81.28 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.271 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.506 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 63.7 Cg_endo -90.14 124.11 1.14 Allowed 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.807 2.338 . . . . 0.0 112.14 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -90.85 113.32 0.41 Allowed 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 121.88 1.72 . . . . 0.0 112.34 -179.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.75 -179.69 1.24 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.615 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 48.3 m -109.66 88.03 2.65 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 177.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.4 mt -61.84 120.73 11.29 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.201 -178.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.497 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.33 -33.39 3.89 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.904 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.476 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.1 p30 -165.14 -178.76 5.27 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.738 0.304 . . . . 0.0 111.288 -179.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.22 -60.71 2.57 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.213 -0.449 . . . . 0.0 112.1 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 22.0 m -60.1 -37.25 79.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.825 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.497 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.6 t60 -62.02 -32.63 73.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.929 179.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.439 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 11.0 t80 -69.51 -39.19 77.7 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.881 178.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -63.53 -38.39 90.96 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.009 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.9 m -67.16 -15.48 63.74 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.377 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 91.5 m -79.34 -41.4 27.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.517 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.455 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 74.8 m -86.04 -22.99 26.94 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.251 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.93 -20.02 42.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.388 0.613 . . . . 0.0 110.361 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.1 -37.78 88.68 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.054 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.6 pt -104.42 11.17 8.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.21 43.75 6.51 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.5 -0.857 . . . . 0.0 114.185 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -144.34 179.89 6.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 117.399 0.599 . . . . 0.0 111.136 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -115.32 145.6 42.33 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.195 -179.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.455 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -72.25 123.69 23.49 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.344 -179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.577 ' HD3' ' HB2' ' A' ' 24' ' ' CYS . 13.9 ptm180 -155.86 126.29 6.74 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.929 0.395 . . . . 0.0 110.507 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.406 ' HB3' ' O ' ' A' ' 20' ' ' THR . 25.5 m -90.45 100.74 13.53 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.961 -179.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.533 ' HA ' ' HB2' ' A' ' 74' ' ' CYS . 9.2 m -98.32 115.34 28.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.247 0.546 . . . . 0.0 112.234 -178.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.626 HG12 ' O ' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -65.64 146.25 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.466 179.212 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.5 mt -49.81 135.31 20.24 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.261 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -62.43 136.96 62.16 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.506 2.138 . . . . 0.0 112.574 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.491 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 51.2 mm -129.12 104.54 11.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.482 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.59 119.5 2.46 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.035 0.445 . . . . 0.0 111.16 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.43 -12.14 11.22 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.553 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.7 pt20 -135.21 168.46 19.11 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.486 0.66 . . . . 0.0 111.207 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -82.24 166.12 19.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.308 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.3 tt -83.53 124.65 39.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-O 120.951 0.405 . . . . 0.0 111.072 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.626 ' O ' HG12 ' A' ' 64' ' ' VAL . 3.7 mm? -101.19 109.42 21.3 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.849 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.533 ' HB2' ' HA ' ' A' ' 63' ' ' CYS . 51.3 t -161.78 133.65 5.59 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.515 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -160.95 171.88 17.91 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.099 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 74.4 m -77.7 136.97 62.88 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.665 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -84.09 134.41 6.04 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.398 2.066 . . . . 0.0 112.887 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.37 2.29 1.13 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.024 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 73.5 42.17 41.77 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.463 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 28.2 mt . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.148 179.907 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.481 1.124 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -93.73 116.95 29.46 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.0 -166.18 39.02 Favored Glycine 0 N--CA 1.439 -1.128 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.996 -177.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.523 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.7 tm? -59.05 -36.73 75.53 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.596 -0.802 . . . . 0.0 110.686 178.07 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.758 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -82.29 -37.58 25.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.141 -178.106 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.07 -12.34 0.02 OUTLIER Glycine 0 CA--C 1.529 0.911 0 N-CA-C 115.586 0.994 . . . . 0.0 115.586 177.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.529 HG22 ' HG2' ' A' ' 22' ' ' GLN . 17.9 m -109.1 123.87 49.88 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 118.625 1.212 . . . . 0.0 112.194 -178.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.2 102.29 14.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.931 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.529 ' HG2' HG22 ' A' ' 20' ' ' THR . 26.2 mm-40 -128.41 -174.22 3.17 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.051 0.453 . . . . 0.0 111.249 -179.28 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.571 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 70.9 m -128.03 116.14 19.56 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.031 179.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.556 ' HB2' ' HD3' ' A' ' 61' ' ' ARG . 78.2 m -129.77 158.49 39.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.068 0.461 . . . . 0.0 111.407 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.32 165.71 12.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.569 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.2 t -125.55 157.39 37.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.78 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -81.48 -170.1 2.62 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.224 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.529 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.3 m -62.65 -47.1 94.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.529 ' HG ' HG23 ' A' ' 28' ' ' VAL . 29.1 mt -77.65 -20.28 54.04 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.587 0.232 . . . . 0.0 111.531 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.21 -17.47 31.65 Favored Glycine 0 CA--C 1.522 0.483 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.696 179.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.415 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 49.0 t -101.61 108.07 22.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 117.276 0.538 . . . . 0.0 111.142 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 175.45 170.9 0.32 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.058 0.456 . . . . 0.0 111.328 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -133.28 95.05 3.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.58 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mt -120.53 140.52 51.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.892 -178.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.6 t70 48.1 82.53 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.795 178.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 47.1 m -113.13 129.79 56.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.821 179.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.76 -178.28 7.14 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.979 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -73.92 136.94 76.4 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.496 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.571 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.1 Cg_endo -89.47 117.17 0.75 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.826 2.35 . . . . 0.0 112.276 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -90.52 112.74 0.43 Allowed 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 121.765 1.643 . . . . 0.0 112.561 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -176.28 -176.35 0.77 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.647 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.6 m -110.84 88.54 2.8 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -63.09 124.32 20.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.382 -178.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.474 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.73 -33.72 3.73 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.75 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.476 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.8 p30 -163.2 -178.6 6.08 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.157 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.13 -59.68 3.92 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.333 -0.394 . . . . 0.0 112.005 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 35.0 m -61.54 -36.1 79.64 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.975 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.476 ' HB3' ' H ' ' A' ' 45' ' ' ASN . 1.9 t60 -62.44 -32.95 73.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.824 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.49 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 18.3 t80 -70.34 -39.56 74.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.944 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -60.63 -36.85 79.66 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.27 0.557 . . . . 0.0 109.773 178.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 51.1 m -67.34 -22.73 65.58 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.479 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 75.6 m -70.07 -43.77 70.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.551 -179.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.538 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 81.0 m -83.02 -24.94 32.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.189 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.96 -19.92 56.75 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.414 0.626 . . . . 0.0 110.115 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.97 -38.86 92.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.891 -1.049 . . . . 0.0 112.137 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.8 pt -101.76 9.91 8.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.41 39.47 6.33 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.554 -0.831 . . . . 0.0 114.225 178.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -146.41 -177.47 5.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 117.161 0.481 . . . . 0.0 111.131 179.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 58.3 mtt180 -119.97 154.96 33.73 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.682 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.538 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -65.9 119.61 11.62 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.364 -179.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.556 ' HD3' ' HB2' ' A' ' 24' ' ' CYS . 39.6 mtp180 -135.93 118.29 15.7 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.161 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.664 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 14.2 t -96.19 107.04 19.32 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.556 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 54.3 m -102.8 146.94 27.5 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.365 0.602 . . . . 0.0 112.548 -178.393 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.758 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -97.76 143.85 12.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.55 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.9 mt -49.66 139.55 15.64 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.212 -179.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 31.5 Cg_exo -59.28 132.8 48.71 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.54 2.16 . . . . 0.0 112.5 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.468 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 51.1 mm -129.55 106.94 14.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.763 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.21 120.47 5.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.301 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.07 -12.53 11.46 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.635 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.468 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.9 pt20 -135.44 167.25 21.42 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.504 0.668 . . . . 0.0 111.299 -179.771 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -81.84 169.87 16.36 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.218 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.1 tt -82.8 125.71 40.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.895 0.378 . . . . 0.0 110.928 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.559 ' HB2' HG11 ' A' ' 64' ' ' VAL . 3.8 mm? -101.61 113.01 25.76 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.01 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 72.5 m -146.45 129.12 16.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.048 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -160.87 170.13 21.28 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 120.867 0.365 . . . . 0.0 110.986 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 85.4 m -92.61 136.41 25.24 Favored Pre-proline 0 CA--C 1.532 0.28 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.001 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -86.89 144.36 7.3 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.685 2.257 . . . . 0.0 112.599 -179.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 68.36 -0.94 2.02 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.759 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.11 35.7 64.26 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.578 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 42.1 mt . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.253 -0.879 . . . . 0.0 111.172 179.934 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 14.6 p . . . . . 0 C--O 1.232 0.164 0 CA-C-O 120.876 0.369 . . . . 0.0 111.541 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.6 p -97.59 116.89 30.68 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 173.35 -155.17 21.92 Favored Glycine 0 N--CA 1.435 -1.387 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.57 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.483 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.8 tm? -62.96 -42.45 99.83 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.762 0.425 . . . . 0.0 111.225 178.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.802 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -78.1 -38.15 44.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.179 0.514 . . . . 0.0 112.028 -178.222 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.9 -8.92 0.02 OUTLIER Glycine 0 CA--C 1.527 0.785 0 CA-C-N 115.148 -0.933 . . . . 0.0 115.288 176.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.429 HG22 ' HG2' ' A' ' 22' ' ' GLN . 89.9 m -112.54 123.05 49.44 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 118.491 1.145 . . . . 0.0 112.546 -178.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.1 118.49 27.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.081 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.429 ' HG2' HG22 ' A' ' 20' ' ' THR . 77.5 mm-40 -146.52 167.79 22.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.858 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.508 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 60.8 m -117.45 113.29 21.83 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.09 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.09 156.35 49.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.018 0.437 . . . . 0.0 111.269 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.519 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -80.56 166.35 21.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.747 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.4 t -131.02 157.68 42.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.927 -179.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -82.17 -169.6 2.48 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.237 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.566 HG23 ' HG ' ' A' ' 29' ' ' LEU . 8.5 m -62.65 -46.16 97.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.612 -179.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.566 ' HG ' HG23 ' A' ' 28' ' ' VAL . 29.3 mt -78.42 -20.12 51.77 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 -178.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.43 -15.36 32.56 Favored Glycine 0 CA--C 1.52 0.402 0 C-N-CA 120.633 -0.794 . . . . 0.0 113.575 179.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.5 t -101.53 108.13 22.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 117.244 0.522 . . . . 0.0 111.181 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 177.68 168.39 0.68 Allowed 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.264 179.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.412 ' HB2' HD13 ' A' ' 72' ' ' ILE . 10.1 t70 -134.42 90.38 2.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.731 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.1 mt -118.6 135.91 54.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.605 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 51.9 84.08 0.05 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.349 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -109.29 134.96 51.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.863 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.7 164.24 36.09 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.182 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -60.92 136.01 93.24 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.914 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.508 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.7 Cg_endo -90.16 109.66 0.4 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.825 2.35 . . . . 0.0 112.3 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -91.21 113.88 0.39 Allowed 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.124 1.883 . . . . 0.0 112.741 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.417 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.47 -177.44 1.0 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.788 178.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.3 m -109.09 88.65 2.78 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.0 mt -65.61 120.16 12.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.352 -178.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -117.32 -40.58 3.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.791 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -151.99 -169.09 3.26 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.969 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.46 -48.48 77.53 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.423 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 27.8 m -66.75 -42.05 86.83 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.679 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -60.04 -32.82 71.27 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.535 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 13.9 t80 -68.54 -38.88 81.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.866 178.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -62.45 -37.39 85.7 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.143 0.497 . . . . 0.0 109.769 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.0 m -69.6 -13.37 62.28 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.616 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.417 HG23 ' CB ' ' A' ' 41' ' ' ALA . 49.8 m -75.08 -44.89 44.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.436 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.504 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 60.4 m -84.99 -25.52 27.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.974 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.3 -20.16 59.27 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.519 0.676 . . . . 0.0 109.921 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.46 -38.57 90.22 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.733 -1.121 . . . . 0.0 112.145 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.1 pt -100.98 -0.93 10.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.98 39.69 2.83 Favored Glycine 0 CA--C 1.521 0.446 0 C-N-CA 120.284 -0.96 . . . . 0.0 113.963 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -149.8 -177.21 5.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 117.057 0.428 . . . . 0.0 110.906 179.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 53.5 mtt180 -118.76 154.82 32.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.843 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.535 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -70.37 116.62 10.92 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.256 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.8 mmm180 -133.56 118.42 18.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.038 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.673 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 34.7 t -94.32 108.62 20.5 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.42 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.568 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 65.5 m -105.82 146.01 30.45 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.399 0.619 . . . . 0.0 112.551 -178.312 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.802 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -95.18 146.95 6.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.39 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.4 mt -49.49 135.64 17.78 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.369 -179.184 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 30.8 Cg_exo -62.32 136.47 59.85 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.571 2.18 . . . . 0.0 112.452 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.5 mm -129.92 109.02 17.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.417 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.54 109.29 0.29 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.058 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.97 -11.62 6.19 Favored Glycine 0 C--N 1.333 0.384 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.882 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -135.8 167.87 20.36 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.484 0.659 . . . . 0.0 111.41 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -81.39 166.95 19.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.301 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.412 HD13 ' HB2' ' A' ' 33' ' ' ASP . 17.9 tt -83.3 124.32 39.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 121.037 0.446 . . . . 0.0 110.803 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.529 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.0 mm? -97.68 110.39 22.96 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.224 -179.425 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 68.2 m -141.15 130.83 24.11 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.595 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -154.78 161.18 41.6 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.781 0.324 . . . . 0.0 110.874 -179.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 71.4 m -100.56 123.52 45.79 Favored Pre-proline 0 CA--C 1.533 0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.127 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -67.21 140.79 54.77 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.563 2.175 . . . . 0.0 112.714 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.11 2.32 1.04 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.061 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.68 35.07 73.41 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.408 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.3 mt . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.996 179.897 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.464 0.275 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.8 p -96.27 115.57 27.64 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.12 -155.08 22.94 Favored Glycine 0 N--CA 1.436 -1.31 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.397 -177.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.5 tm? -67.16 -40.13 86.6 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.899 0.381 . . . . 0.0 110.717 177.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.759 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.2 OUTLIER -75.23 -37.97 60.84 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.268 0.556 . . . . 0.0 111.422 -178.8 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.75 -9.44 0.02 OUTLIER Glycine 0 CA--C 1.524 0.651 0 CA-C-N 114.922 -1.035 . . . . 0.0 114.945 177.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.526 HG22 ' HG2' ' A' ' 22' ' ' GLN . 6.0 m -109.56 142.36 40.76 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 118.16 0.98 . . . . 0.0 112.212 -178.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -113.74 100.64 8.61 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.484 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.563 ' NE2' ' HA ' ' A' ' 38' ' ' ASN . 6.1 mm-40 -134.23 -177.74 4.72 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.919 0.39 . . . . 0.0 111.349 -178.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.511 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 56.9 m -126.34 106.82 9.78 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 178.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.438 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 2.0 m -109.08 154.46 22.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.604 -178.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -91.0 166.97 12.73 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.699 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.3 t -131.86 158.25 41.82 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -179.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.93 -169.63 2.09 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.198 -179.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.536 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.1 m -63.56 -46.34 95.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.676 -179.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.536 ' HG ' HG23 ' A' ' 28' ' ' VAL . 34.3 mt -76.25 -19.65 58.13 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -178.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.97 -13.29 31.81 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.566 -0.826 . . . . 0.0 113.497 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.416 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 61.1 t -101.45 108.05 22.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 117.132 0.466 . . . . 0.0 111.108 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 176.13 163.4 0.37 Allowed 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.406 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -134.56 65.95 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.431 179.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 mt -93.15 138.38 31.62 Favored 'General case' 0 C--O 1.226 -0.159 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.567 -178.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 43.95 83.42 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.769 177.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.438 ' HB2' ' HB3' ' A' ' 24' ' ' CYS . 21.0 t -133.33 136.38 45.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.91 0.386 . . . . 0.0 110.66 179.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -164.1 -174.87 3.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.503 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.563 ' HA ' ' NE2' ' A' ' 22' ' ' GLN . 6.3 p30 -58.43 126.35 78.67 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.702 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.511 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 68.4 Cg_endo -90.57 134.37 1.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 122.751 2.301 . . . . 0.0 112.293 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -91.66 113.76 0.36 Allowed 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.207 1.938 . . . . 0.0 112.839 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.406 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.63 -178.63 1.12 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.021 179.029 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.0 m -110.33 88.47 2.77 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 177.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.9 mt -64.56 120.15 11.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.41 -178.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -115.36 -40.94 3.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.78 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -152.01 -169.02 3.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.806 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.11 -41.56 94.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.221 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.1 m -70.61 -44.47 67.17 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.759 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -58.56 -34.88 71.53 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.447 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 13.5 t80 -67.32 -38.33 84.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.581 178.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -60.66 -40.51 92.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.222 0.535 . . . . 0.0 109.761 178.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.6 m -66.3 -23.85 66.45 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.442 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.406 HG23 ' CB ' ' A' ' 41' ' ' ALA . 66.4 m -63.97 -45.93 86.9 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.501 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 61.1 m -80.11 -28.75 38.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.25 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.92 -20.08 61.82 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.579 0.704 . . . . 0.0 109.948 -179.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.45 -36.61 84.72 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.876 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.3 pt -108.71 1.08 9.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -179.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.84 43.46 2.64 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 120.324 -0.941 . . . . 0.0 114.306 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -148.83 174.64 12.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 117.468 0.634 . . . . 0.0 110.923 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.437 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 11.7 ptm180 -119.01 142.18 48.04 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.766 0.317 . . . . 0.0 110.992 -179.682 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.447 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -60.51 125.77 24.92 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.167 -179.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.468 ' HB2' ' SG ' ' A' ' 74' ' ' CYS . 8.6 ptm180 -153.63 127.87 9.12 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.125 179.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.42 ' HB2' ' CD2' ' A' ' 18' ' ' TYR . 6.4 m -95.02 105.11 17.0 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.846 -178.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 3.9 m -105.58 136.24 45.52 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.12 0.486 . . . . 0.0 111.934 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.759 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -85.29 148.4 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.922 179.911 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.7 mt -49.5 137.7 16.59 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.126 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 37.2 Cg_exo -60.79 137.12 70.74 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 122.458 2.105 . . . . 0.0 112.464 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.462 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 51.1 mm -129.56 106.1 13.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.565 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.412 ' HA ' HD12 ' A' ' 68' ' ' LEU . 0.6 OUTLIER -47.63 120.69 3.47 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.379 -179.716 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 116.21 -11.93 16.91 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.718 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.3 pt20 -138.6 169.51 17.67 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.492 0.663 . . . . 0.0 111.335 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -84.4 165.34 18.27 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.968 179.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.9 tt -83.66 122.97 38.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.206 0.527 . . . . 0.0 110.938 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.619 ' O ' HG12 ' A' ' 64' ' ' VAL . 4.1 mm? -92.53 115.33 28.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.571 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.468 ' SG ' ' HB2' ' A' ' 61' ' ' ARG . 51.7 t -161.03 137.63 8.59 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.572 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -160.34 167.39 27.54 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.199 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 84.1 m -87.79 137.11 31.95 Favored Pre-proline 0 CA--C 1.531 0.229 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.83 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -84.21 141.24 9.1 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 122.496 2.131 . . . . 0.0 112.902 -179.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.98 1.03 1.06 Allowed 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.05 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.02 37.92 64.07 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.32 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 37.1 mt . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.145 -179.951 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.463 0.219 0 CA-C-O 120.719 0.295 . . . . 0.0 111.738 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.6 p -95.34 115.5 27.52 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 178.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.46 -154.81 22.05 Favored Glycine 0 N--CA 1.436 -1.334 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.772 -177.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.463 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.6 tm? -66.32 -40.8 90.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.169 -0.515 . . . . 0.0 110.896 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.781 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -76.04 -37.84 57.86 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.495 0.664 . . . . 0.0 111.117 -179.055 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.87 -8.23 0.02 OUTLIER Glycine 0 CA--C 1.525 0.665 0 CA-C-N 114.733 -1.121 . . . . 0.0 114.8 177.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.536 HG22 ' HG2' ' A' ' 22' ' ' GLN . 23.3 m -108.72 142.98 38.44 Favored 'General case' 0 N--CA 1.457 -0.087 0 CA-C-N 118.016 0.908 . . . . 0.0 112.194 -178.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.445 ' O ' ' HG3' ' A' ' 39' ' ' PRO . . . -107.9 101.72 10.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.038 179.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.536 ' HG2' HG22 ' A' ' 20' ' ' THR . 27.8 mm-40 -126.33 -179.28 4.67 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 121.137 0.494 . . . . 0.0 111.505 -179.12 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.596 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 77.4 m -133.86 117.44 16.82 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.84 179.347 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.08 -179.04 5.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.843 0.354 . . . . 0.0 111.083 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.476 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -111.32 165.66 11.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.815 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.1 t -129.77 157.08 43.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.8 -179.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.07 -170.18 2.9 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.092 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.556 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.4 m -61.76 -45.97 97.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.672 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.556 ' HG ' HG23 ' A' ' 28' ' ' VAL . 30.3 mt -77.5 -20.08 54.87 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.59 -13.22 32.82 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.561 -0.828 . . . . 0.0 113.424 179.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.412 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 22.5 t -101.16 107.83 22.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 117.255 0.527 . . . . 0.0 110.957 179.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.412 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 174.46 154.36 0.13 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.177 179.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -123.55 59.54 1.11 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.76 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.476 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 3.3 mt -81.46 135.64 35.63 Favored 'General case' 0 C--O 1.227 -0.108 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.849 -178.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.0 t70 51.0 83.23 0.05 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.78 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.6 m -109.28 132.09 54.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.379 179.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.07 -177.1 6.31 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.892 0.377 . . . . 0.0 111.647 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -77.7 138.14 62.54 Favored Pre-proline 0 CA--C 1.532 0.27 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.357 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.596 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 62.6 Cg_endo -90.72 110.75 0.37 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.021 2.481 . . . . 0.0 112.993 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -91.5 113.69 0.37 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.002 1.802 . . . . 0.0 112.032 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.14 -178.38 1.19 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.985 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.2 m -110.53 88.68 2.83 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.3 mt -63.52 122.08 15.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.274 -178.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.507 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.36 -33.4 3.88 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.753 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.475 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.1 p30 -162.88 -178.05 5.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.073 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.62 -61.51 2.15 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.102 -179.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 34.2 m -60.81 -35.93 77.75 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.956 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.507 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.7 t60 -62.19 -32.93 73.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.016 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.493 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 29.3 t80 -71.08 -39.97 71.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.142 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -61.39 -35.63 78.05 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.219 0.533 . . . . 0.0 109.735 178.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.2 m -67.71 -24.0 65.34 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.195 179.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 51.6 m -65.03 -45.66 84.54 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.439 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.547 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 38.3 m -81.73 -26.17 34.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.14 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.27 -20.2 59.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.452 0.644 . . . . 0.0 110.151 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.59 -36.88 85.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.062 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.5 pt -107.48 14.2 8.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -179.064 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.34 41.9 8.22 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.421 -0.895 . . . . 0.0 113.546 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -143.71 -178.81 6.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 117.034 0.417 . . . . 0.0 111.074 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.449 ' HD3' HH21 ' A' ' 61' ' ' ARG . 99.2 mtt180 -122.99 151.59 41.7 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.406 -179.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.547 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -66.91 120.05 12.94 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.326 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.449 HH21 ' HD3' ' A' ' 59' ' ' ARG . 13.9 mmt180 -138.9 125.74 20.96 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.964 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 22.4 m -100.03 99.94 10.74 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.401 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 4.0 m -104.07 141.11 36.79 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -177.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.781 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.4 OUTLIER -97.77 144.11 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.181 179.255 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.1 mt -53.25 135.08 50.92 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.753 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -66.82 141.06 57.79 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.545 2.163 . . . . 0.0 112.74 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.443 ' O ' ' C ' ' A' ' 68' ' ' LEU . 1.8 mp -112.68 102.99 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.443 ' C ' ' O ' ' A' ' 67' ' ' ILE . 0.3 OUTLIER -30.32 108.67 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.928 0.394 . . . . 0.0 111.206 -179.675 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 121.78 -8.89 9.93 Favored Glycine 0 C--N 1.333 0.395 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.374 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -135.67 170.21 16.33 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.516 0.674 . . . . 0.0 111.339 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -85.9 169.9 12.85 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.33 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.3 tt -83.28 126.66 40.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.076 0.465 . . . . 0.0 111.024 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.561 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.9 mm? -98.43 119.78 37.72 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.113 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.438 ' SG ' ' HB3' ' A' ' 61' ' ' ARG . 41.8 t -161.56 137.81 8.11 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.47 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -160.81 170.74 20.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.82 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.9 m -89.88 137.25 28.4 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.826 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -86.8 142.77 6.84 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.693 2.262 . . . . 0.0 112.787 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 66.65 -1.32 1.34 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.92 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.18 36.52 63.85 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.452 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.1 mt . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.229 179.969 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.216 0 CA-C-O 120.887 0.375 . . . . 0.0 110.927 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.4 p -103.87 116.04 31.55 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 173.13 -154.89 21.59 Favored Glycine 0 N--CA 1.434 -1.443 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.743 -177.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.478 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.5 tm? -65.56 -40.63 93.02 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.31 -0.445 . . . . 0.0 110.96 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.783 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -77.43 -39.04 48.29 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.233 0.539 . . . . 0.0 111.645 -178.347 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.4 -12.91 0.01 OUTLIER Glycine 0 CA--C 1.528 0.87 0 N-CA-C 115.919 1.128 . . . . 0.0 115.919 176.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.426 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 25.6 m -110.73 129.11 55.92 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 118.78 1.29 . . . . 0.0 112.683 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.38 115.99 28.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.431 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.499 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 18.9 mm-40 -135.53 -178.24 5.03 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.03 0.443 . . . . 0.0 111.366 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.545 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 98.1 m -138.02 100.42 4.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.837 179.192 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 4.5 t -118.89 177.88 4.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.903 -179.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.423 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -104.08 166.94 10.09 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.8 -179.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.2 t -129.19 157.8 40.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.674 -179.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.417 ' H ' ' HB3' ' A' ' 32' ' ' ALA . 1.5 p-10 -77.64 -170.02 1.68 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.051 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.538 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.8 m -65.19 -44.67 95.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.516 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.538 ' HG ' HG23 ' A' ' 28' ' ' VAL . 31.3 mt -76.6 -19.36 57.93 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.88 -16.86 30.46 Favored Glycine 0 CA--C 1.521 0.465 0 C-N-CA 120.541 -0.838 . . . . 0.0 113.79 179.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 66.2 t -101.48 107.68 21.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 117.464 0.632 . . . . 0.0 111.074 179.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.417 ' HB3' ' H ' ' A' ' 27' ' ' ASP . . . 175.74 168.42 0.38 Allowed 'General case' 0 C--O 1.231 0.113 0 CA-C-O 121.091 0.472 . . . . 0.0 111.389 179.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -135.24 65.41 1.56 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.58 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.423 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.6 mt -87.57 132.23 34.13 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.119 -178.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.9 t70 51.17 84.75 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.562 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 86.8 m -108.12 129.72 55.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.121 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -148.17 -178.98 6.6 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.861 0.362 . . . . 0.0 111.433 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -73.79 137.94 76.76 Favored Pre-proline 0 CA--C 1.531 0.246 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.75 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.545 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 63.8 Cg_endo -90.88 109.73 0.34 Allowed 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 123.044 2.496 . . . . 0.0 112.609 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -91.01 113.73 0.4 Allowed 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 121.948 1.765 . . . . 0.0 112.387 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.27 177.27 1.9 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.887 178.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.1 m -106.99 88.11 2.66 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 177.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mt -61.8 122.71 16.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.252 -178.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.487 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.59 -31.72 4.22 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 116.232 -0.44 . . . . 0.0 112.074 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.472 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.0 p30 -166.24 -179.53 5.12 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.708 0.289 . . . . 0.0 111.337 -179.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.98 -59.17 4.14 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.026 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.6 m -60.26 -36.64 78.27 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.792 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.487 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.8 t60 -62.49 -33.81 75.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.861 179.295 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -69.05 -34.48 75.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.184 179.232 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -70.29 -24.06 62.97 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.626 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 29.5 t -85.43 -12.76 51.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.315 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 60.4 m -72.15 -44.17 63.52 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.756 0.312 . . . . 0.0 111.284 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.492 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 48.2 m -84.67 -25.48 28.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.069 -179.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.45 -20.06 57.42 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.471 0.653 . . . . 0.0 110.176 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.2 -36.53 82.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.946 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.5 pt -105.36 -4.5 9.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 112.951 0.722 . . . . 0.0 112.951 -178.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 103.98 39.59 2.46 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 120.272 -0.966 . . . . 0.0 114.133 178.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -143.94 -178.89 6.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 117.265 0.533 . . . . 0.0 111.069 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -114.95 149.77 36.79 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.327 -179.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.492 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -76.22 121.15 22.49 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.831 -179.24 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.499 HH21 ' HB2' ' A' ' 74' ' ' CYS . 11.9 ptm180 -146.08 125.62 13.26 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.692 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.648 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 10.6 t -88.95 118.16 28.47 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.539 -179.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.608 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 40.6 m -109.76 148.1 32.04 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -178.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.783 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -99.91 149.21 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 115.041 -0.982 . . . . 0.0 111.061 -179.556 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.422 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.1 mt -49.37 136.84 16.42 Favored Pre-proline 0 CA--C 1.531 0.228 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.422 -179.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 27.2 Cg_exo -63.18 133.36 40.42 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.562 2.175 . . . . 0.0 112.642 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.3 mm -129.38 106.8 14.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.664 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.748 HD22 ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -50.86 110.83 0.46 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 121.563 0.696 . . . . 0.0 111.529 -179.763 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.27 -15.58 5.79 Favored Glycine 0 C--N 1.335 0.51 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.548 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -132.37 168.3 18.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.441 0.639 . . . . 0.0 111.176 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -84.27 167.1 16.93 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.258 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.413 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.0 tt -83.14 125.03 40.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.001 0.429 . . . . 0.0 110.919 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.575 ' HB2' HG11 ' A' ' 64' ' ' VAL . 3.9 mm? -96.28 110.73 22.99 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.164 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.499 ' HB2' HH21 ' A' ' 61' ' ' ARG . 57.4 m -145.93 135.98 23.65 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.226 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -159.83 166.67 29.85 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.699 0.285 . . . . 0.0 110.851 179.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.2 m -91.89 135.99 26.75 Favored Pre-proline 0 CA--C 1.531 0.246 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.986 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -88.12 143.47 5.75 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.795 2.33 . . . . 0.0 112.817 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 64.94 4.05 2.32 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.853 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.35 33.69 68.51 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.351 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 47.4 mt . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.183 -0.913 . . . . 0.0 111.078 179.981 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.449 ' SG ' ' N ' ' A' ' 15' ' ' SER . 3.4 p . . . . . 0 CA--C 1.517 -0.302 0 CA-C-O 121.2 0.524 . . . . 0.0 111.101 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.583 ' O ' ' O ' ' A' ' 16' ' ' GLY . 4.2 m -113.3 -157.85 0.63 Allowed 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -178.505 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.583 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -19.49 -149.69 0.0 OUTLIER Glycine 0 CA--C 1.531 1.079 0 N-CA-C 119.086 2.394 . . . . 0.0 119.086 -179.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.507 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -22.79 -41.09 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 115.757 1.762 . . . . 0.0 115.757 -177.252 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.705 ' HB2' ' SG ' ' A' ' 62' ' ' CYS . 2.8 m-85 -68.59 -36.67 79.03 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 118.679 0.672 . . . . 0.0 111.485 -177.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.3 -20.33 0.01 OUTLIER Glycine 0 CA--C 1.533 1.204 0 N-CA-C 117.981 1.952 . . . . 0.0 117.981 175.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.481 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 76.9 m -130.04 120.58 24.93 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 120.064 1.932 . . . . 0.0 113.539 -177.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.13 120.58 15.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.291 -179.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.44 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 20.4 mm-40 -138.46 -175.39 4.11 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.89 0.376 . . . . 0.0 110.781 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.8 t -145.91 134.04 21.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.608 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.7 m -148.38 162.26 39.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.015 0.436 . . . . 0.0 111.392 -179.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -96.32 170.35 9.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.297 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.1 t -130.59 157.94 41.34 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.709 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -82.09 -169.96 2.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.212 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.549 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.6 m -63.02 -43.5 99.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.623 -179.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.549 ' HG ' HG23 ' A' ' 28' ' ' VAL . 29.4 mt -78.37 -19.92 52.37 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.77 -14.54 31.99 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.395 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.405 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 51.6 t -101.71 107.94 22.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 117.239 0.52 . . . . 0.0 111.127 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 176.4 145.38 0.09 Allowed 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.283 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -116.62 60.96 0.73 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.758 179.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.8 mt -84.91 153.23 22.99 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.577 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.1 t70 41.37 79.74 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.785 178.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 54.4 m -109.31 131.45 55.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.71 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -162.45 -174.8 4.18 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.931 0.395 . . . . 0.0 111.369 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.566 ' H ' HD22 ' A' ' 38' ' ' ASN . 0.1 OUTLIER -78.99 133.05 62.0 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.883 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 22' ' ' GLN . 92.5 Cg_endo -85.27 117.88 1.89 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.665 2.244 . . . . 0.0 111.78 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -91.1 114.34 0.41 Allowed 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 122.229 1.953 . . . . 0.0 113.036 -179.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.447 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.62 178.02 1.65 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.915 178.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 31.7 m -106.86 88.42 2.74 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mt -63.95 124.3 21.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.59 -178.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.1 -40.52 2.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.855 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -151.91 -167.34 2.75 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.997 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.16 -45.29 77.46 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.364 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 42.4 m -67.83 -40.98 83.69 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.497 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -61.15 -32.7 72.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.549 179.115 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -68.82 -37.32 79.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.167 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -67.1 -27.45 67.36 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.526 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.6 t -82.37 -13.85 56.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.936 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.447 HG23 ' CB ' ' A' ' 41' ' ' ALA . 42.8 m -69.91 -40.07 75.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.91 0.386 . . . . 0.0 111.176 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 12.2 m -88.58 -29.31 20.11 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.293 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.31 -19.95 62.26 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.706 0.765 . . . . 0.0 109.579 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.12 -38.02 89.34 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.884 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.7 pt -103.13 -1.35 9.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -179.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.4 44.1 3.3 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 120.331 -0.938 . . . . 0.0 113.519 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -146.03 -172.98 4.04 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 117.227 0.514 . . . . 0.0 111.089 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 19.3 ptt180 -119.37 141.89 48.65 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 -178.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -72.05 123.24 22.4 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.213 -179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.484 HH21 ' HB2' ' A' ' 74' ' ' CYS . 14.2 ptm180 -158.55 126.15 5.06 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.337 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.705 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 18.7 t -85.43 145.36 27.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.404 -179.268 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 21.6 m -125.5 147.38 49.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.327 0.584 . . . . 0.0 111.723 -179.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.638 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -101.52 147.4 8.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.251 179.79 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.46 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 7.9 mt -49.32 133.12 17.41 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.29 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 23.9 Cg_exo -63.65 139.05 67.56 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.622 2.214 . . . . 0.0 112.521 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.429 HD13 ' O ' ' A' ' 66' ' ' PRO . 46.0 mm -131.6 110.42 17.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.394 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.81 109.49 0.29 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.878 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.84 -13.74 5.8 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.588 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -133.39 167.65 20.03 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.473 0.654 . . . . 0.0 111.31 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -83.53 168.56 16.32 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.77 -1.104 . . . . 0.0 110.181 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.439 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.8 tt -83.32 125.56 40.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.867 0.365 . . . . 0.0 110.615 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.524 ' HB2' HG11 ' A' ' 64' ' ' VAL . 3.9 mm? -98.28 105.85 18.05 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.83 0.348 . . . . 0.0 111.328 -179.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.484 ' HB2' HH21 ' A' ' 61' ' ' ARG . 48.5 m -146.89 133.63 20.0 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.099 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -161.03 166.76 27.66 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-O 120.823 0.344 . . . . 0.0 110.825 179.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.2 m -80.34 137.38 52.33 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.803 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -89.86 142.69 4.03 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.797 2.331 . . . . 0.0 112.757 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.23 4.47 1.64 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.613 179.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.46 36.7 58.99 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.537 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.6 mt . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.875 179.94 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 21' ' ' ALA . 51.3 t . . . . . 0 N--CA 1.473 0.687 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.1 p -96.22 115.81 28.01 Favored 'General case' 0 C--O 1.232 0.147 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 170.94 -166.56 39.74 Favored Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 120.582 -0.818 . . . . 0.0 113.26 -177.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.518 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.8 tm? -60.06 -37.51 80.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.823 -0.688 . . . . 0.0 110.27 177.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.77 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -79.43 -36.07 39.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.565 -178.653 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 59.02 -11.7 0.02 OUTLIER Glycine 0 CA--C 1.525 0.698 0 N-CA-C 115.507 0.963 . . . . 0.0 115.507 177.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.545 HG22 ' HG2' ' A' ' 22' ' ' GLN . 28.0 m -119.15 120.59 37.56 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 118.602 1.201 . . . . 0.0 112.38 -178.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.512 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . . . -86.77 107.2 18.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.313 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.545 ' HG2' HG22 ' A' ' 20' ' ' THR . 29.7 mm-40 -126.14 -169.45 2.02 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.092 0.472 . . . . 0.0 111.724 -178.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 4.4 t -143.67 138.04 28.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.747 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.8 t -157.15 173.47 16.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.932 0.396 . . . . 0.0 111.215 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.98 166.23 11.54 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.691 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.6 t -125.67 156.99 38.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.681 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -84.76 -169.81 2.82 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.194 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.548 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.6 m -61.42 -44.81 99.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.557 -179.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.548 ' HG ' HG23 ' A' ' 28' ' ' VAL . 27.0 mt -79.74 -20.27 46.77 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.037 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.35 -15.42 32.72 Favored Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.596 -0.812 . . . . 0.0 113.485 179.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 31.0 t -101.77 108.1 22.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 117.241 0.52 . . . . 0.0 111.124 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 179.52 168.0 1.11 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.044 0.45 . . . . 0.0 111.451 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -132.84 64.21 1.62 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.609 179.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -91.51 131.33 37.03 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.526 -178.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 52.14 83.23 0.06 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.956 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 56.4 m -108.08 131.9 54.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.338 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -153.65 -178.03 6.76 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.879 0.371 . . . . 0.0 111.29 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -77.96 140.51 62.38 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.633 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -90.72 111.17 0.38 Allowed 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.953 2.436 . . . . 0.0 111.909 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -90.71 113.78 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 121.903 1.736 . . . . 0.0 112.866 -179.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.439 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.99 -178.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.651 178.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.8 m -107.01 88.28 2.7 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.4 mt -62.51 122.85 16.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.482 -178.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.486 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.77 -33.62 3.75 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.764 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.465 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 6.9 p30 -163.48 -179.16 6.3 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.134 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.08 -60.03 3.33 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.289 -0.414 . . . . 0.0 112.025 -179.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 23.2 m -60.11 -37.78 81.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.756 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . 0.486 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.6 t60 -61.27 -33.11 73.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.904 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.411 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 18.3 t80 -68.78 -33.6 74.14 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.042 179.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -69.29 -41.58 76.6 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.025 178.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.1 m -64.36 -17.47 63.75 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.237 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.439 HG23 ' CB ' ' A' ' 41' ' ' ALA . 50.8 m -71.37 -42.1 68.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.443 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 23.0 m -84.59 -30.43 25.01 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.657 -179.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.83 -19.71 63.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.635 0.731 . . . . 0.0 109.631 -179.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -68.56 -39.72 80.92 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.286 -179.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 23.4 pt -100.57 1.41 10.51 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.24 39.56 5.67 Favored Glycine 0 CA--C 1.522 0.516 0 C-N-CA 120.294 -0.955 . . . . 0.0 113.443 179.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -145.96 -174.13 4.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.814 0.307 . . . . 0.0 110.807 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 23.9 mtm180 -119.73 156.45 30.53 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.89 0.376 . . . . 0.0 111.184 -179.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.411 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -85.49 122.87 30.25 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.645 -179.064 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -144.14 129.67 19.04 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.947 0.404 . . . . 0.0 110.546 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.689 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.9 t -98.5 109.67 22.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.732 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.539 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 91.9 m -101.07 145.75 28.34 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.308 0.575 . . . . 0.0 112.493 -178.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.77 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -95.25 148.42 5.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.495 179.704 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.431 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.5 mt -49.24 140.64 12.38 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.398 -179.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.501 ' O ' HD13 ' A' ' 67' ' ' ILE . 34.1 Cg_exo -59.79 139.65 89.47 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.734 2.289 . . . . 0.0 112.327 -179.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.501 HD13 ' O ' ' A' ' 66' ' ' PRO . 30.2 mm -131.95 110.12 16.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.476 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.48 111.89 0.8 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.092 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 122.65 -2.96 10.17 Favored Glycine 0 C--N 1.335 0.485 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.089 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -149.7 165.42 32.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.269 0.557 . . . . 0.0 111.163 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -78.87 169.85 17.59 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.577 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.406 HG23 ' O ' ' A' ' 72' ' ' ILE . 17.2 tt -82.85 121.69 36.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.152 0.501 . . . . 0.0 110.613 179.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.537 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.7 mm? -90.49 124.64 35.16 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.466 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -160.27 135.84 8.22 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.217 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -159.51 162.37 35.48 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.741 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 53.1 m -82.82 136.31 44.74 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.862 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -85.74 140.88 7.26 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.577 2.184 . . . . 0.0 112.653 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.12 3.69 1.36 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.664 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.94 38.04 60.31 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.485 179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 35.6 mt . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.232 -0.889 . . . . 0.0 111.049 179.992 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 23.1 p . . . . . 0 N--CA 1.466 0.33 0 CA-C-O 121.119 0.485 . . . . 0.0 112.241 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.0 p -95.32 117.96 31.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.27 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.25 -166.79 39.65 Favored Glycine 0 N--CA 1.441 -1.031 0 C-N-CA 120.551 -0.833 . . . . 0.0 113.161 -177.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.523 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.7 tm? -56.86 -37.21 70.99 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.764 -0.718 . . . . 0.0 110.591 177.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.746 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -80.91 -38.9 27.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.404 0.621 . . . . 0.0 111.375 -178.551 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.72 -8.18 0.01 OUTLIER Glycine 0 CA--C 1.527 0.805 0 CA-C-N 114.671 -1.149 . . . . 0.0 115.739 176.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.541 HG22 ' HG2' ' A' ' 22' ' ' GLN . 18.1 m -115.69 126.12 53.7 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 118.658 1.229 . . . . 0.0 112.996 -178.024 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -87.43 104.89 16.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.087 179.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.541 ' HG2' HG22 ' A' ' 20' ' ' THR . 29.4 mm-40 -128.25 -169.41 2.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.126 0.488 . . . . 0.0 111.69 -178.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.9 t -139.68 140.73 36.94 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.974 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -161.86 155.86 21.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.085 0.469 . . . . 0.0 111.285 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.521 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -79.5 166.46 21.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.594 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.0 t -134.74 158.21 44.72 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.426 ' HB3' ' HB2' ' A' ' 32' ' ' ALA . 1.6 p-10 -77.33 -168.89 1.23 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.007 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.588 HG23 ' HG ' ' A' ' 29' ' ' LEU . 11.0 m -65.24 -44.67 95.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.632 -179.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.588 ' HG ' HG23 ' A' ' 28' ' ' VAL . 29.1 mt -78.16 -19.29 54.28 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -178.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.77 -15.44 31.62 Favored Glycine 0 CA--C 1.521 0.416 0 C-N-CA 120.541 -0.838 . . . . 0.0 113.697 179.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.5 t -101.68 108.14 23.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 117.302 0.551 . . . . 0.0 111.181 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.426 ' HB2' ' HB3' ' A' ' 27' ' ' ASP . . . 179.51 171.33 1.0 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.124 0.488 . . . . 0.0 111.322 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -139.41 93.45 2.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.769 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.521 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 1.7 mt -125.08 134.67 52.41 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.548 -178.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.3 t70 52.94 86.24 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.198 179.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 m -108.46 133.93 51.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.964 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -156.32 -178.09 7.07 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.937 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -83.31 138.21 42.06 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.541 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -90.1 114.56 0.54 Allowed 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.814 2.343 . . . . 0.0 111.928 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -90.44 114.0 0.48 Allowed 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 121.982 1.788 . . . . 0.0 112.783 -179.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.42 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.48 -179.28 1.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.532 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.6 m -108.2 88.12 2.66 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 177.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -61.41 123.18 17.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.284 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.64 -40.61 2.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.906 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -152.92 -168.36 3.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.045 179.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.501 ' HB1' ' HG ' ' A' ' 80' ' ' LEU . . . -64.94 -44.05 90.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.257 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 41.3 m -70.4 -41.94 72.31 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.798 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -60.49 -33.85 73.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.118 0.485 . . . . 0.0 109.856 179.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -69.27 -35.76 76.41 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.975 179.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -67.02 -32.12 73.13 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.216 179.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.5 t -76.2 -12.89 60.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.776 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.42 HG23 ' CB ' ' A' ' 41' ' ' ALA . 52.4 m -73.81 -40.93 63.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.075 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 7.4 m -86.16 -31.95 21.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.51 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.8 -19.93 63.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.659 0.742 . . . . 0.0 109.825 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.03 -39.22 93.04 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.925 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.4 pt -103.34 0.79 10.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -179.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.18 43.13 3.09 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.318 -0.944 . . . . 0.0 113.58 178.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -150.63 -175.03 4.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 117.097 0.448 . . . . 0.0 110.995 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -120.66 153.99 36.12 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.976 0.417 . . . . 0.0 111.122 -179.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.59 126.2 30.56 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.241 -179.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -149.64 155.41 40.2 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.044 0.45 . . . . 0.0 110.925 179.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.626 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 33.6 t -121.44 104.76 9.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.18 -179.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . 0.543 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 5.0 m -109.95 145.0 37.65 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.197 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.746 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.3 OUTLIER -90.81 146.02 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.742 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.463 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.5 mt -49.95 138.65 18.38 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.451 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 27.3 Cg_exo -62.65 138.53 70.29 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.589 2.193 . . . . 0.0 112.556 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.41 HD13 ' O ' ' A' ' 66' ' ' PRO . 50.3 mm -130.82 108.4 15.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.658 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.65 109.98 0.33 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.266 -179.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.14 -12.46 6.42 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.643 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -136.95 168.9 18.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.416 0.627 . . . . 0.0 111.25 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -82.22 166.82 19.26 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.113 179.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.6 tt -83.44 124.49 39.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 121.065 0.459 . . . . 0.0 110.995 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.619 ' O ' HG12 ' A' ' 64' ' ' VAL . 4.0 mm? -98.94 113.7 25.98 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.705 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 43.6 t -161.55 138.67 8.65 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.623 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -159.93 163.3 34.34 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.95 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.3 m -90.2 126.62 56.29 Favored Pre-proline 0 CA--C 1.531 0.218 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.182 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -53.57 108.89 0.3 Allowed 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.679 2.252 . . . . 0.0 113.178 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.82 34.06 18.39 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.55 179.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 62.49 20.95 61.92 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.924 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.685 ' O ' HD13 ' A' ' 80' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.775 -0.631 . . . . 0.0 111.063 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.517 -0.299 0 CA-C-O 121.318 0.58 . . . . 0.0 111.946 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.585 ' O ' ' O ' ' A' ' 16' ' ' GLY . 14.0 m -133.36 -157.57 0.82 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.711 -179.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . 0.585 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -19.42 -149.78 0.0 OUTLIER Glycine 0 CA--C 1.532 1.096 0 N-CA-C 119.084 2.394 . . . . 0.0 119.084 -179.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.2 tm? -23.21 -43.13 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -177.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.726 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 3.7 m-85 -68.55 -35.92 78.08 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.207 -0.597 . . . . 0.0 112.208 -176.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.31 -10.98 0.01 OUTLIER Glycine 0 CA--C 1.527 0.816 0 N-CA-C 115.554 0.982 . . . . 0.0 115.554 176.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.425 ' H ' ' C ' ' A' ' 18' ' ' TYR . 32.5 m -125.13 145.9 49.73 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 118.591 1.196 . . . . 0.0 112.162 -178.163 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -111.73 109.15 18.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.794 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.597 ' HA ' HE21 ' A' ' 22' ' ' GLN . 0.1 OUTLIER -129.07 -172.03 2.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.153 0.501 . . . . 0.0 111.673 -178.787 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 36' ' ' CYS . 2.1 t -135.93 105.59 6.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.79 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.458 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 2.3 m -126.76 151.8 47.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.964 0.411 . . . . 0.0 111.712 -178.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -89.32 166.37 13.8 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.046 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.9 t -121.76 157.21 31.51 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -179.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -86.18 -170.26 3.01 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.418 -179.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.553 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.4 m -61.1 -45.12 99.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.407 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.553 ' HG ' HG23 ' A' ' 28' ' ' VAL . 24.0 mt -79.9 -20.72 45.14 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.606 0.241 . . . . 0.0 111.446 -179.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.63 -18.07 32.65 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 120.674 -0.774 . . . . 0.0 113.7 179.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.427 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 39.5 t -101.96 107.72 22.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 117.497 0.649 . . . . 0.0 111.058 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.427 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 174.81 171.16 0.25 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.029 0.442 . . . . 0.0 111.401 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -133.15 85.71 2.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.585 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 mt -109.03 137.01 47.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.043 -178.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.6 t70 41.63 81.23 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.075 178.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.458 ' HB2' ' HB3' ' A' ' 24' ' ' CYS . 49.1 t -128.03 139.76 52.36 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.342 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -155.71 -173.19 4.43 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.243 -179.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -64.93 133.1 95.66 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.85 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . 0.479 ' HD3' HE21 ' A' ' 22' ' ' GLN . 90.7 Cg_endo -90.46 110.04 0.38 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.89 2.393 . . . . 0.0 111.922 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -90.75 115.13 0.47 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.24 1.96 . . . . 0.0 112.887 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.414 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.05 -179.14 1.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.784 178.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 34.9 m -105.87 88.52 2.83 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 177.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.15 123.18 19.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.449 -178.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.9 -40.64 2.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.826 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -151.49 -168.23 3.03 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.037 179.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.64 -49.8 71.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.415 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.8 m -65.17 -40.81 94.8 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.806 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -60.65 -32.34 71.51 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.814 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.49 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 18.5 t80 -69.37 -37.95 77.83 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.938 178.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.0 -41.19 97.57 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.954 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.4 m -64.44 -20.06 65.93 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.416 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.414 HG23 ' CB ' ' A' ' 41' ' ' ALA . 51.8 m -69.52 -39.18 77.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.534 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.401 ' HB3' ' C ' ' A' ' 58' ' ' GLN . 2.5 m -87.72 -32.6 19.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.816 -179.305 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.21 -19.37 63.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.674 0.749 . . . . 0.0 109.686 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.5 -39.11 88.51 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.399 -1.273 . . . . 0.0 112.446 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.9 pt -105.85 3.03 10.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.71 42.7 3.06 Favored Glycine 0 CA--C 1.523 0.563 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.784 178.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.401 ' C ' ' HB3' ' A' ' 53' ' ' CYS . 36.8 mt-30 -151.32 -174.56 4.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 117.041 0.421 . . . . 0.0 110.717 179.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.2 mtp180 -125.47 153.79 43.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.798 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.49 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -67.66 118.83 11.46 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.005 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -130.48 123.79 30.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.855 0.359 . . . . 0.0 110.52 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.678 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 3.4 t -96.31 107.68 20.07 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 57.8 m -105.78 151.03 24.98 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.538 0.685 . . . . 0.0 112.635 -178.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.726 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -105.3 150.33 8.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.483 179.569 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.484 HD12 ' HD2' ' A' ' 66' ' ' PRO . 1.2 tp -50.35 122.76 15.83 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.137 -179.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.484 ' HD2' HD12 ' A' ' 65' ' ' LEU . 24.3 Cg_exo -65.31 139.53 60.28 Favored 'Trans proline' 0 C--N 1.355 0.921 0 C-N-CA 122.481 2.121 . . . . 0.0 112.516 -179.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.438 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 48.2 mm -131.38 112.63 21.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.486 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -46.93 108.91 0.16 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.792 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.94 -14.56 5.71 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.525 -179.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 3.2 pt20 -129.07 166.55 19.03 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.534 0.683 . . . . 0.0 111.265 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -82.49 162.21 22.13 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.225 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.408 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.0 tt -83.35 121.02 35.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.138 0.494 . . . . 0.0 111.004 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.52 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.9 mm? -95.13 107.92 20.01 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.959 -179.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.408 ' SG ' HG12 ' A' ' 72' ' ' ILE . 69.7 m -144.79 130.35 18.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.11 -179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -160.37 161.91 33.24 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.879 0.371 . . . . 0.0 110.86 179.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.5 m -85.97 135.24 37.72 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.163 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -86.04 142.42 7.59 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.736 2.29 . . . . 0.0 112.644 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 65.17 1.54 1.58 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.842 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.14 36.57 64.0 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.405 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.7 mt . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.253 -0.879 . . . . 0.0 111.012 179.801 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.533 0.206 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -59.12 123.78 14.21 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.681 2.254 . . . . 0.0 112.407 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.632 ' HB1' ' HG2' ' A' ' 6' ' ' GLU . . . -88.63 82.11 6.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.857 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.533 ' HA ' ' CZ ' ' A' ' 7' ' ' ARG . . . -118.83 -10.95 9.83 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.376 -179.613 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 16.2 ttm -112.97 -24.17 9.66 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.673 0.749 . . . . 0.0 109.413 -179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.819 ' HG3' ' HG3' ' A' ' 7' ' ' ARG . 0.3 OUTLIER -55.11 -26.93 41.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.223 179.94 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.819 ' HG3' ' HG3' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -105.48 82.34 1.8 Allowed 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 122.1 0.952 . . . . 0.0 110.49 -179.437 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -55.63 150.28 12.64 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 113.547 -1.66 . . . . 0.0 110.768 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.556 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -93.55 154.0 41.23 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.96 -179.922 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.556 ' HD2' HG22 ' A' ' 9' ' ' VAL . 82.2 Cg_exo -43.95 129.26 7.59 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.944 2.43 . . . . 0.0 112.727 179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -56.21 151.07 13.14 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.975 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 55.4 m -111.79 97.3 36.99 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.338 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.426 ' O ' ' C ' ' A' ' 14' ' ' CYS . 60.1 Cg_exo -53.29 177.02 0.07 OUTLIER 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.743 2.296 . . . . 0.0 112.963 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.426 ' C ' ' O ' ' A' ' 13' ' ' PRO . 0.5 OUTLIER -27.27 109.47 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.859 179.91 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 80.0 p -95.08 115.83 27.93 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.07 -154.63 22.02 Favored Glycine 0 N--CA 1.436 -1.314 0 CA-C-N 115.792 -0.64 . . . . 0.0 112.733 -177.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.478 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.5 tm? -65.58 -40.49 92.78 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.327 -0.436 . . . . 0.0 110.783 177.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.764 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -76.54 -36.96 57.38 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.442 0.639 . . . . 0.0 111.595 -178.804 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.64 -8.92 0.02 OUTLIER Glycine 0 CA--C 1.525 0.671 0 CA-C-N 114.763 -1.108 . . . . 0.0 114.794 177.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.423 ' H ' ' C ' ' A' ' 18' ' ' TYR . 7.6 m -112.61 154.59 25.79 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 118.174 0.987 . . . . 0.0 111.929 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -120.88 107.57 12.86 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.256 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.507 ' HA ' ' HG3' ' A' ' 39' ' ' PRO . 0.0 OUTLIER -137.71 -169.86 2.63 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 112.375 0.509 . . . . 0.0 112.375 -179.195 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.516 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 60.1 m -134.28 119.84 19.22 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.501 -179.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.495 ' HB3' ' HD3' ' A' ' 61' ' ' ARG . 1.1 t -128.43 -179.8 5.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.958 0.408 . . . . 0.0 110.927 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.508 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -115.2 164.71 13.82 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.873 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.7 t -130.46 157.68 41.99 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.512 -179.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.407 ' H ' ' HB3' ' A' ' 32' ' ' ALA . 0.8 OUTLIER -80.56 -170.67 2.7 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.545 -179.194 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.529 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.7 m -62.63 -47.0 95.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.721 -179.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.529 ' HG ' HG23 ' A' ' 28' ' ' VAL . 32.5 mt -76.2 -19.68 58.18 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.39 -13.39 33.31 Favored Glycine 0 CA--C 1.52 0.394 0 C-N-CA 120.702 -0.761 . . . . 0.0 113.451 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.602 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.6 p -100.36 108.18 22.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 117.156 0.478 . . . . 0.0 111.103 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.542 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 172.58 161.27 0.12 Allowed 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.637 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -131.24 63.07 1.61 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.632 179.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.508 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 3.8 mt -82.59 135.54 35.04 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.83 -178.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.1 t70 50.37 81.62 0.06 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.679 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -109.34 129.56 55.52 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.461 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -166.25 172.64 10.93 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.102 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.9 m-80 -66.52 145.2 98.93 Favored Pre-proline 0 C--N 1.33 -0.251 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.444 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.516 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 57.1 Cg_endo -91.19 121.37 0.69 Allowed 'Trans proline' 0 N--CA 1.459 -0.529 0 C-N-CA 122.864 2.376 . . . . 0.0 112.657 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -90.7 112.11 0.4 Allowed 'Trans proline' 0 N--CA 1.455 -0.768 0 C-N-CA 121.684 1.589 . . . . 0.0 112.025 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -176.63 -175.83 0.67 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.748 179.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 36.5 m -109.05 88.27 2.69 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -64.35 123.98 20.57 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.555 -178.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.474 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.6 -33.35 3.84 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.955 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.465 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 6.9 p30 -163.86 -179.5 6.35 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.099 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.59 -58.46 6.27 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -179.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.4 m -60.3 -35.79 76.39 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.804 -179.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.474 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.9 t60 -62.43 -34.5 76.9 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.981 179.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.409 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 25.7 t80 -70.15 -35.96 74.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.394 179.181 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -67.01 -31.23 71.64 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.063 0.458 . . . . 0.0 110.138 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.8 t -76.59 -17.74 59.03 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.389 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 60.0 m -73.35 -42.5 62.18 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.988 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.4 m -80.79 -26.77 36.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.223 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.22 -20.1 55.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.437 0.637 . . . . 0.0 110.302 -179.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -61.88 -36.08 80.23 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.923 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.4 pt -108.96 11.42 8.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 84.3 41.6 7.87 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.489 -0.862 . . . . 0.0 113.393 178.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.0 mt-30 -140.95 177.93 7.71 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.855 0.327 . . . . 0.0 110.878 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 24.4 mtp180 -117.2 162.95 17.04 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.878 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.409 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -85.98 118.42 25.45 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.746 -179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.593 HH21 ' HB3' ' A' ' 74' ' ' CYS . 12.9 ptm180 -147.55 125.74 12.2 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.164 0.507 . . . . 0.0 110.211 179.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.472 ' HB2' ' CD2' ' A' ' 18' ' ' TYR . 5.5 m -85.88 106.22 16.93 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.261 -178.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.415 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 65.2 m -98.0 142.61 29.51 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.229 0.538 . . . . 0.0 111.904 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.764 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -93.83 144.3 9.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.444 179.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.448 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.5 mt -49.43 137.14 16.59 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.535 -178.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 37.9 Cg_exo -61.42 138.13 74.38 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.71 2.273 . . . . 0.0 112.617 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 51.3 mm -130.3 108.17 15.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.375 179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.65 109.36 0.31 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.12 -179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.68 -13.68 5.84 Favored Glycine 0 C--N 1.333 0.38 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.773 179.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -135.16 168.48 19.08 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 121.451 0.643 . . . . 0.0 111.161 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -81.29 169.3 17.46 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.294 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 20.2 tt -84.09 132.27 31.94 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-O 120.813 0.34 . . . . 0.0 110.876 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.553 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.5 mm? -109.82 132.15 54.41 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-O 120.789 0.328 . . . . 0.0 110.622 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.593 ' HB3' HH21 ' A' ' 61' ' ' ARG . 0.5 OUTLIER -160.14 135.39 8.05 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.339 179.406 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -153.11 163.13 40.43 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.63 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.458 HG23 ' HD2' ' A' ' 77' ' ' PRO . 54.4 m -96.38 139.47 21.72 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.654 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.458 ' HD2' HG23 ' A' ' 76' ' ' THR . 64.1 Cg_endo -75.49 125.22 8.86 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.28 1.987 . . . . 0.0 113.144 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 57.19 23.83 9.09 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.801 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 63.62 33.76 88.12 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.66 -0.781 . . . . 0.0 111.559 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 7.6 tp . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.466 -0.778 . . . . 0.0 111.282 -179.552 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 77.9 p . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.583 0.23 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -56.45 108.4 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.682 2.255 . . . . 0.0 112.45 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.55 ' HB1' ' HB2' ' A' ' 6' ' ' GLU . . . -106.58 108.87 20.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.783 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -97.56 -50.6 4.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.587 -179.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 22.8 mmt -106.36 -1.76 22.96 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.399 -179.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.55 ' HB2' ' HB1' ' A' ' 3' ' ' ALA . 32.2 mt-10 -82.89 -71.29 0.5 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.737 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.96 120.24 10.88 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-O 120.99 0.424 . . . . 0.0 110.866 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -88.57 134.62 33.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.994 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.565 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.7 OUTLIER -92.87 154.42 41.97 Favored Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.951 -179.933 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.565 ' HD2' HG22 ' A' ' 9' ' ' VAL . 80.3 Cg_exo -46.38 128.67 12.62 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 123.01 2.473 . . . . 0.0 112.866 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -54.22 153.96 4.8 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.386 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 26.4 m -120.78 91.75 47.61 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.84 179.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.81 176.57 0.07 OUTLIER 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.744 2.296 . . . . 0.0 112.916 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -41.04 121.55 1.57 Allowed 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.675 -179.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 75.3 p -98.29 117.13 31.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.532 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 173.77 -155.22 21.56 Favored Glycine 0 N--CA 1.434 -1.47 0 C-N-CA 120.925 -0.655 . . . . 0.0 112.744 -178.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.496 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.4 tm? -66.75 -38.64 87.02 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.216 -0.492 . . . . 0.0 110.966 178.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.749 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -79.07 -39.24 34.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.833 -178.252 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.79 -11.5 0.01 OUTLIER Glycine 0 CA--C 1.528 0.855 0 CA-C-N 114.97 -1.014 . . . . 0.0 115.285 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.517 HG22 ' HG2' ' A' ' 22' ' ' GLN . 6.6 m -105.94 131.14 53.61 Favored 'General case' 0 N--CA 1.46 0.074 0 CA-C-N 118.383 1.091 . . . . 0.0 112.372 -178.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -100.98 99.53 10.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.544 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.517 ' HG2' HG22 ' A' ' 20' ' ' THR . 24.1 mm-40 -126.31 -174.57 3.15 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.88 0.371 . . . . 0.0 111.003 -179.34 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.585 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 58.3 m -135.51 107.76 7.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.298 179.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.14 151.56 51.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.886 0.374 . . . . 0.0 111.143 -179.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.41 169.65 16.72 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.593 -178.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.4 t -126.35 158.13 36.67 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.635 -179.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -76.87 -169.86 1.43 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.451 -179.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.543 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.6 m -65.74 -46.04 90.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.649 -0.705 . . . . 0.0 112.699 -179.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.543 ' HG ' HG23 ' A' ' 28' ' ' VAL . 30.6 mt -75.46 -19.8 59.22 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.661 0.245 . . . . 0.0 111.661 -178.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.82 -18.33 29.29 Favored Glycine 0 CA--C 1.521 0.464 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.765 179.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.41 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 46.8 t -101.51 107.81 22.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 117.603 0.702 . . . . 0.0 111.033 179.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 175.94 172.74 0.35 Allowed 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.049 179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -141.38 84.23 1.9 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.91 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.7 mt -104.38 134.95 46.72 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.682 -178.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 51.53 84.14 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.11 -0.495 . . . . 0.0 112.006 178.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.5 t -122.76 137.77 54.82 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.826 0.346 . . . . 0.0 111.005 179.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -159.76 -178.4 7.04 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -65.85 124.62 88.07 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.825 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.585 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 93.7 Cg_endo -85.84 122.17 2.23 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 122.506 2.137 . . . . 0.0 112.087 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -91.25 113.73 0.39 Allowed 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.113 1.875 . . . . 0.0 112.508 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.53 179.12 1.5 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 179.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 32.1 m -106.89 88.07 2.66 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.5 mt -63.36 121.2 13.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.411 -178.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.483 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.62 -34.46 3.59 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.71 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.47 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.1 p30 -162.77 -179.18 6.64 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.238 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.88 -59.84 3.7 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.937 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.6 m -60.27 -36.33 77.57 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.745 -179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.483 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.7 t60 -62.78 -32.44 73.61 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.947 179.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.533 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 13.8 t80 -71.34 -38.65 71.64 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.103 179.176 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -63.08 -31.86 73.1 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-O 121.058 0.456 . . . . 0.0 110.149 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 32.3 t -75.51 -13.38 60.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.958 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 74.2 m -78.06 -44.04 27.48 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.077 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.492 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 36.2 m -82.95 -26.94 30.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.986 -179.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.49 -20.18 58.92 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 121.501 0.667 . . . . 0.0 110.186 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.81 -37.24 86.95 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.744 -1.117 . . . . 0.0 112.077 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.0 pt -106.01 11.29 8.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -178.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.42 40.36 6.07 Favored Glycine 0 CA--C 1.522 0.492 0 C-N-CA 120.493 -0.861 . . . . 0.0 114.235 178.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -148.44 -178.1 6.13 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 117.263 0.531 . . . . 0.0 111.059 179.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 35.7 mtp180 -122.98 154.81 37.93 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.168 -179.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.533 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -69.57 119.91 14.55 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.689 -179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -139.6 125.3 19.44 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.563 179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.602 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 15.4 t -98.72 99.54 10.66 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 179.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.503 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 3.8 m -109.1 141.37 41.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.257 0.551 . . . . 0.0 112.33 -177.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.749 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.3 OUTLIER -87.48 144.12 9.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.457 179.873 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.4 mt -49.52 136.43 17.62 Favored Pre-proline 0 N--CA 1.462 0.165 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.359 -179.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 37.5 Cg_exo -61.1 133.92 49.81 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.497 2.132 . . . . 0.0 112.531 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.4 mm -128.17 106.14 14.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.6 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.18 110.98 0.38 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.18 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.49 -13.97 5.87 Favored Glycine 0 C--N 1.331 0.287 0 C-N-CA 120.87 -0.681 . . . . 0.0 112.464 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -138.18 166.86 23.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.41 0.624 . . . . 0.0 111.144 -179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -80.46 164.63 22.89 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.288 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.5 tt -83.43 125.2 40.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.05 0.452 . . . . 0.0 110.952 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.626 ' O ' HG12 ' A' ' 64' ' ' VAL . 4.0 mm? -100.66 115.73 30.92 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.9 -179.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 42.2 t -161.27 140.45 10.18 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.653 -0.419 . . . . 0.0 111.251 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -160.7 168.24 25.26 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.384 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 72.9 m -100.69 124.65 41.54 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.325 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -69.45 141.2 45.85 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.403 2.069 . . . . 0.0 112.72 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.47 -0.85 0.64 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.246 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.9 36.84 65.39 Favored Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.397 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 28.6 mt . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.191 -0.909 . . . . 0.0 111.193 179.849 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 55.6 m . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.625 0.25 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.26 116.24 3.1 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.706 2.271 . . . . 0.0 112.364 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.471 ' HB1' ' HB2' ' A' ' 6' ' ' GLU . . . -74.5 143.02 44.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.072 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -110.22 -37.1 5.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.53 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 7.7 ptp -107.26 -36.28 6.58 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.927 0.394 . . . . 0.0 110.865 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.471 ' HB2' ' HB1' ' A' ' 3' ' ' ALA . 22.9 mt-10 -56.92 -70.7 0.11 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.865 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.67 116.96 7.92 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 121.071 0.462 . . . . 0.0 110.886 179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -74.95 147.5 40.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.57 179.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.521 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.9 OUTLIER -90.19 152.79 46.33 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.984 -179.778 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.521 ' HD2' HG22 ' A' ' 9' ' ' VAL . 81.3 Cg_exo -42.89 133.42 5.68 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 123.003 2.469 . . . . 0.0 112.714 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -55.23 154.39 5.93 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.963 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 89.1 m -135.64 90.5 19.71 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.322 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -75.34 166.31 29.05 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.678 2.252 . . . . 0.0 111.962 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 11.1 t 51.32 -171.12 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.148 0.499 . . . . 0.0 111.173 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.624 ' O ' ' O ' ' A' ' 16' ' ' GLY . 87.6 p -134.18 -156.99 0.77 Allowed 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.392 -179.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.624 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -18.52 -147.71 0.0 OUTLIER Glycine 0 CA--C 1.532 1.146 0 N-CA-C 118.251 2.06 . . . . 0.0 118.251 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.481 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.8 OUTLIER -22.85 -42.07 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 115.402 1.63 . . . . 0.0 115.402 -177.675 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.577 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 5.7 m-85 -69.37 -36.46 76.84 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.275 -0.57 . . . . 0.0 112.264 -177.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.69 -14.43 0.01 OUTLIER Glycine 0 CA--C 1.531 1.034 0 N-CA-C 115.708 1.043 . . . . 0.0 115.708 177.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.434 ' H ' ' C ' ' A' ' 18' ' ' TYR . 23.3 m -129.54 153.92 47.55 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 118.576 1.188 . . . . 0.0 112.175 -178.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -115.31 114.97 25.88 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.976 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -132.63 -169.88 2.33 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.128 0.489 . . . . 0.0 111.646 -178.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.458 ' HB2' ' HB3' ' A' ' 39' ' ' PRO . 5.6 t -147.27 131.11 17.05 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.115 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.543 ' HB2' ' HD2' ' A' ' 61' ' ' ARG . 36.7 m -147.34 165.83 28.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.967 0.413 . . . . 0.0 111.498 -179.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.35 168.77 10.86 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.385 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.427 ' HB ' HH21 ' A' ' 59' ' ' ARG . 5.7 t -122.98 156.82 33.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.72 -179.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -85.0 -169.61 2.73 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.234 -179.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.584 HG23 ' HG ' ' A' ' 29' ' ' LEU . 8.2 m -60.93 -46.29 96.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.571 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.584 ' HG ' HG23 ' A' ' 28' ' ' VAL . 24.8 mt -80.21 -20.4 44.77 Favored 'General case' 0 C--N 1.332 -0.159 0 N-CA-C 111.636 0.235 . . . . 0.0 111.636 -179.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.32 -16.38 32.2 Favored Glycine 0 CA--C 1.522 0.509 0 C-N-CA 120.716 -0.754 . . . . 0.0 113.52 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 61.0 t -101.4 108.38 23.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 117.192 0.496 . . . . 0.0 111.178 179.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.35 167.41 0.81 Allowed 'General case' 0 N--CA 1.461 0.119 0 CA-C-O 120.967 0.413 . . . . 0.0 111.336 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -130.36 76.29 1.71 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.834 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 mt -102.95 143.21 32.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.976 -178.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 30.3 t70 45.52 83.48 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.946 178.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 52.0 m -109.66 130.28 55.53 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.211 179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -156.99 -176.18 5.84 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.053 -179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 p30 -79.33 133.32 60.46 Favored Pre-proline 0 CA--C 1.533 0.304 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.685 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.458 ' HB3' ' HB2' ' A' ' 23' ' ' CYS . 93.5 Cg_endo -89.07 119.97 1.03 Allowed 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 122.72 2.28 . . . . 0.0 111.931 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -91.27 114.34 0.4 Allowed 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.32 2.013 . . . . 0.0 113.105 -179.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.455 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.58 179.98 1.34 Allowed 'General case' 0 CA--C 1.521 -0.161 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.939 178.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.6 m -106.72 88.47 2.76 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 177.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.2 mt -62.47 121.56 13.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.277 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.506 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.55 -34.44 3.61 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.553 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.454 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.0 p30 -162.89 -177.91 5.79 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.103 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.88 -61.25 2.33 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.245 -0.434 . . . . 0.0 112.011 -179.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.7 m -59.55 -36.42 76.13 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.846 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.506 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.2 t60 -63.03 -33.33 75.19 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -67.73 -34.85 77.67 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.741 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -67.78 -42.3 81.87 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.055 178.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 57.0 m -63.26 -18.07 63.18 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.297 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.455 HG23 ' CB ' ' A' ' 41' ' ' ALA . 48.5 m -70.85 -40.68 72.21 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.486 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 32.6 m -86.66 -31.47 21.05 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.791 -179.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.53 -19.71 63.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.657 0.741 . . . . 0.0 109.542 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.49 -39.86 88.97 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 114.417 -1.265 . . . . 0.0 112.117 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 16.1 pt -101.41 1.25 10.48 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -179.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.43 40.66 5.34 Favored Glycine 0 CA--C 1.522 0.511 0 C-N-CA 120.282 -0.961 . . . . 0.0 113.289 179.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -143.41 -172.12 3.64 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.782 0.291 . . . . 0.0 110.826 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.427 HH21 ' HB ' ' A' ' 26' ' ' THR . 50.6 mtm180 -119.96 152.15 37.87 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.743 0.306 . . . . 0.0 111.119 -179.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -82.72 122.76 28.58 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.763 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.543 ' HD2' ' HB2' ' A' ' 24' ' ' CYS . 4.2 ptm180 -140.19 140.26 35.86 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-O 120.627 0.251 . . . . 0.0 110.564 -179.538 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -106.39 119.57 39.6 Favored 'General case' 0 N--CA 1.463 0.215 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 55.5 m -110.21 149.21 30.45 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 121.424 0.63 . . . . 0.0 112.254 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.577 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -101.39 149.3 6.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 114.982 -1.008 . . . . 0.0 110.543 179.725 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.2 mt -49.6 137.46 17.41 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.364 -179.523 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 33.1 Cg_exo -60.63 134.97 57.51 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.604 2.203 . . . . 0.0 112.801 -179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.457 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.8 mm -130.57 106.19 12.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.51 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.2 119.79 4.77 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.982 0.42 . . . . 0.0 111.278 -179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 118.94 -8.13 12.76 Favored Glycine 0 CA--C 1.518 0.229 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.826 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.457 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.9 pt20 -139.24 168.5 19.69 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.477 0.656 . . . . 0.0 111.218 -179.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -82.99 168.9 16.55 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.311 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.417 HG12 ' SG ' ' A' ' 74' ' ' CYS . 16.3 tt -83.4 124.81 39.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-O 120.922 0.391 . . . . 0.0 110.932 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.508 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.1 mm? -96.61 109.01 21.7 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.031 -179.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.417 ' SG ' HG12 ' A' ' 72' ' ' ILE . 64.2 m -144.76 131.96 20.57 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.122 -179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -160.27 167.51 27.38 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.766 0.317 . . . . 0.0 110.941 179.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 49.4 m -82.86 137.47 43.73 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.87 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -83.67 136.22 7.23 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 122.378 2.052 . . . . 0.0 112.684 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 64.34 3.48 1.85 Allowed 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.811 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.63 40.02 54.56 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.436 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.2 mt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.285 -0.864 . . . . 0.0 111.061 179.971 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.497 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 60.5 m . . . . . 0 N--CA 1.486 1.37 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' ' 1' ' ' SER . 17.2 Cg_endo -58.2 119.77 7.24 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 121.964 1.776 . . . . 0.0 112.386 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -129.71 91.7 3.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.945 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -94.62 -20.77 19.29 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.166 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 11.2 ptm -110.54 -35.42 6.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.14 0.495 . . . . 0.0 110.345 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -75.12 -164.87 0.34 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.842 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.715 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -49.82 119.75 3.77 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.002 0.43 . . . . 0.0 111.222 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.423 ' HA ' ' OE1' ' A' ' 8' ' ' GLN . 4.7 tp60 -57.2 150.14 18.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.877 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.527 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -101.76 154.5 37.26 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.267 -179.796 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.527 ' HD2' HG22 ' A' ' 9' ' ' VAL . 72.0 Cg_exo -46.57 130.02 14.46 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.902 2.401 . . . . 0.0 112.648 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -63.83 157.79 23.65 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.231 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 94.1 m -136.62 92.71 14.74 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.674 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -73.1 166.96 28.6 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.602 2.202 . . . . 0.0 112.248 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.1 t 47.92 -162.58 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.408 0.623 . . . . 0.0 111.664 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.596 ' O ' ' O ' ' A' ' 16' ' ' GLY . 10.6 m -129.11 -156.08 0.74 Allowed 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.136 -178.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.596 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -17.2 -147.7 0.0 OUTLIER Glycine 0 CA--C 1.533 1.182 0 N-CA-C 118.655 2.222 . . . . 0.0 118.655 -179.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.451 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.7 OUTLIER -22.15 -45.96 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.638 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -176.846 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.636 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 6.4 m-85 -69.26 -37.23 77.81 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 119.927 -0.709 . . . . 0.0 112.031 -177.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.92 -12.26 0.01 OUTLIER Glycine 0 CA--C 1.529 0.952 0 N-CA-C 116.545 1.378 . . . . 0.0 116.545 176.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.473 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 52.6 m -138.16 138.11 38.29 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 119.139 1.469 . . . . 0.0 112.839 -177.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -106.18 125.87 51.52 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.407 -179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.537 ' HA ' ' HG3' ' A' ' 39' ' ' PRO . 67.1 mm-40 -147.56 176.31 10.16 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.78 0.324 . . . . 0.0 111.525 -178.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.442 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 75.7 m -122.82 116.41 23.64 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.999 179.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.652 ' HB2' ' HD2' ' A' ' 61' ' ' ARG . 60.2 m -132.44 159.95 37.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.016 0.436 . . . . 0.0 111.431 -179.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.431 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -83.47 167.57 17.32 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.893 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 5.4 t -123.78 156.67 35.66 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.597 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -87.73 -170.59 3.07 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.339 -179.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.562 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.5 m -60.61 -44.88 97.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.428 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.562 ' HG ' HG23 ' A' ' 28' ' ' VAL . 24.0 mt -80.55 -20.47 43.36 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.701 0.286 . . . . 0.0 111.279 -179.278 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.69 -18.97 31.54 Favored Glycine 0 CA--C 1.522 0.52 0 C-N-CA 120.827 -0.701 . . . . 0.0 113.792 178.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 48.4 t -101.81 108.49 23.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 117.286 0.543 . . . . 0.0 111.255 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -179.68 168.34 1.37 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.048 0.451 . . . . 0.0 111.377 179.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -128.97 82.79 2.1 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.756 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.431 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.0 mt -110.48 137.35 48.3 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.017 -178.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 48.02 84.97 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.874 178.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 51.4 m -109.6 129.94 55.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.631 179.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -151.55 163.86 38.1 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.413 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.402 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 7.2 p30 -57.92 133.12 83.42 Favored Pre-proline 0 CA--C 1.533 0.302 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.473 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.537 ' HG3' ' HA ' ' A' ' 22' ' ' GLN . 97.5 Cg_endo -90.67 113.45 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.66 0 C-N-CA 122.87 2.38 . . . . 0.0 112.302 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -90.5 113.3 0.45 Allowed 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 121.919 1.746 . . . . 0.0 112.495 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.79 -178.42 1.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.632 178.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.6 m -110.17 88.37 2.74 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 177.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.8 mt -64.79 119.77 11.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.432 -178.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.41 ' H ' ' HB3' ' A' ' 48' ' ' HIS . . . -116.55 -40.69 3.17 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.761 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -152.82 -168.69 3.11 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.723 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.78 -39.37 94.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.993 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 46.6 m -71.04 -47.98 55.47 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.863 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.41 ' HB3' ' H ' ' A' ' 44' ' ' ALA . 2.1 t-160 -57.22 -31.22 65.27 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.081 0.467 . . . . 0.0 109.753 179.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -70.48 -39.56 74.15 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.077 179.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -62.99 -38.58 91.72 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-O 121.244 0.545 . . . . 0.0 109.912 178.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 56.9 m -68.29 -16.06 63.81 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.291 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 94.2 m -75.74 -43.31 47.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.549 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.436 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 68.5 m -85.88 -23.46 27.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.346 -179.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.83 -20.0 43.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.259 0.552 . . . . 0.0 110.467 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.22 -39.93 93.42 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.158 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.1 pt -100.4 9.39 8.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -178.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.54 42.95 5.65 Favored Glycine 0 CA--C 1.522 0.477 0 C-N-CA 120.415 -0.898 . . . . 0.0 114.108 178.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -146.21 -177.42 5.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.362 0.581 . . . . 0.0 111.081 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 49.1 mtm180 -116.99 151.56 36.48 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.991 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.436 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -80.99 122.24 27.05 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.665 -179.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.652 ' HD2' ' HB2' ' A' ' 24' ' ' CYS . 9.5 ptp180 -145.72 125.58 13.52 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.948 0.404 . . . . 0.0 110.135 179.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.582 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.0 t -92.41 107.36 19.15 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.785 -179.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 93.0 m -98.21 150.88 21.03 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 121.281 0.563 . . . . 0.0 111.842 -179.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.636 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -98.27 150.14 4.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.876 179.833 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.413 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.4 mt -49.32 138.07 15.18 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.371 -179.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.421 ' O ' HD13 ' A' ' 67' ' ' ILE . 29.4 Cg_exo -62.13 132.98 41.53 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 122.537 2.158 . . . . 0.0 112.581 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.496 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 49.8 mm -131.74 104.71 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.739 179.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.43 ' HA ' HD12 ' A' ' 68' ' ' LEU . 0.5 OUTLIER -50.71 121.08 5.35 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.266 -179.905 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 118.51 -11.19 12.57 Favored Glycine 0 CA--C 1.517 0.182 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.77 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 3.0 pt20 -135.33 167.41 21.07 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.484 0.659 . . . . 0.0 111.347 -179.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -81.65 167.64 18.98 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.493 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.4 tt -83.79 124.5 39.74 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 121.045 0.45 . . . . 0.0 110.927 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.543 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.5 mm? -101.2 128.47 47.3 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.293 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -160.72 132.57 5.88 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.28 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -151.61 166.11 32.22 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.847 0.356 . . . . 0.0 110.685 179.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 54.0 m -95.28 138.04 22.0 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.498 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -81.73 137.61 10.15 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.23 1.953 . . . . 0.0 112.756 -179.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.04 2.53 1.05 Allowed 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.928 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.47 38.64 61.99 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.285 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 28.6 mt . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.201 -0.904 . . . . 0.0 111.187 -179.919 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.8 t . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.539 0.209 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -42.68 129.91 5.27 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 122.932 2.422 . . . . 0.0 112.714 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -111.36 82.6 1.63 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.921 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -106.29 -53.87 2.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.41 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 26.1 ttp -112.9 -8.59 13.69 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 122.091 0.948 . . . . 0.0 108.766 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.607 ' N ' ' CD ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -67.84 -156.81 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.908 -178.871 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.646 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.2 OUTLIER -46.41 121.63 3.54 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 121.106 0.479 . . . . 0.0 111.022 179.846 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -55.97 148.24 17.81 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.843 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.548 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -94.65 153.75 40.14 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.97 -179.645 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.548 ' HD2' HG22 ' A' ' 9' ' ' VAL . 86.4 Cg_exo -44.18 125.0 5.33 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.937 2.425 . . . . 0.0 112.906 179.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -57.01 136.93 56.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.91 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 84.9 m -160.06 97.45 1.5 Allowed Pre-proline 0 C--N 1.331 -0.23 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.184 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.458 ' O ' ' C ' ' A' ' 14' ' ' CYS . 41.5 Cg_endo -80.59 163.91 21.25 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.805 2.337 . . . . 0.0 112.521 179.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.458 ' C ' ' O ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER 13.63 108.65 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.07 0 O-C-N 124.41 1.068 . . . . 0.0 112.507 -179.874 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.1 m -94.42 116.7 29.1 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.2 -167.25 40.19 Favored Glycine 0 N--CA 1.439 -1.115 0 C-N-CA 120.565 -0.826 . . . . 0.0 113.244 -177.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.53 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.9 tm? -57.91 -37.08 73.38 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.571 -0.815 . . . . 0.0 110.656 178.079 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.769 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -82.93 -37.14 24.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.249 -177.978 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.28 -13.15 0.02 OUTLIER Glycine 0 CA--C 1.528 0.902 0 N-CA-C 115.558 0.983 . . . . 0.0 115.558 177.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.466 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 20.7 m -107.29 124.36 49.67 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 118.589 1.194 . . . . 0.0 112.202 -178.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -89.35 105.22 17.65 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.026 -179.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.451 ' HG2' HG22 ' A' ' 20' ' ' THR . 24.7 mm-40 -130.12 -179.18 5.08 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.082 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.581 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 83.6 m -129.85 117.44 20.2 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.03 179.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -135.48 160.38 38.66 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.084 0.468 . . . . 0.0 111.415 -179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.505 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -85.22 167.0 16.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.732 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.8 t -131.88 157.49 43.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.765 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -80.14 -170.37 2.46 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.059 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.565 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.9 m -63.58 -44.39 98.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.516 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.565 ' HG ' HG23 ' A' ' 28' ' ' VAL . 25.4 mt -79.53 -20.11 47.95 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -178.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.43 -17.56 31.0 Favored Glycine 0 CA--C 1.521 0.453 0 C-N-CA 120.636 -0.792 . . . . 0.0 113.873 179.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 40.1 t -101.4 108.07 22.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.141 0 CA-C-N 117.493 0.647 . . . . 0.0 111.028 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 177.14 172.0 0.51 Allowed 'General case' 0 N--CA 1.462 0.144 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.248 179.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -135.82 96.78 3.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.834 179.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.505 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.1 mt -124.78 134.6 52.73 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.644 -178.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.7 t70 51.55 83.93 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.515 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.5 m -109.12 129.98 55.48 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.481 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -153.76 177.4 11.03 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.809 0.338 . . . . 0.0 111.357 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -74.98 137.47 72.87 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.45 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.581 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 65.4 Cg_endo -89.64 112.34 0.52 Allowed 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 122.83 2.354 . . . . 0.0 112.402 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -90.48 113.53 0.46 Allowed 'Trans proline' 0 N--CA 1.456 -0.685 0 C-N-CA 121.897 1.731 . . . . 0.0 112.218 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.52 -177.7 1.03 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.812 179.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 34.7 m -108.0 88.04 2.64 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 177.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.5 mt -64.88 126.71 28.83 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.653 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.37 -40.34 2.7 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.864 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -150.27 -167.72 2.9 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.008 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.33 -41.69 76.33 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.24 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 42.3 m -69.74 -40.17 76.34 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.707 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -60.15 -33.68 72.51 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.445 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 24.9 t80 -67.65 -39.07 84.61 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.61 178.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -60.24 -38.77 84.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.297 0.57 . . . . 0.0 109.489 178.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 66.3 m -69.83 -22.39 63.29 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.167 179.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 70.9 m -67.99 -44.51 76.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.45 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.555 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 57.8 m -79.49 -26.25 41.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.296 -179.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.63 -20.37 56.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.454 0.645 . . . . 0.0 110.084 -179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.64 -37.71 88.52 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 114.881 -1.054 . . . . 0.0 112.097 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.2 pt -102.76 2.44 10.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -178.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.92 41.62 3.76 Favored Glycine 0 CA--C 1.523 0.532 0 C-N-CA 120.288 -0.958 . . . . 0.0 113.903 178.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -148.52 -178.31 6.26 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 117.219 0.509 . . . . 0.0 111.08 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -119.03 152.68 35.99 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.115 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.555 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -65.43 117.25 7.67 Favored 'General case' 0 C--O 1.231 0.109 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.523 -179.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 14.1 mtp180 -134.16 113.25 11.84 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.005 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.636 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 13.9 t -90.85 107.48 19.21 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 108.882 -0.785 . . . . 0.0 108.882 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.545 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 55.5 m -103.41 148.94 25.29 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -178.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.769 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -103.67 145.71 12.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.656 -179.784 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.432 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.8 mt -50.14 138.54 19.6 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.352 -179.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 32.2 Cg_exo -62.04 138.06 70.7 Favored 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.622 2.215 . . . . 0.0 112.483 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.462 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.4 mm -131.37 107.69 13.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.628 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -48.96 120.0 3.59 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.002 0.43 . . . . 0.0 111.273 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 117.88 -12.42 13.24 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.852 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.7 pt20 -134.93 167.35 21.07 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 121.606 0.717 . . . . 0.0 111.547 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -82.12 170.2 15.76 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 114.638 -1.164 . . . . 0.0 110.348 179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.0 tt -82.81 127.56 39.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.941 0.401 . . . . 0.0 110.735 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.529 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.8 mm? -101.87 112.7 25.41 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-O 120.894 0.378 . . . . 0.0 111.259 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 77.8 m -147.22 129.08 15.32 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.859 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.38 169.86 22.22 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.788 0.327 . . . . 0.0 110.749 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 57.6 m -92.07 136.75 25.59 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.718 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -84.94 141.28 8.32 Favored 'Trans proline' 0 C--N 1.351 0.673 0 C-N-CA 122.518 2.145 . . . . 0.0 113.077 -179.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.75 3.02 1.06 Allowed 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.883 179.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.62 38.4 67.93 Favored Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.357 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 38.6 mt . . . . . 0 C--O 1.25 1.127 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.112 179.921 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.6 0.238 . . . . 0.0 110.915 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -57.17 101.57 0.1 Allowed 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.703 2.268 . . . . 0.0 112.288 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.23 90.32 2.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.048 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -104.27 -27.83 11.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.194 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 23.7 mmt -107.63 -13.55 15.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.924 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -86.03 -159.41 0.46 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.539 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.729 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -48.23 116.94 1.72 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 121.144 0.497 . . . . 0.0 111.02 179.894 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -95.02 150.95 19.6 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.075 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.505 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.9 OUTLIER -101.58 154.26 37.37 Favored Pre-proline 0 CA--C 1.533 0.32 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.014 179.966 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.505 ' HD2' HG22 ' A' ' 9' ' ' VAL . 87.9 Cg_exo -44.61 130.37 9.46 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.891 2.394 . . . . 0.0 112.732 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -55.06 155.26 4.75 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.073 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 65.4 m -130.65 91.97 36.0 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.0 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.517 ' HB2' ' HB2' ' A' ' 21' ' ' ALA . 93.9 Cg_endo -70.48 177.35 6.17 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.772 2.315 . . . . 0.0 112.152 179.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.496 ' C ' ' O ' ' A' ' 13' ' ' PRO . 25.6 p -15.81 112.95 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.869 0.731 . . . . 0.0 112.318 -179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.3 m -95.22 117.67 30.66 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.29 -166.38 39.16 Favored Glycine 0 N--CA 1.44 -1.066 0 C-N-CA 120.549 -0.834 . . . . 0.0 113.326 -177.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.531 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.8 tm? -56.23 -37.39 69.65 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.523 -0.839 . . . . 0.0 110.714 178.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.79 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -82.65 -39.2 22.42 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.894 -178.204 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.76 -9.47 0.01 OUTLIER Glycine 0 CA--C 1.528 0.864 0 CA-C-N 115.072 -0.967 . . . . 0.0 115.469 176.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.56 HG22 ' HG2' ' A' ' 22' ' ' GLN . 24.7 m -109.81 123.0 48.79 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 118.382 1.091 . . . . 0.0 112.491 -178.216 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.517 ' HB2' ' HB2' ' A' ' 13' ' ' PRO . . . -86.85 102.51 14.37 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.793 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.56 ' HG2' HG22 ' A' ' 20' ' ' THR . 25.4 mm-40 -125.27 -170.01 2.09 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.819 -179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 2.5 t -144.08 121.14 11.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.792 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.09 159.82 41.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.932 0.396 . . . . 0.0 111.206 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -88.64 166.89 13.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.9 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.418 ' HB ' ' NH2' ' A' ' 59' ' ' ARG . 10.3 t -124.94 157.49 35.91 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.791 -179.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -81.73 -169.78 2.51 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.184 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.55 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.4 m -63.43 -45.32 98.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.653 -179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.55 ' HG ' HG23 ' A' ' 28' ' ' VAL . 26.8 mt -77.79 -20.1 53.88 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.583 0.23 . . . . 0.0 111.474 -178.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.87 -17.66 32.39 Favored Glycine 0 CA--C 1.522 0.53 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.567 179.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.415 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 43.9 t -101.99 107.99 22.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 117.301 0.55 . . . . 0.0 111.092 179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 176.11 171.77 0.39 Allowed 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.01 0.434 . . . . 0.0 111.326 179.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -136.16 86.45 2.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.53 179.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -110.59 136.4 49.75 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.873 -178.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.4 t70 51.71 86.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.35 179.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -108.74 133.76 52.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.87 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -157.55 -178.51 7.39 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.927 -179.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -82.89 138.75 43.08 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.965 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -88.89 113.1 0.64 Allowed 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 122.656 2.237 . . . . 0.0 111.991 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -90.59 114.15 0.46 Allowed 'Trans proline' 0 N--CA 1.457 -0.64 0 C-N-CA 122.21 1.94 . . . . 0.0 112.639 -179.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.4 -178.22 1.11 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.721 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.9 m -108.05 88.72 2.8 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 177.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mt -63.61 123.0 17.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.358 -178.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.49 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.35 -33.86 3.78 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.739 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.485 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.2 p30 -163.04 -178.97 6.38 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.979 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.15 -59.63 3.98 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.943 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 44.5 m -60.84 -37.42 82.02 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.834 -179.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.49 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.8 t60 -61.86 -31.29 71.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.054 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.439 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 17.8 t80 -72.07 -40.81 68.03 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.099 179.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.499 ' HB2' HD22 ' A' ' 80' ' ' LEU . 30.9 tt0 -62.12 -27.19 68.76 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.051 0.453 . . . . 0.0 110.0 178.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 31.2 t -76.43 -23.77 53.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.47 179.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 66.5 m -67.31 -38.38 84.86 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.889 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 3.9 m -85.04 -30.87 23.77 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.317 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -72.56 -19.7 61.45 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.517 0.675 . . . . 0.0 109.795 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.97 -38.01 89.55 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 114.702 -1.136 . . . . 0.0 112.1 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pt -106.87 6.72 9.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 N-CA-C 112.627 0.602 . . . . 0.0 112.627 -179.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.36 44.47 5.28 Favored Glycine 0 CA--C 1.523 0.59 0 C-N-CA 120.385 -0.912 . . . . 0.0 113.864 178.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 -147.56 -177.93 5.97 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 117.346 0.573 . . . . 0.0 111.082 179.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.418 ' NH2' ' HB ' ' A' ' 26' ' ' THR . 30.6 mtm180 -117.83 155.8 29.48 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.276 -179.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.439 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -71.41 118.72 14.58 Favored 'General case' 0 C--O 1.231 0.091 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.848 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.0 mmt180 -138.17 114.89 10.62 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.039 0.447 . . . . 0.0 111.859 -179.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.613 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 28.7 t -89.82 111.11 22.03 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.591 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 63.6 m -107.92 149.3 28.5 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.79 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -101.64 143.09 15.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 114.937 -1.029 . . . . 0.0 110.475 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 9.7 mt -50.38 137.04 23.03 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.351 -179.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.417 ' O ' HD13 ' A' ' 67' ' ' ILE . 38.9 Cg_exo -61.24 137.39 70.47 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.485 2.123 . . . . 0.0 112.415 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.47 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 47.8 mm -131.94 109.94 16.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.421 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 68' ' ' LEU . 2.1 pt? -48.18 117.21 1.83 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.292 0.567 . . . . 0.0 110.883 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 120.12 -10.66 10.9 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.487 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.47 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.4 pt20 -138.83 168.44 19.81 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 121.527 0.679 . . . . 0.0 111.219 -179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -88.03 168.95 12.38 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.822 -1.081 . . . . 0.0 110.306 179.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.2 tt -83.22 125.25 40.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.919 0.39 . . . . 0.0 110.701 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.583 ' HB2' HG11 ' A' ' 64' ' ' VAL . 3.9 mm? -97.82 111.39 23.7 Favored 'General case' 0 CA--C 1.53 0.186 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.321 -179.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 77.0 m -139.39 129.34 24.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.708 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -155.84 164.75 38.13 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.807 0.337 . . . . 0.0 110.926 -179.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.415 ' CG2' ' HB2' ' A' ' 80' ' ' LEU . 92.7 m -100.4 121.98 51.44 Favored Pre-proline 0 CA--C 1.53 0.197 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.84 179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.99 127.36 23.02 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.413 2.075 . . . . 0.0 111.849 179.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.26 -115.1 0.53 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.099 -179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -141.26 37.3 1.65 Allowed Glycine 0 N--CA 1.438 -1.188 0 C-N-CA 120.852 -0.69 . . . . 0.0 113.739 -179.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.499 HD22 ' HB2' ' A' ' 50' ' ' GLU . 20.3 mt . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.291 -0.862 . . . . 0.0 110.708 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 N--CA 1.485 1.312 0 CA-C-O 120.563 0.22 . . . . 0.0 110.976 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -57.83 97.05 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.619 2.213 . . . . 0.0 112.082 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -76.77 84.17 3.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.275 -179.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -97.9 -41.21 8.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.706 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 14.4 ptm -104.42 -34.28 8.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.275 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -52.92 -75.59 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.872 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.01 113.12 7.16 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.076 0.465 . . . . 0.0 111.162 179.673 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -82.83 -30.33 28.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.789 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.572 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.7 OUTLIER -92.41 154.66 42.76 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.804 -179.947 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.572 ' HD2' HG22 ' A' ' 9' ' ' VAL . 86.7 Cg_exo -45.4 130.88 11.81 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.912 2.408 . . . . 0.0 112.61 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 30.2 t80 -51.45 142.98 12.69 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.212 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 86.1 m -139.14 94.54 9.76 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.159 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_endo -74.74 166.77 28.58 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.635 2.223 . . . . 0.0 111.911 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.488 ' SG ' ' HA ' ' A' ' 21' ' ' ALA . 1.1 m 46.02 -160.72 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.967 0.413 . . . . 0.0 111.164 -179.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.593 ' O ' ' O ' ' A' ' 16' ' ' GLY . 95.5 p -119.47 -159.07 0.76 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.113 0.782 . . . . 0.0 113.113 -178.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.593 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -20.93 -149.8 0.0 OUTLIER Glycine 0 CA--C 1.529 0.95 0 N-CA-C 118.825 2.29 . . . . 0.0 118.825 -179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.574 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.7 tm? -23.27 -38.18 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 115.417 1.636 . . . . 0.0 115.417 -178.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.753 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 1.7 m-85 -67.97 -36.6 80.33 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.121 -0.631 . . . . 0.0 112.078 -177.113 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.36 -17.73 0.01 OUTLIER Glycine 0 CA--C 1.53 0.988 0 N-CA-C 115.416 0.927 . . . . 0.0 115.416 177.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.473 ' H ' ' C ' ' A' ' 18' ' ' TYR . 41.3 m -116.79 151.5 36.34 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 118.388 1.094 . . . . 0.0 112.0 -178.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.488 ' HA ' ' SG ' ' A' ' 14' ' ' CYS . . . -116.63 111.43 19.85 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.773 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -135.11 -179.61 5.73 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.53 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.573 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 61.8 m -131.33 108.29 9.55 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.028 179.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.452 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 3.3 m -116.61 157.77 24.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.125 -179.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.468 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -88.06 165.46 15.14 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 179.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.2 t -128.54 157.05 42.29 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.926 0.393 . . . . 0.0 111.973 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -86.53 -170.22 2.99 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.026 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.536 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.3 m -61.09 -45.13 99.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.357 -179.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.536 ' HG ' HG23 ' A' ' 28' ' ' VAL . 30.2 mt -77.81 -20.35 53.39 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.765 0.283 . . . . 0.0 111.765 -179.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.38 -14.36 33.07 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 120.541 -0.838 . . . . 0.0 113.643 179.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.5 t -101.95 108.14 23.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 117.249 0.524 . . . . 0.0 111.033 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.91 152.1 0.34 Allowed 'General case' 0 N--CA 1.463 0.182 0 CA-C-O 120.958 0.409 . . . . 0.0 111.539 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -120.76 60.89 0.89 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.261 179.151 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.468 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.6 mt -88.57 138.25 31.59 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.364 -0.834 . . . . 0.0 112.433 -178.199 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.6 t70 39.64 81.22 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.552 178.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.452 ' HB2' ' HB3' ' A' ' 24' ' ' CYS . 37.0 t -128.89 152.17 48.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.056 0.455 . . . . 0.0 111.055 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -170.17 -172.94 1.4 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.05 -179.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -65.12 136.31 96.59 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.557 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.573 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.7 Cg_endo -90.39 114.69 0.5 Allowed 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.882 2.388 . . . . 0.0 112.483 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -91.35 113.76 0.38 Allowed 'Trans proline' 0 N--CA 1.453 -0.886 0 C-N-CA 122.097 1.865 . . . . 0.0 112.255 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.65 -175.55 0.79 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.004 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.1 m -109.68 88.51 2.76 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.8 mt -64.95 123.5 19.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.115 -178.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.484 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.34 -31.36 4.38 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 112.06 0.393 . . . . 0.0 112.06 -179.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.484 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.7 p30 -164.68 -177.36 4.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.627 0.251 . . . . 0.0 111.137 -179.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.558 ' HB1' HD21 ' A' ' 80' ' ' LEU . . . -52.72 -58.66 6.14 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.868 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 23.7 m -62.25 -37.1 84.12 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.894 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.484 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.9 t60 -61.52 -33.1 73.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.859 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.419 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 22.0 t80 -70.82 -40.04 72.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.165 179.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -64.03 -32.19 73.65 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.09 179.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 50.4 m -71.76 -24.29 61.74 Favored 'General case' 0 N--CA 1.44 -0.927 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.21 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 52.2 m -66.86 -43.43 83.58 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.391 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.493 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 60.8 m -79.19 -26.78 42.6 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.477 -179.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.62 -20.06 54.48 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.448 0.642 . . . . 0.0 110.372 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.09 -37.82 88.84 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.982 -1.008 . . . . 0.0 112.153 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.3 pt -104.5 4.97 10.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -178.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.18 42.08 4.12 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.381 -0.914 . . . . 0.0 113.953 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -148.81 -178.12 6.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 117.309 0.555 . . . . 0.0 111.278 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 77.0 mtp180 -118.46 162.5 18.24 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.056 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.493 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -76.27 119.35 20.04 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.129 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -138.36 110.18 7.17 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.947 0.403 . . . . 0.0 111.468 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.422 ' HB3' ' HB2' ' A' ' 18' ' ' TYR . 48.9 m -79.07 99.91 7.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.558 179.062 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 42.6 m -96.61 138.76 33.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.496 0.665 . . . . 0.0 111.874 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.753 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -96.88 146.92 6.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.497 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.7 mt -49.42 136.31 16.99 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.382 -179.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 33.2 Cg_exo -60.34 136.8 70.43 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.543 2.162 . . . . 0.0 112.929 -179.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.483 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.9 mm -129.07 104.79 11.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.271 179.552 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.25 120.1 2.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.005 0.431 . . . . 0.0 111.235 -179.456 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 117.01 -10.25 15.4 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.622 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.483 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.5 pt20 -137.85 168.36 19.86 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 121.585 0.707 . . . . 0.0 111.41 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -84.58 170.0 13.84 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.673 -1.149 . . . . 0.0 110.277 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.429 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.5 tt -82.99 126.32 40.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 120.965 0.412 . . . . 0.0 110.729 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.534 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.0 mm? -97.46 110.81 23.29 Favored 'General case' 0 CA--C 1.528 0.097 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.177 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.429 ' SG ' HG12 ' A' ' 72' ' ' ILE . 50.0 m -146.02 130.82 18.06 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.123 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -160.61 165.67 30.29 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.784 0.325 . . . . 0.0 110.754 179.203 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 50.4 m -81.01 136.55 50.38 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.961 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -87.37 137.6 4.35 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.619 2.212 . . . . 0.0 112.887 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.29 2.71 0.89 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.904 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.05 41.84 53.28 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.375 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.558 HD21 ' HB1' ' A' ' 46' ' ' ALA . 36.2 mt . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.181 -0.914 . . . . 0.0 111.24 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 65.9 p . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.545 0.212 . . . . 0.0 110.922 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -57.3 132.91 53.91 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.667 2.244 . . . . 0.0 112.296 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.606 ' HB1' ' HB2' ' A' ' 6' ' ' GLU . . . -107.88 95.11 5.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.845 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -100.23 -27.87 13.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.434 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.6 pmm? -110.03 -31.86 7.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.232 0.539 . . . . 0.0 110.585 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.606 ' HB2' ' HB1' ' A' ' 3' ' ' ALA . 27.6 mt-10 -51.12 -49.26 61.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.259 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 1.5 ppt_? -133.65 58.95 1.75 Allowed 'General case' 0 CA--C 1.514 -0.437 0 CA-C-O 122.301 1.048 . . . . 0.0 110.731 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -53.17 141.36 23.51 Favored 'General case' 0 C--N 1.309 -1.167 0 CA-C-N 113.514 -1.675 . . . . 0.0 110.979 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.561 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -94.96 153.77 39.83 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.915 -179.85 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.561 ' HD2' HG22 ' A' ' 9' ' ' VAL . 85.5 Cg_exo -44.42 122.16 3.66 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.922 2.415 . . . . 0.0 112.752 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -54.51 147.96 13.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.063 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 29.8 m -86.7 113.99 55.77 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.037 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.434 ' O ' ' O ' ' A' ' 14' ' ' CYS . 72.9 Cg_exo -52.61 -179.52 0.03 OUTLIER 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.967 2.444 . . . . 0.0 113.356 179.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.434 ' O ' ' O ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER -37.32 170.83 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 122.018 0.913 . . . . 0.0 112.86 -178.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.582 ' O ' ' O ' ' A' ' 16' ' ' GLY . 1.8 m -101.13 -154.02 0.47 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.738 -1.119 . . . . 0.0 112.914 -176.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.582 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -13.32 -145.34 0.0 OUTLIER Glycine 0 CA--C 1.529 0.941 0 N-CA-C 118.355 2.102 . . . . 0.0 118.355 -179.097 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.438 HD22 ' HA ' ' A' ' 17' ' ' LEU . 0.6 OUTLIER -20.0 -47.62 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 N-CA-C 115.28 1.585 . . . . 0.0 115.28 -176.179 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.485 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 2.6 m-85 -69.85 -38.62 76.51 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.016 0.825 . . . . 0.0 111.369 -178.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 16' ' ' GLY . . . 56.23 -12.52 0.01 OUTLIER Glycine 0 CA--C 1.527 0.831 0 N-CA-C 116.092 1.197 . . . . 0.0 116.092 176.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.421 HG22 ' N ' ' A' ' 21' ' ' ALA . 21.2 m -135.31 155.41 50.67 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.849 1.325 . . . . 0.0 112.852 -177.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.424 ' HB1' ' CZ ' ' A' ' 49' ' ' PHE . . . -116.33 103.66 10.7 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.346 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -124.86 -169.51 2.0 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.872 0.368 . . . . 0.0 111.279 -179.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 3.9 t -142.14 139.08 32.02 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.246 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -155.8 171.08 20.64 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.975 0.417 . . . . 0.0 111.181 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.36 168.59 10.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.802 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 12.1 t -133.9 157.79 45.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.79 -179.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -81.91 -169.86 2.57 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.282 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.522 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.2 m -63.04 -45.08 99.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.737 -179.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.522 ' HG ' HG23 ' A' ' 28' ' ' VAL . 26.5 mt -78.38 -20.4 51.32 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.598 0.222 . . . . 0.0 111.598 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.27 -15.82 32.69 Favored Glycine 0 CA--C 1.522 0.491 0 C-N-CA 120.636 -0.793 . . . . 0.0 113.558 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.3 t -101.42 107.56 21.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 117.26 0.53 . . . . 0.0 110.932 179.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.99 166.62 0.93 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.069 0.462 . . . . 0.0 111.429 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -133.51 89.09 2.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.558 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -119.82 135.83 54.71 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.927 -0.578 . . . . 0.0 111.696 -178.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.7 t70 51.51 83.83 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.364 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.6 m -108.86 133.01 53.46 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.7 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -159.47 -179.03 7.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.141 -179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 36.8 m-80 -78.49 140.3 59.89 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.005 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -90.69 113.86 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.635 0 C-N-CA 122.906 2.404 . . . . 0.0 111.904 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -90.22 113.51 0.49 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 121.893 1.728 . . . . 0.0 112.845 -179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.422 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -176.16 -177.59 0.91 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.936 178.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.2 m -108.72 88.88 2.83 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 177.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.3 mt -64.2 124.93 22.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.678 -178.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.514 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.97 -33.01 3.83 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.862 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.473 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.5 p30 -163.5 -177.28 5.16 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.113 -179.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.01 -59.23 4.59 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.929 -179.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 23.0 m -61.82 -38.43 88.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.871 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.514 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.7 t60 -61.17 -32.26 71.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.03 0.443 . . . . 0.0 109.845 179.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.431 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 17.7 t80 -69.94 -37.03 75.76 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.12 179.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.66 -32.85 74.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.286 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.2 t -70.55 -20.54 62.79 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.508 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.422 HG23 ' CB ' ' A' ' 41' ' ' ALA . 54.4 m -68.45 -44.02 75.77 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.118 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 19.0 m -81.11 -28.44 35.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.493 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -70.85 -19.58 62.63 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.554 0.693 . . . . 0.0 109.717 -179.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.49 -38.85 90.97 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 114.653 -1.158 . . . . 0.0 112.17 -179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.8 pt -105.27 8.39 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -179.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.63 38.78 10.24 Favored Glycine 0 CA--C 1.522 0.505 0 C-N-CA 120.438 -0.886 . . . . 0.0 113.452 178.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -139.21 -175.93 4.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.719 0.26 . . . . 0.0 110.866 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 77.3 mtp180 -120.46 155.36 33.7 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 121.008 0.433 . . . . 0.0 111.903 -179.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.431 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -84.97 124.96 32.28 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.022 -179.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.541 ' HE ' ' HB3' ' A' ' 74' ' ' CYS . 13.8 ptm180 -149.49 125.16 10.41 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 121.131 0.491 . . . . 0.0 110.909 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 31.8 m -85.26 99.61 11.24 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.719 -179.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 59.9 m -90.94 143.21 26.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.331 0.586 . . . . 0.0 111.265 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.528 ' CG1' ' HB2' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -99.77 146.38 8.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.662 -179.763 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 7.0 mt -49.43 133.09 18.2 Favored Pre-proline 0 CA--C 1.531 0.22 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.502 -179.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 24.3 Cg_exo -64.27 139.76 67.45 Favored 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 122.615 2.21 . . . . 0.0 112.596 -179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 51.0 mm -129.08 109.55 18.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.231 179.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -46.26 109.16 0.17 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.827 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.46 -13.49 6.22 Favored Glycine 0 C--N 1.332 0.336 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.611 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -133.51 167.71 19.96 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 121.524 0.678 . . . . 0.0 111.227 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -83.22 169.61 15.57 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.654 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.8 tt -83.19 126.89 40.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.719 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.528 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.1 mm? -101.96 112.21 24.76 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.965 0.412 . . . . 0.0 111.284 -179.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.541 ' HB3' ' HE ' ' A' ' 61' ' ' ARG . 63.4 m -143.99 135.09 25.51 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.703 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -158.26 171.24 20.55 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.947 0.403 . . . . 0.0 111.013 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 87.5 m -99.08 137.01 20.38 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.696 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -87.67 142.16 5.76 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.545 2.163 . . . . 0.0 112.821 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.58 6.5 2.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.782 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.92 36.09 73.16 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.26 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 38.5 mt . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.008 179.902 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 71.6 p . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.625 0.25 . . . . 0.0 111.001 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -58.07 114.24 1.88 Allowed 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.566 2.177 . . . . 0.0 112.152 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -84.43 85.44 7.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.113 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -85.63 -25.77 26.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.013 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.0 ttt -111.49 -30.0 7.55 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.381 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -82.56 -164.62 0.87 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.877 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.669 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.2 OUTLIER -48.12 121.55 4.39 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.119 0.485 . . . . 0.0 111.183 179.89 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.427 ' CG ' ' N ' ' A' ' 9' ' ' VAL . 7.6 pt20 -50.05 -48.92 52.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.515 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.627 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.5 OUTLIER -64.11 154.82 81.22 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.899 179.849 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.627 ' HD2' HG22 ' A' ' 9' ' ' VAL . 81.0 Cg_exo -44.25 133.57 9.07 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.926 2.417 . . . . 0.0 112.767 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -56.09 145.87 24.57 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.131 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 81.8 m -133.72 93.11 21.59 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.003 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.595 ' HG2' ' HA ' ' A' ' 20' ' ' THR . 74.0 Cg_endo -67.95 170.33 14.49 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.255 1.97 . . . . 0.0 111.69 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 2.4 t 49.27 -161.25 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.147 0.498 . . . . 0.0 110.778 -178.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.592 ' O ' ' O ' ' A' ' 16' ' ' GLY . 87.5 p -120.25 -156.35 0.66 Allowed 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.529 -178.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.592 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -17.01 -146.92 0.0 OUTLIER Glycine 0 CA--C 1.53 0.981 0 N-CA-C 118.349 2.1 . . . . 0.0 118.349 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.524 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.1 tm? -22.03 -41.41 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 115.19 1.552 . . . . 0.0 115.19 -177.474 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.613 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 2.0 m-85 -69.13 -36.91 78.0 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 120.093 -0.643 . . . . 0.0 111.947 -177.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.87 -14.09 0.02 OUTLIER Glycine 0 CA--C 1.528 0.853 0 N-CA-C 115.495 0.958 . . . . 0.0 115.495 177.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.595 ' HA ' ' HG2' ' A' ' 13' ' ' PRO . 28.2 m -140.26 144.89 36.7 Favored 'General case' 0 N--CA 1.461 0.122 0 CA-C-N 118.471 1.135 . . . . 0.0 112.215 -178.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.433 ' HB1' ' CZ ' ' A' ' 49' ' ' PHE . . . -108.59 112.56 24.98 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.707 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.46 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 16.8 mm-40 -131.32 -175.91 3.85 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.0 0.429 . . . . 0.0 111.216 -179.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.569 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 71.0 m -127.56 109.97 12.25 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.032 179.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.536 ' HB2' ' HD3' ' A' ' 61' ' ' ARG . 59.2 m -127.59 155.92 43.08 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.094 0.474 . . . . 0.0 111.416 -179.08 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -86.42 165.41 16.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.584 179.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 10.7 t -126.43 157.22 39.16 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.478 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -80.78 -170.34 2.61 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.106 -179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.547 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.0 m -62.93 -45.53 98.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -179.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.547 ' HG ' HG23 ' A' ' 28' ' ' VAL . 28.0 mt -78.46 -20.17 51.53 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.647 0.261 . . . . 0.0 111.615 -178.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.29 -16.11 32.45 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.631 -0.795 . . . . 0.0 113.784 179.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.3 t -101.49 108.11 22.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 117.163 0.481 . . . . 0.0 111.191 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 178.21 167.17 0.78 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 121.106 0.479 . . . . 0.0 111.492 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -133.04 85.94 2.26 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.549 -0.751 . . . . 0.0 109.464 179.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -114.2 141.9 46.95 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.983 -178.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 46.8 82.1 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.863 178.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 34.2 m -110.0 129.64 55.64 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.929 179.417 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -153.18 -178.07 6.71 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.056 -179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -78.28 134.86 62.28 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.553 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.569 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.1 Cg_endo -89.61 114.61 0.6 Allowed 'Trans proline' 0 N--CA 1.459 -0.533 0 C-N-CA 122.832 2.355 . . . . 0.0 112.053 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -90.7 112.87 0.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 121.885 1.724 . . . . 0.0 112.342 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -176.0 -176.55 0.83 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.756 179.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 42.6 m -111.22 88.58 2.82 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.3 mt -61.44 122.03 14.17 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.397 -178.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.464 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.4 -32.84 4.0 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.94 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.469 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.1 p30 -165.41 -178.92 5.21 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 120.756 0.312 . . . . 0.0 111.307 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.14 -60.14 3.25 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.208 -0.451 . . . . 0.0 112.007 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 32.0 m -60.97 -36.57 79.76 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.857 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.469 ' HB3' ' H ' ' A' ' 45' ' ' ASN . 1.6 t60 -62.76 -31.73 72.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.133 -0.485 . . . . 0.0 109.77 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.435 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 13.2 t80 -70.17 -38.66 75.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.958 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -64.55 -34.67 78.8 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.426 179.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.2 t -72.92 -13.06 61.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.061 -179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 87.1 m -80.3 -40.83 26.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.232 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.451 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 72.8 m -85.93 -25.43 26.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.261 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -78.4 -19.91 52.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.363 0.602 . . . . 0.0 110.357 -179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.7 -37.72 88.56 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.051 -0.977 . . . . 0.0 112.278 -179.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.1 pt -103.28 7.33 9.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -178.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.58 40.97 5.22 Favored Glycine 0 CA--C 1.522 0.493 0 C-N-CA 120.408 -0.901 . . . . 0.0 114.041 178.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -146.77 -179.03 6.5 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.344 0.572 . . . . 0.0 111.142 179.254 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 44.0 mtp180 -116.81 153.55 32.27 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.111 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.451 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -77.32 121.22 23.42 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.569 -179.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.558 HH21 ' HB2' ' A' ' 74' ' ' CYS . 13.4 ptm180 -155.6 115.58 3.71 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 121.23 0.538 . . . . 0.0 110.551 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.424 ' HB3' ' O ' ' A' ' 20' ' ' THR . 33.5 m -79.11 103.21 8.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.745 -179.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 23.4 m -94.12 123.94 37.82 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 121.435 0.636 . . . . 0.0 111.572 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.665 HG11 ' HB2' ' A' ' 73' ' ' LEU . 1.5 p -72.85 148.05 9.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 114.969 -1.014 . . . . 0.0 111.182 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.437 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 7.9 mt -51.88 137.32 35.5 Favored Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.931 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 31.2 Cg_exo -60.37 124.78 15.84 Favored 'Trans proline' 0 C--N 1.348 0.513 0 C-N-CA 122.386 2.057 . . . . 0.0 112.369 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.48 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 50.0 mm -124.85 101.67 9.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.565 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -48.33 120.21 3.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.14 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.2 -12.18 11.41 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.63 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.8 pt20 -135.27 168.45 19.15 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.396 0.617 . . . . 0.0 111.137 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -84.35 166.25 17.56 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.252 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.454 HG12 ' SG ' ' A' ' 74' ' ' CYS . 15.9 tt -83.31 126.91 40.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 120.807 0.337 . . . . 0.0 110.575 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.665 ' HB2' HG11 ' A' ' 64' ' ' VAL . 4.0 mm? -99.55 102.22 13.68 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.589 -179.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.558 ' HB2' HH21 ' A' ' 61' ' ' ARG . 44.3 m -137.81 131.63 31.44 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.803 179.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -160.32 163.44 33.32 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-O 120.745 0.307 . . . . 0.0 111.218 179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 90.6 m -99.99 116.79 64.31 Favored Pre-proline 0 CA--C 1.532 0.274 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.11 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -62.21 136.73 61.84 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 122.663 2.242 . . . . 0.0 112.722 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 62.25 1.67 0.74 Allowed 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.05 179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.83 38.79 65.65 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.252 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 36.0 mt . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.155 -0.926 . . . . 0.0 111.104 179.934 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 62.6 p . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.613 0.244 . . . . 0.0 110.998 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -57.6 97.32 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.705 2.27 . . . . 0.0 112.336 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -102.82 82.84 2.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.212 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.9 -32.22 14.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.906 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.0 ptt? -106.16 -32.59 8.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.207 0.527 . . . . 0.0 110.043 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -76.05 -165.23 0.45 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.683 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.541 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -55.41 119.56 5.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.972 0.415 . . . . 0.0 110.773 179.658 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 10.2 pm0 -57.69 145.68 33.49 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.967 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.551 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -91.97 153.82 43.46 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.81 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.551 ' HD2' HG22 ' A' ' 9' ' ' VAL . 84.9 Cg_exo -44.16 125.77 5.87 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.829 2.352 . . . . 0.0 112.521 179.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -54.5 147.04 14.81 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.084 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 51.4 m -128.99 91.35 42.93 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.226 -179.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.461 ' O ' ' O ' ' A' ' 14' ' ' CYS . 50.1 Cg_exo -51.41 168.06 0.32 Allowed 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.435 2.09 . . . . 0.0 112.643 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.461 ' O ' ' O ' ' A' ' 13' ' ' PRO . 42.3 t 35.42 108.53 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.317 -0.856 . . . . 0.0 113.161 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.8 p -95.42 115.32 27.26 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 179.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 171.31 -165.72 38.77 Favored Glycine 0 N--CA 1.44 -1.074 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.272 -177.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.532 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.7 tm? -61.67 -36.37 80.67 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.631 -0.784 . . . . 0.0 110.337 177.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.808 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -81.58 -36.01 29.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.256 -178.167 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.79 -11.56 0.02 OUTLIER Glycine 0 CA--C 1.529 0.919 0 N-CA-C 115.859 1.104 . . . . 0.0 115.859 177.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.602 HG22 ' HG2' ' A' ' 22' ' ' GLN . 16.3 m -111.3 126.96 55.46 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 118.792 1.296 . . . . 0.0 112.613 -178.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -96.55 101.35 12.95 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.816 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.602 ' HG2' HG22 ' A' ' 20' ' ' THR . 28.1 mm-40 -128.52 -174.74 3.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.935 0.397 . . . . 0.0 111.145 -179.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.615 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 64.3 m -134.8 114.75 12.93 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.123 179.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.82 161.42 32.98 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.983 0.421 . . . . 0.0 111.164 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.494 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -87.94 166.34 14.59 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.675 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 11.0 t -131.05 157.64 42.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.814 -179.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.11 -169.59 2.47 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.103 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.503 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.9 m -62.0 -47.14 94.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.747 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.503 ' HG ' HG23 ' A' ' 28' ' ' VAL . 33.2 mt -76.91 -19.99 56.74 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -178.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.98 -12.23 31.88 Favored Glycine 0 CA--C 1.521 0.412 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.353 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.582 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.4 p -100.64 108.72 23.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 117.137 0.469 . . . . 0.0 111.255 179.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 172.72 153.72 0.08 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.881 -179.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -123.88 67.26 1.03 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.632 179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.494 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.0 mt -90.3 135.76 33.48 Favored 'General case' 0 CA--C 1.522 -0.126 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.466 -178.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 52.23 83.44 0.06 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.39 179.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.7 m -108.91 134.0 52.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.537 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -160.62 -178.28 6.77 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.838 0.351 . . . . 0.0 111.319 -179.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.4 m-80 -81.33 136.82 49.08 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.725 179.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.615 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 68.4 Cg_endo -90.51 117.08 0.59 Allowed 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 123.034 2.489 . . . . 0.0 112.746 -179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -91.31 113.41 0.37 Allowed 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.052 1.835 . . . . 0.0 112.227 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.89 -178.57 1.06 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.833 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 35.9 m -109.27 88.09 2.65 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 177.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.0 mt -63.08 124.4 21.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.408 -178.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -117.8 -40.33 3.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.981 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 34.8 m-80 -151.08 -168.41 3.09 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.985 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.89 -44.32 81.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.2 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.5 m -68.35 -39.22 81.94 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.552 -179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -60.25 -34.99 74.48 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.787 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.418 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 21.4 t80 -68.42 -39.07 81.73 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.932 179.17 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -61.78 -39.57 92.13 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.23 0.538 . . . . 0.0 109.746 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.1 m -68.09 -24.33 65.04 Favored 'General case' 0 N--CA 1.438 -1.03 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.171 179.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 90.4 m -68.56 -43.52 76.45 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.304 -179.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.531 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 59.0 m -78.74 -26.13 44.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.102 -179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.63 -19.93 54.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.4 0.619 . . . . 0.0 110.139 -179.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.05 -37.29 86.89 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.983 -1.008 . . . . 0.0 112.043 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.3 pt -105.39 8.74 9.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 112.702 0.63 . . . . 0.0 112.702 -178.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.67 42.72 5.67 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 120.413 -0.899 . . . . 0.0 114.015 178.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -147.83 -178.55 6.33 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 117.336 0.568 . . . . 0.0 111.192 179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 91.4 mtt180 -120.31 153.15 36.82 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.338 -179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.531 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -67.99 117.67 10.16 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.704 -179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.3 mmm180 -136.02 115.24 12.48 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.988 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.708 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 23.0 t -93.29 109.28 20.81 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.489 -0.559 . . . . 0.0 109.489 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.554 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 76.7 m -104.67 148.67 26.31 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -178.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.808 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -99.02 148.32 6.28 Favored 'Isoleucine or valine' 0 C--O 1.232 0.169 0 CA-C-N 114.988 -1.006 . . . . 0.0 110.761 179.861 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.424 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.2 mt -49.48 140.74 13.38 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.395 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.466 ' O ' HD13 ' A' ' 67' ' ' ILE . 33.0 Cg_exo -59.52 137.98 81.03 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.674 2.249 . . . . 0.0 112.495 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.466 HD13 ' O ' ' A' ' 66' ' ' PRO . 31.1 mm -131.97 108.56 14.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.308 179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.414 HD12 ' HA ' ' A' ' 68' ' ' LEU . 0.7 OUTLIER -52.72 121.46 7.23 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.001 0.429 . . . . 0.0 111.406 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 114.76 -4.58 22.76 Favored Glycine 0 C--N 1.33 0.212 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.682 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 14.2 pt20 -148.67 165.4 31.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.324 0.583 . . . . 0.0 111.189 -179.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -81.37 169.9 16.66 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.648 -179.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.3 tt -82.74 123.65 38.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 121.116 0.484 . . . . 0.0 110.502 179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.526 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.1 mm? -90.52 110.93 22.05 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.254 -179.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 67.2 m -138.15 132.33 31.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.143 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -156.81 168.64 26.83 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 120.815 0.34 . . . . 0.0 110.611 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.0 m -96.73 137.25 21.42 Favored Pre-proline 0 CA--C 1.532 0.278 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.761 179.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -83.48 139.49 9.07 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.418 2.079 . . . . 0.0 112.958 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.06 3.37 1.25 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.038 179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 68.35 38.51 87.3 Favored Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.249 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 31.5 mt . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.32 -0.848 . . . . 0.0 111.235 179.965 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.9 m . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.725 0.297 . . . . 0.0 110.791 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.23 103.07 0.14 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.668 2.245 . . . . 0.0 112.529 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.58 82.5 1.64 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.825 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -111.07 -33.87 6.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.498 -179.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 9.0 ptp -103.17 -38.13 7.41 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.013 0.435 . . . . 0.0 110.689 -179.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -77.52 -161.28 0.22 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.833 -179.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.521 ' HD3' ' H ' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -47.04 122.66 4.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.131 0.491 . . . . 0.0 111.156 179.891 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -52.79 140.89 22.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.184 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.466 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.9 OUTLIER -98.75 153.69 37.77 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.924 179.893 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.466 ' HD2' HG22 ' A' ' 9' ' ' VAL . 73.4 Cg_exo -47.77 122.92 7.65 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 122.83 2.353 . . . . 0.0 112.473 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -68.31 148.51 50.64 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.89 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 98.6 m -132.55 89.68 35.34 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.006 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.714 ' HG2' ' HA ' ' A' ' 20' ' ' THR . 93.2 Cg_endo -75.09 166.46 29.05 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.48 2.12 . . . . 0.0 111.814 179.246 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.6 t 48.54 -163.18 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.24 0.543 . . . . 0.0 111.093 -178.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.599 ' O ' ' O ' ' A' ' 16' ' ' GLY . 88.7 p -115.16 -156.4 0.6 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.588 -178.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.599 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -17.58 -148.35 0.0 OUTLIER Glycine 0 CA--C 1.529 0.933 0 N-CA-C 118.701 2.241 . . . . 0.0 118.701 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.491 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -23.23 -41.41 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 115.438 1.644 . . . . 0.0 115.438 -177.232 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.592 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 5.3 m-85 -68.3 -36.74 79.8 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 119.895 -0.722 . . . . 0.0 111.497 -177.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.2 -12.13 0.01 OUTLIER Glycine 0 CA--C 1.526 0.742 0 N-CA-C 115.644 1.018 . . . . 0.0 115.644 176.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.714 ' HA ' ' HG2' ' A' ' 13' ' ' PRO . 26.9 m -137.91 143.34 40.77 Favored 'General case' 0 C--N 1.334 -0.088 0 CA-C-N 118.631 1.216 . . . . 0.0 112.451 -178.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.434 ' HB1' ' CZ ' ' A' ' 49' ' ' PHE . . . -110.6 106.39 15.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.554 179.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.477 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 20.0 mm-40 -126.18 -176.55 3.68 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.834 0.35 . . . . 0.0 111.309 -179.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.506 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 72.6 m -124.64 111.8 16.04 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.159 179.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.577 ' HB2' ' HD3' ' A' ' 61' ' ' ARG . 63.6 m -128.61 153.84 46.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.208 0.527 . . . . 0.0 111.566 -179.265 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.437 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -84.88 166.81 16.54 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.667 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.5 t -133.96 158.23 44.03 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.742 -179.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -77.99 -169.93 1.74 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.369 -179.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.536 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.3 m -64.25 -46.61 92.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.722 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.536 ' HG ' HG23 ' A' ' 28' ' ' VAL . 30.7 mt -75.91 -19.94 58.41 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -178.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.75 -15.29 31.76 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 120.589 -0.815 . . . . 0.0 113.625 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.4 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 40.4 t -101.49 107.83 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 117.28 0.54 . . . . 0.0 111.006 179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 176.17 158.46 0.27 Allowed 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.315 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -127.48 89.92 3.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.78 179.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.437 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.9 mt -116.73 141.91 47.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.798 -178.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.6 t70 48.9 83.3 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.679 178.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 35.8 m -112.78 131.1 55.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.018 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -161.66 -179.51 7.33 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 120.878 0.37 . . . . 0.0 111.099 -179.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -73.26 133.16 81.28 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.271 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.506 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 63.7 Cg_endo -90.14 124.11 1.14 Allowed 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.807 2.338 . . . . 0.0 112.14 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -90.85 113.32 0.41 Allowed 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 121.88 1.72 . . . . 0.0 112.34 -179.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.75 -179.69 1.24 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.615 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 48.3 m -109.66 88.03 2.65 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 177.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.4 mt -61.84 120.73 11.29 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.201 -178.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.497 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.33 -33.39 3.89 Favored 'General case' 0 C--O 1.231 0.105 0 CA-C-N 116.163 -0.472 . . . . 0.0 111.904 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.476 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.1 p30 -165.14 -178.76 5.27 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.738 0.304 . . . . 0.0 111.288 -179.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.22 -60.71 2.57 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.213 -0.449 . . . . 0.0 112.1 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 22.0 m -60.1 -37.25 79.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.825 -179.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.497 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.6 t60 -62.02 -32.63 73.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.929 179.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.439 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 11.0 t80 -69.51 -39.19 77.7 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.881 178.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -63.53 -38.39 90.96 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.009 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 54.9 m -67.16 -15.48 63.74 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.377 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 91.5 m -79.34 -41.4 27.98 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.517 -179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.455 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 74.8 m -86.04 -22.99 26.94 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.251 -179.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -80.93 -20.02 42.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.388 0.613 . . . . 0.0 110.361 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.1 -37.78 88.68 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.078 -0.964 . . . . 0.0 112.054 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.6 pt -104.42 11.17 8.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.21 43.75 6.51 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 120.5 -0.857 . . . . 0.0 114.185 178.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -144.34 179.89 6.96 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 117.399 0.599 . . . . 0.0 111.136 179.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -115.32 145.6 42.33 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.195 -179.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.455 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -72.25 123.69 23.49 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.344 -179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.577 ' HD3' ' HB2' ' A' ' 24' ' ' CYS . 13.9 ptm180 -155.86 126.29 6.74 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-O 120.929 0.395 . . . . 0.0 110.507 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.406 ' HB3' ' O ' ' A' ' 20' ' ' THR . 25.5 m -90.45 100.74 13.53 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.961 -179.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.533 ' HA ' ' HB2' ' A' ' 74' ' ' CYS . 9.2 m -98.32 115.34 28.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.247 0.546 . . . . 0.0 112.234 -178.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.626 HG12 ' O ' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -65.64 146.25 13.37 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.466 179.212 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.5 mt -49.81 135.31 20.24 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.261 -179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -62.43 136.96 62.16 Favored 'Trans proline' 0 C--N 1.349 0.603 0 C-N-CA 122.506 2.138 . . . . 0.0 112.574 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.491 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 51.2 mm -129.12 104.54 11.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.482 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -46.59 119.5 2.46 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.035 0.445 . . . . 0.0 111.16 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.43 -12.14 11.22 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.553 -179.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.7 pt20 -135.21 168.46 19.11 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-O 121.486 0.66 . . . . 0.0 111.207 -179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -82.24 166.12 19.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.854 -1.066 . . . . 0.0 110.308 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.3 tt -83.53 124.65 39.81 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 CA-C-O 120.951 0.405 . . . . 0.0 111.072 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.626 ' O ' HG12 ' A' ' 64' ' ' VAL . 3.7 mm? -101.19 109.42 21.3 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.849 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.533 ' HB2' ' HA ' ' A' ' 63' ' ' CYS . 51.3 t -161.78 133.65 5.59 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.426 -0.51 . . . . 0.0 111.515 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -160.95 171.88 17.91 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.099 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 74.4 m -77.7 136.97 62.88 Favored Pre-proline 0 CA--C 1.532 0.276 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.665 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -84.09 134.41 6.04 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.398 2.066 . . . . 0.0 112.887 -179.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.37 2.29 1.13 Allowed 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.889 -0.596 . . . . 0.0 112.024 179.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 73.5 42.17 41.77 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.463 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 28.2 mt . . . . . 0 C--O 1.249 1.027 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.148 179.907 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 67.6 p . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.615 0.245 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.01 89.83 0.06 OUTLIER 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 122.733 2.289 . . . . 0.0 112.453 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -92.67 90.79 7.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.017 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -102.49 -34.94 8.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.354 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 11.5 ttp -111.04 -29.11 8.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.715 -179.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -76.19 -166.04 0.56 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.954 -179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.744 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -47.05 113.01 0.59 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.31 0.576 . . . . 0.0 111.226 -179.839 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.719 HE21 ' H ' ' A' ' 9' ' ' VAL . 0.3 OUTLIER -53.83 -47.81 70.56 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.443 -0.798 . . . . 0.0 111.595 179.826 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.719 ' H ' HE21 ' A' ' 8' ' ' GLN . 0.8 OUTLIER -97.55 153.2 38.42 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.155 179.848 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.532 ' HD2' HG22 ' A' ' 9' ' ' VAL . 52.9 Cg_exo -50.04 123.47 10.94 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.95 2.433 . . . . 0.0 112.539 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -67.48 153.04 44.6 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.701 179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 65.7 m -155.34 101.89 2.24 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.263 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.446 ' O ' ' O ' ' A' ' 14' ' ' CYS . 65.3 Cg_endo -76.12 166.37 27.96 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.732 2.288 . . . . 0.0 112.352 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.446 ' O ' ' O ' ' A' ' 13' ' ' PRO . 0.1 OUTLIER 17.44 106.87 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.124 0 O-C-N 124.336 1.022 . . . . 0.0 112.237 -179.655 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.2 m -93.73 116.95 29.46 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.0 -166.18 39.02 Favored Glycine 0 N--CA 1.439 -1.128 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.996 -177.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.523 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.7 tm? -59.05 -36.73 75.53 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.596 -0.802 . . . . 0.0 110.686 178.07 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.758 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -82.29 -37.58 25.63 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.141 -178.106 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 58.07 -12.34 0.02 OUTLIER Glycine 0 CA--C 1.529 0.911 0 N-CA-C 115.586 0.994 . . . . 0.0 115.586 177.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.529 HG22 ' HG2' ' A' ' 22' ' ' GLN . 17.9 m -109.1 123.87 49.88 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 118.625 1.212 . . . . 0.0 112.194 -178.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.2 102.29 14.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.931 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.529 ' HG2' HG22 ' A' ' 20' ' ' THR . 26.2 mm-40 -128.41 -174.22 3.17 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.051 0.453 . . . . 0.0 111.249 -179.28 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.571 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 70.9 m -128.03 116.14 19.56 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.031 179.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.556 ' HB2' ' HD3' ' A' ' 61' ' ' ARG . 78.2 m -129.77 158.49 39.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.068 0.461 . . . . 0.0 111.407 -179.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.32 165.71 12.66 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.569 179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.2 t -125.55 157.39 37.21 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.78 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -81.48 -170.1 2.62 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.224 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.529 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.3 m -62.65 -47.1 94.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -179.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.529 ' HG ' HG23 ' A' ' 28' ' ' VAL . 29.1 mt -77.65 -20.28 54.04 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.587 0.232 . . . . 0.0 111.531 -179.054 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.21 -17.47 31.65 Favored Glycine 0 CA--C 1.522 0.483 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.696 179.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.415 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 49.0 t -101.61 108.07 22.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 117.276 0.538 . . . . 0.0 111.142 179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.415 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 175.45 170.9 0.32 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.058 0.456 . . . . 0.0 111.328 179.61 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -133.28 95.05 3.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.58 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.8 mt -120.53 140.52 51.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.892 -178.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.6 t70 48.1 82.53 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.795 178.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 47.1 m -113.13 129.79 56.4 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.821 179.405 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.76 -178.28 7.14 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.979 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -73.92 136.94 76.4 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.496 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.571 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.1 Cg_endo -89.47 117.17 0.75 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.826 2.35 . . . . 0.0 112.276 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -90.52 112.74 0.43 Allowed 'Trans proline' 0 N--CA 1.457 -0.669 0 C-N-CA 121.765 1.643 . . . . 0.0 112.561 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -176.28 -176.35 0.77 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.647 179.121 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 37.6 m -110.84 88.54 2.8 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 177.425 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -63.09 124.32 20.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.382 -178.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.474 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.73 -33.72 3.73 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.75 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.476 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.8 p30 -163.2 -178.6 6.08 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.157 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -51.13 -59.68 3.92 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.333 -0.394 . . . . 0.0 112.005 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 35.0 m -61.54 -36.1 79.64 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.975 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.476 ' HB3' ' H ' ' A' ' 45' ' ' ASN . 1.9 t60 -62.44 -32.95 73.9 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.189 -0.46 . . . . 0.0 109.824 179.384 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.49 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 18.3 t80 -70.34 -39.56 74.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.806 -0.634 . . . . 0.0 109.944 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -60.63 -36.85 79.66 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 121.27 0.557 . . . . 0.0 109.773 178.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 51.1 m -67.34 -22.73 65.58 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.479 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 75.6 m -70.07 -43.77 70.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.551 -179.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.538 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 81.0 m -83.02 -24.94 32.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.189 -179.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.96 -19.92 56.75 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.414 0.626 . . . . 0.0 110.115 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.97 -38.86 92.36 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.891 -1.049 . . . . 0.0 112.137 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.8 pt -101.76 9.91 8.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 89.41 39.47 6.33 Favored Glycine 0 CA--C 1.521 0.461 0 C-N-CA 120.554 -0.831 . . . . 0.0 114.225 178.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -146.41 -177.47 5.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 117.161 0.481 . . . . 0.0 111.131 179.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 58.3 mtt180 -119.97 154.96 33.73 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.682 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.538 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -65.9 119.61 11.62 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.364 -179.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.556 ' HD3' ' HB2' ' A' ' 24' ' ' CYS . 39.6 mtp180 -135.93 118.29 15.7 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.161 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.664 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 14.2 t -96.19 107.04 19.32 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.556 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 54.3 m -102.8 146.94 27.5 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.365 0.602 . . . . 0.0 112.548 -178.393 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.758 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -97.76 143.85 12.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.55 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.9 mt -49.66 139.55 15.64 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.212 -179.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 31.5 Cg_exo -59.28 132.8 48.71 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.54 2.16 . . . . 0.0 112.5 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.468 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 51.1 mm -129.55 106.94 14.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.763 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.21 120.47 5.51 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.301 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 119.07 -12.53 11.46 Favored Glycine 0 N--CA 1.453 -0.197 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.635 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.468 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.9 pt20 -135.44 167.25 21.42 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.504 0.668 . . . . 0.0 111.299 -179.771 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -81.84 169.87 16.36 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.218 179.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.1 tt -82.8 125.71 40.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.895 0.378 . . . . 0.0 110.928 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.559 ' HB2' HG11 ' A' ' 64' ' ' VAL . 3.8 mm? -101.61 113.01 25.76 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.01 -179.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 72.5 m -146.45 129.12 16.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.048 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -160.87 170.13 21.28 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 120.867 0.365 . . . . 0.0 110.986 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 85.4 m -92.61 136.41 25.24 Favored Pre-proline 0 CA--C 1.532 0.28 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.001 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -86.89 144.36 7.3 Favored 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 122.685 2.257 . . . . 0.0 112.599 -179.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 68.36 -0.94 2.02 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.759 179.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.11 35.7 64.26 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.578 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 42.1 mt . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.253 -0.879 . . . . 0.0 111.172 179.934 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 59.3 m . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.209 0.052 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_exo -41.1 140.01 1.38 Allowed 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.802 2.335 . . . . 0.0 112.782 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.51 ' HB1' ' HB2' ' A' ' 6' ' ' GLU . . . -128.26 91.82 3.33 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.139 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -98.77 -37.43 9.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.808 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 23.8 mmt -110.04 -8.08 14.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.773 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.51 ' HB2' ' HB1' ' A' ' 3' ' ' ALA . 30.7 mt-10 -78.43 -113.99 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.676 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.406 ' HD3' ' C ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER 43.7 82.0 0.03 OUTLIER 'General case' 0 CA--C 1.515 -0.386 0 CA-C-O 121.888 0.851 . . . . 0.0 110.852 -179.842 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.1 mm100 -92.54 120.67 33.22 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.074 -1.421 . . . . 0.0 110.849 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.629 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.5 OUTLIER -66.55 153.5 93.12 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.919 -179.795 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.629 ' HD2' HG22 ' A' ' 9' ' ' VAL . 73.1 Cg_exo -47.1 120.9 4.63 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.857 2.371 . . . . 0.0 112.85 179.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -78.6 151.17 32.51 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.756 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 91.6 m -59.71 111.98 4.64 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.831 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.36 176.49 0.11 Allowed 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 122.646 2.231 . . . . 0.0 112.713 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 14.6 p -39.46 114.89 0.45 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.541 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.6 p -97.59 116.89 30.68 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 173.35 -155.17 21.92 Favored Glycine 0 N--CA 1.435 -1.387 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.57 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.483 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.8 tm? -62.96 -42.45 99.83 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.762 0.425 . . . . 0.0 111.225 178.478 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.802 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -78.1 -38.15 44.72 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.179 0.514 . . . . 0.0 112.028 -178.222 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.9 -8.92 0.02 OUTLIER Glycine 0 CA--C 1.527 0.785 0 CA-C-N 115.148 -0.933 . . . . 0.0 115.288 176.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.429 HG22 ' HG2' ' A' ' 22' ' ' GLN . 89.9 m -112.54 123.05 49.44 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 118.491 1.145 . . . . 0.0 112.546 -178.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -88.1 118.49 27.7 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.081 179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.429 ' HG2' HG22 ' A' ' 20' ' ' THR . 77.5 mm-40 -146.52 167.79 22.82 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.858 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.508 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 60.8 m -117.45 113.29 21.83 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.09 179.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -135.09 156.35 49.17 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.018 0.437 . . . . 0.0 111.269 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.519 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -80.56 166.35 21.23 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.747 179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 9.4 t -131.02 157.68 42.36 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.927 -179.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -82.17 -169.6 2.48 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.237 -179.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.566 HG23 ' HG ' ' A' ' 29' ' ' LEU . 8.5 m -62.65 -46.16 97.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.612 -179.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.566 ' HG ' HG23 ' A' ' 28' ' ' VAL . 29.3 mt -78.42 -20.12 51.77 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 -178.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.43 -15.36 32.56 Favored Glycine 0 CA--C 1.52 0.402 0 C-N-CA 120.633 -0.794 . . . . 0.0 113.575 179.241 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 51.5 t -101.53 108.13 22.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 117.244 0.522 . . . . 0.0 111.181 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 177.68 168.39 0.68 Allowed 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.264 179.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.412 ' HB2' HD13 ' A' ' 72' ' ' ILE . 10.1 t70 -134.42 90.38 2.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.731 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.1 mt -118.6 135.91 54.17 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.605 -178.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 51.9 84.08 0.05 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.349 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.3 m -109.29 134.96 51.14 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.863 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.7 164.24 36.09 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.182 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 33.8 m-80 -60.92 136.01 93.24 Favored Pre-proline 0 C--N 1.331 -0.233 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.914 -179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.508 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 66.7 Cg_endo -90.16 109.66 0.4 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.825 2.35 . . . . 0.0 112.3 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -91.21 113.88 0.39 Allowed 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 122.124 1.883 . . . . 0.0 112.741 -179.626 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.417 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.47 -177.44 1.0 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.788 178.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.3 m -109.09 88.65 2.78 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.0 mt -65.61 120.16 12.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.352 -178.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -117.32 -40.58 3.06 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.791 179.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -151.99 -169.09 3.26 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.969 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.46 -48.48 77.53 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.423 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 27.8 m -66.75 -42.05 86.83 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.679 -179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -60.04 -32.82 71.27 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 179.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.535 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 13.9 t80 -68.54 -38.88 81.2 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.866 178.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -62.45 -37.39 85.7 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.143 0.497 . . . . 0.0 109.769 178.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.0 m -69.6 -13.37 62.28 Favored 'General case' 0 N--CA 1.44 -0.961 0 CA-C-N 115.511 -0.768 . . . . 0.0 111.616 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.417 HG23 ' CB ' ' A' ' 41' ' ' ALA . 49.8 m -75.08 -44.89 44.87 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.436 -179.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.504 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 60.4 m -84.99 -25.52 27.67 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.974 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.3 -20.16 59.27 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.519 0.676 . . . . 0.0 109.921 -179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.46 -38.57 90.22 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 114.733 -1.121 . . . . 0.0 112.145 -179.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.1 pt -100.98 -0.93 10.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -178.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.98 39.69 2.83 Favored Glycine 0 CA--C 1.521 0.446 0 C-N-CA 120.284 -0.96 . . . . 0.0 113.963 178.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 -149.8 -177.21 5.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 117.057 0.428 . . . . 0.0 110.906 179.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 53.5 mtt180 -118.76 154.82 32.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.843 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.535 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -70.37 116.62 10.92 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.256 -179.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 18.8 mmm180 -133.56 118.42 18.24 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.038 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.673 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 34.7 t -94.32 108.62 20.5 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 179.42 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.568 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 65.5 m -105.82 146.01 30.45 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.399 0.619 . . . . 0.0 112.551 -178.312 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.802 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -95.18 146.95 6.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.39 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 9.4 mt -49.49 135.64 17.78 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.369 -179.184 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 30.8 Cg_exo -62.32 136.47 59.85 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.571 2.18 . . . . 0.0 112.452 -179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.5 mm -129.92 109.02 17.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.417 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.54 109.29 0.29 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.058 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.97 -11.62 6.19 Favored Glycine 0 C--N 1.333 0.384 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.882 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -135.8 167.87 20.36 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-O 121.484 0.659 . . . . 0.0 111.41 -179.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -81.39 166.95 19.96 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.301 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.412 HD13 ' HB2' ' A' ' 33' ' ' ASP . 17.9 tt -83.3 124.32 39.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-O 121.037 0.446 . . . . 0.0 110.803 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.529 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 4.0 mm? -97.68 110.39 22.96 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.224 -179.425 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 68.2 m -141.15 130.83 24.11 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.595 179.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -154.78 161.18 41.6 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.781 0.324 . . . . 0.0 110.874 -179.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 71.4 m -100.56 123.52 45.79 Favored Pre-proline 0 CA--C 1.533 0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.127 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -67.21 140.79 54.77 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.563 2.175 . . . . 0.0 112.714 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.11 2.32 1.04 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.061 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 69.68 35.07 73.41 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.408 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 40.3 mt . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.996 179.897 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 74.4 p . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.532 0.206 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -57.59 117.46 4.17 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.621 2.214 . . . . 0.0 112.16 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.55 ' HB1' ' HB2' ' A' ' 6' ' ' GLU . . . -140.21 91.98 2.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.228 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -99.65 -22.68 15.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.094 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.2 ptp -104.58 -34.42 8.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.439 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.575 ' HB2' ' HD3' ' A' ' 7' ' ' ARG . 23.0 mt-10 -60.51 -51.81 67.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.05 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.575 ' HD3' ' HB2' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -164.26 91.58 0.62 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.665 0.745 . . . . 0.0 110.801 179.675 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -48.83 145.31 3.9 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.226 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.563 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -97.71 155.14 37.52 Favored Pre-proline 0 CA--C 1.532 0.28 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.737 179.908 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.563 ' HD2' HG22 ' A' ' 9' ' ' VAL . 88.4 Cg_exo -44.84 131.78 10.44 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.672 2.248 . . . . 0.0 112.7 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -54.6 149.72 10.37 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.085 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 87.8 m -125.21 99.47 34.03 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.189 -179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.402 ' O ' ' C ' ' A' ' 14' ' ' CYS . 59.4 Cg_exo -53.1 176.7 0.07 OUTLIER 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.723 2.282 . . . . 0.0 113.169 179.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.402 ' C ' ' O ' ' A' ' 13' ' ' PRO . 0.5 OUTLIER -30.38 111.92 0.08 Allowed 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.723 -179.947 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.8 p -96.27 115.57 27.64 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 179.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.12 -155.08 22.94 Favored Glycine 0 N--CA 1.436 -1.31 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.397 -177.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.5 tm? -67.16 -40.13 86.6 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 120.899 0.381 . . . . 0.0 110.717 177.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.759 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.2 OUTLIER -75.23 -37.97 60.84 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.268 0.556 . . . . 0.0 111.422 -178.8 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.75 -9.44 0.02 OUTLIER Glycine 0 CA--C 1.524 0.651 0 CA-C-N 114.922 -1.035 . . . . 0.0 114.945 177.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.526 HG22 ' HG2' ' A' ' 22' ' ' GLN . 6.0 m -109.56 142.36 40.76 Favored 'General case' 0 C--N 1.334 -0.096 0 CA-C-N 118.16 0.98 . . . . 0.0 112.212 -178.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -113.74 100.64 8.61 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.484 179.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.563 ' NE2' ' HA ' ' A' ' 38' ' ' ASN . 6.1 mm-40 -134.23 -177.74 4.72 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.919 0.39 . . . . 0.0 111.349 -178.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.511 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 56.9 m -126.34 106.82 9.78 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 178.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.438 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 2.0 m -109.08 154.46 22.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.604 -178.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -91.0 166.97 12.73 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.699 178.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.3 t -131.86 158.25 41.82 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -179.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -79.93 -169.63 2.09 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.198 -179.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.536 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.1 m -63.56 -46.34 95.25 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.676 -179.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.536 ' HG ' HG23 ' A' ' 28' ' ' VAL . 34.3 mt -76.25 -19.65 58.13 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -178.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.97 -13.29 31.81 Favored Glycine 0 CA--C 1.52 0.406 0 C-N-CA 120.566 -0.826 . . . . 0.0 113.497 179.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.416 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 61.1 t -101.45 108.05 22.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 117.132 0.466 . . . . 0.0 111.108 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 176.13 163.4 0.37 Allowed 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.406 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -134.56 65.95 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.431 179.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.2 mt -93.15 138.38 31.62 Favored 'General case' 0 C--O 1.226 -0.159 0 CA-C-N 115.726 -0.67 . . . . 0.0 112.567 -178.081 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 43.95 83.42 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.769 177.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.438 ' HB2' ' HB3' ' A' ' 24' ' ' CYS . 21.0 t -133.33 136.38 45.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.91 0.386 . . . . 0.0 110.66 179.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -164.1 -174.87 3.74 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.503 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.563 ' HA ' ' NE2' ' A' ' 22' ' ' GLN . 6.3 p30 -58.43 126.35 78.67 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.702 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.511 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 68.4 Cg_endo -90.57 134.37 1.92 Allowed 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 122.751 2.301 . . . . 0.0 112.293 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -91.66 113.76 0.36 Allowed 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 122.207 1.938 . . . . 0.0 112.839 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.406 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.63 -178.63 1.12 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.021 179.029 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.0 m -110.33 88.47 2.77 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 177.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.9 mt -64.56 120.15 11.8 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.41 -178.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -115.36 -40.94 3.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.78 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.5 m-80 -152.01 -169.02 3.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.806 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.11 -41.56 94.81 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.221 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.1 m -70.61 -44.47 67.17 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.759 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -58.56 -34.88 71.53 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.447 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 13.5 t80 -67.32 -38.33 84.75 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.581 178.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -60.66 -40.51 92.35 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.222 0.535 . . . . 0.0 109.761 178.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.6 m -66.3 -23.85 66.45 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.442 179.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.406 HG23 ' CB ' ' A' ' 41' ' ' ALA . 66.4 m -63.97 -45.93 86.9 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.501 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 61.1 m -80.11 -28.75 38.95 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.25 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.92 -20.08 61.82 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.579 0.704 . . . . 0.0 109.948 -179.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.45 -36.61 84.72 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 114.611 -1.177 . . . . 0.0 111.876 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.3 pt -108.71 1.08 9.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -179.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.84 43.46 2.64 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 120.324 -0.941 . . . . 0.0 114.306 178.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -148.83 174.64 12.0 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 117.468 0.634 . . . . 0.0 110.923 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.437 ' O ' ' HG2' ' A' ' 61' ' ' ARG . 11.7 ptm180 -119.01 142.18 48.04 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 120.766 0.317 . . . . 0.0 110.992 -179.682 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.447 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -60.51 125.77 24.92 Favored 'General case' 0 C--N 1.34 0.173 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.167 -179.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.468 ' HB2' ' SG ' ' A' ' 74' ' ' CYS . 8.6 ptm180 -153.63 127.87 9.12 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.125 179.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.42 ' HB2' ' CD2' ' A' ' 18' ' ' TYR . 6.4 m -95.02 105.11 17.0 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.954 -0.566 . . . . 0.0 109.846 -178.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 3.9 m -105.58 136.24 45.52 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 121.12 0.486 . . . . 0.0 111.934 -179.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.759 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -85.29 148.4 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.364 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.922 179.911 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.7 mt -49.5 137.7 16.59 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.126 -179.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 37.2 Cg_exo -60.79 137.12 70.74 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 122.458 2.105 . . . . 0.0 112.464 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.462 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 51.1 mm -129.56 106.1 13.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.565 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.412 ' HA ' HD12 ' A' ' 68' ' ' LEU . 0.6 OUTLIER -47.63 120.69 3.47 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.379 -179.716 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 116.21 -11.93 16.91 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.718 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 2.3 pt20 -138.6 169.51 17.67 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.492 0.663 . . . . 0.0 111.335 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -84.4 165.34 18.27 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.968 179.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.9 tt -83.66 122.97 38.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 121.206 0.527 . . . . 0.0 110.938 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.619 ' O ' HG12 ' A' ' 64' ' ' VAL . 4.1 mm? -92.53 115.33 28.0 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.571 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.468 ' SG ' ' HB2' ' A' ' 61' ' ' ARG . 51.7 t -161.03 137.63 8.59 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.572 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -160.34 167.39 27.54 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.199 -179.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 84.1 m -87.79 137.11 31.95 Favored Pre-proline 0 CA--C 1.531 0.229 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.83 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -84.21 141.24 9.1 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 122.496 2.131 . . . . 0.0 112.902 -179.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.98 1.03 1.06 Allowed 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.846 -0.615 . . . . 0.0 112.05 179.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.02 37.92 64.07 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.32 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 37.1 mt . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.237 -0.887 . . . . 0.0 111.145 -179.951 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 53.0 m . . . . . 0 N--CA 1.486 1.345 0 CA-C-O 120.493 0.187 . . . . 0.0 111.048 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -59.05 90.66 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.649 2.232 . . . . 0.0 112.296 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -112.23 89.24 3.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.911 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -98.07 -44.81 6.48 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.3 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -103.87 -2.04 26.84 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.294 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -86.21 -72.49 0.49 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.984 -179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.61 117.27 8.11 Favored 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 120.983 0.42 . . . . 0.0 110.918 179.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -56.41 145.76 26.46 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.745 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.659 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.5 OUTLIER -84.3 152.87 61.96 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.694 179.912 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.659 ' HD2' HG22 ' A' ' 9' ' ' VAL . 82.8 Cg_exo -43.81 127.09 6.22 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.862 2.375 . . . . 0.0 112.564 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 31.0 t80 -52.77 153.04 3.44 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.294 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 44.9 m -118.9 95.63 49.41 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.047 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -52.55 176.65 0.06 OUTLIER 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.795 2.33 . . . . 0.0 113.191 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -37.08 109.01 0.09 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.738 -179.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.6 p -95.34 115.5 27.52 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 178.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.46 -154.81 22.05 Favored Glycine 0 N--CA 1.436 -1.334 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.772 -177.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.463 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.6 tm? -66.32 -40.8 90.16 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.169 -0.515 . . . . 0.0 110.896 178.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.781 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -76.04 -37.84 57.86 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.495 0.664 . . . . 0.0 111.117 -179.055 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.87 -8.23 0.02 OUTLIER Glycine 0 CA--C 1.525 0.665 0 CA-C-N 114.733 -1.121 . . . . 0.0 114.8 177.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.536 HG22 ' HG2' ' A' ' 22' ' ' GLN . 23.3 m -108.72 142.98 38.44 Favored 'General case' 0 N--CA 1.457 -0.087 0 CA-C-N 118.016 0.908 . . . . 0.0 112.194 -178.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.445 ' O ' ' HG3' ' A' ' 39' ' ' PRO . . . -107.9 101.72 10.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.038 179.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.536 ' HG2' HG22 ' A' ' 20' ' ' THR . 27.8 mm-40 -126.33 -179.28 4.67 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 121.137 0.494 . . . . 0.0 111.505 -179.12 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.596 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 77.4 m -133.86 117.44 16.82 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.84 179.347 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.08 -179.04 5.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.843 0.354 . . . . 0.0 111.083 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.476 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -111.32 165.66 11.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.815 -179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.1 t -129.77 157.08 43.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.8 -179.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -83.07 -170.18 2.9 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.092 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.556 HG23 ' HG ' ' A' ' 29' ' ' LEU . 7.4 m -61.76 -45.97 97.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.836 -0.62 . . . . 0.0 112.672 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.556 ' HG ' HG23 ' A' ' 28' ' ' VAL . 30.3 mt -77.5 -20.08 54.87 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -178.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.59 -13.22 32.82 Favored Glycine 0 CA--C 1.519 0.333 0 C-N-CA 120.561 -0.828 . . . . 0.0 113.424 179.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.412 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 22.5 t -101.16 107.83 22.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 117.255 0.527 . . . . 0.0 110.957 179.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.412 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 174.46 154.36 0.13 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.177 179.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -123.55 59.54 1.11 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.76 179.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.476 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 3.3 mt -81.46 135.64 35.63 Favored 'General case' 0 C--O 1.227 -0.108 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.849 -178.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.0 t70 51.0 83.23 0.05 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.78 179.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.6 m -109.28 132.09 54.45 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.379 179.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -158.07 -177.1 6.31 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-O 120.892 0.377 . . . . 0.0 111.647 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -77.7 138.14 62.54 Favored Pre-proline 0 CA--C 1.532 0.27 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.357 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.596 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 62.6 Cg_endo -90.72 110.75 0.37 Allowed 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.021 2.481 . . . . 0.0 112.993 -179.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_endo -91.5 113.69 0.37 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.002 1.802 . . . . 0.0 112.032 179.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.14 -178.38 1.19 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.985 179.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.2 m -110.53 88.68 2.83 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.3 mt -63.52 122.08 15.41 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.274 -178.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.507 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.36 -33.4 3.88 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.753 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.475 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 8.1 p30 -162.88 -178.05 5.87 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.073 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.62 -61.51 2.15 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.102 -179.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 34.2 m -60.81 -35.93 77.75 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.956 -179.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.507 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.7 t60 -62.19 -32.93 73.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.016 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.493 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 29.3 t80 -71.08 -39.97 71.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.142 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -61.39 -35.63 78.05 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.219 0.533 . . . . 0.0 109.735 178.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 45.2 m -67.71 -24.0 65.34 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-N 115.446 -0.797 . . . . 0.0 111.195 179.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 51.6 m -65.03 -45.66 84.54 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.439 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.547 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 38.3 m -81.73 -26.17 34.79 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.14 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -75.27 -20.2 59.29 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.452 0.644 . . . . 0.0 110.151 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.59 -36.88 85.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 114.865 -1.061 . . . . 0.0 112.062 -179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.5 pt -107.48 14.2 8.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -179.064 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 83.34 41.9 8.22 Favored Glycine 0 CA--C 1.521 0.411 0 C-N-CA 120.421 -0.895 . . . . 0.0 113.546 178.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.3 mt-30 -143.71 -178.81 6.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 117.034 0.417 . . . . 0.0 111.074 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.449 ' HD3' HH21 ' A' ' 61' ' ' ARG . 99.2 mtt180 -122.99 151.59 41.7 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.406 -179.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.547 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -66.91 120.05 12.94 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.326 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.449 HH21 ' HD3' ' A' ' 59' ' ' ARG . 13.9 mmt180 -138.9 125.74 20.96 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.964 -179.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 22.4 m -100.03 99.94 10.74 Favored 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.401 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 4.0 m -104.07 141.11 36.79 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -177.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.781 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.4 OUTLIER -97.77 144.11 11.63 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.181 179.255 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 8.1 mt -53.25 135.08 50.92 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.753 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -66.82 141.06 57.79 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.545 2.163 . . . . 0.0 112.74 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.443 ' O ' ' C ' ' A' ' 68' ' ' LEU . 1.8 mp -112.68 102.99 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.072 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.443 ' C ' ' O ' ' A' ' 67' ' ' ILE . 0.3 OUTLIER -30.32 108.67 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.385 0 CA-C-O 120.928 0.394 . . . . 0.0 111.206 -179.675 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 121.78 -8.89 9.93 Favored Glycine 0 C--N 1.333 0.395 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.374 -179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -135.67 170.21 16.33 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.516 0.674 . . . . 0.0 111.339 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -85.9 169.9 12.85 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.33 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 17.3 tt -83.28 126.66 40.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.076 0.465 . . . . 0.0 111.024 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.561 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.9 mm? -98.43 119.78 37.72 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.113 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.438 ' SG ' ' HB3' ' A' ' 61' ' ' ARG . 41.8 t -161.56 137.81 8.11 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.769 -0.372 . . . . 0.0 111.47 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -160.81 170.74 20.09 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.82 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.9 m -89.88 137.25 28.4 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.826 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -86.8 142.77 6.84 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.693 2.262 . . . . 0.0 112.787 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 66.65 -1.32 1.34 Allowed 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.92 179.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.18 36.52 63.85 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.452 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.1 mt . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.229 179.969 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 56.6 m . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.607 0.242 . . . . 0.0 110.899 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -56.78 113.45 1.47 Allowed 'Trans proline' 0 C--N 1.346 0.433 0 C-N-CA 122.664 2.243 . . . . 0.0 112.351 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.47 ' HB1' ' HB2' ' A' ' 6' ' ' GLU . . . -146.06 104.01 3.79 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.322 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -95.54 -28.66 14.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.933 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 9.8 ttm -110.87 -28.98 8.14 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.105 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.47 ' HB2' ' HB1' ' A' ' 3' ' ' ALA . 19.8 mt-10 -81.15 -158.42 0.21 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.584 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.69 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -49.18 119.69 3.46 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.989 179.859 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -51.95 139.03 23.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.93 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.578 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -88.81 154.71 50.33 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.946 -179.823 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.578 ' HD2' HG22 ' A' ' 9' ' ' VAL . 82.4 Cg_exo -43.55 123.97 3.99 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.884 2.389 . . . . 0.0 112.51 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 8.6 t80 -57.81 157.43 7.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.075 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 84.7 m -117.02 126.18 27.67 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.072 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_exo -58.2 176.78 0.33 Allowed 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.52 2.147 . . . . 0.0 112.433 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -42.41 126.06 3.37 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.927 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.4 p -103.87 116.04 31.55 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 173.13 -154.89 21.59 Favored Glycine 0 N--CA 1.434 -1.443 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.743 -177.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.478 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.5 tm? -65.56 -40.63 93.02 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.31 -0.445 . . . . 0.0 110.96 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.783 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -77.43 -39.04 48.29 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.233 0.539 . . . . 0.0 111.645 -178.347 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.4 -12.91 0.01 OUTLIER Glycine 0 CA--C 1.528 0.87 0 N-CA-C 115.919 1.128 . . . . 0.0 115.919 176.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.426 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 25.6 m -110.73 129.11 55.92 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 118.78 1.29 . . . . 0.0 112.683 -178.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.38 115.99 28.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.431 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.499 ' NE2' ' HD3' ' A' ' 39' ' ' PRO . 18.9 mm-40 -135.53 -178.24 5.03 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 121.03 0.443 . . . . 0.0 111.366 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.545 ' SG ' ' HB3' ' A' ' 39' ' ' PRO . 98.1 m -138.02 100.42 4.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.718 -0.673 . . . . 0.0 109.837 179.192 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 4.5 t -118.89 177.88 4.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.903 -179.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.423 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -104.08 166.94 10.09 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.8 -179.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.2 t -129.19 157.8 40.79 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.674 -179.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.417 ' H ' ' HB3' ' A' ' 32' ' ' ALA . 1.5 p-10 -77.64 -170.02 1.68 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.051 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.538 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.8 m -65.19 -44.67 95.25 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.516 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.538 ' HG ' HG23 ' A' ' 28' ' ' VAL . 31.3 mt -76.6 -19.36 57.93 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.88 -16.86 30.46 Favored Glycine 0 CA--C 1.521 0.465 0 C-N-CA 120.541 -0.838 . . . . 0.0 113.79 179.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.409 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 66.2 t -101.48 107.68 21.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 117.464 0.632 . . . . 0.0 111.074 179.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.417 ' HB3' ' H ' ' A' ' 27' ' ' ASP . . . 175.74 168.42 0.38 Allowed 'General case' 0 C--O 1.231 0.113 0 CA-C-O 121.091 0.472 . . . . 0.0 111.389 179.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -135.24 65.41 1.56 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.58 179.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.423 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 2.6 mt -87.57 132.23 34.13 Favored 'General case' 0 C--O 1.225 -0.237 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.119 -178.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.9 t70 51.17 84.75 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.562 179.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 86.8 m -108.12 129.72 55.15 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.121 179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -148.17 -178.98 6.6 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.861 0.362 . . . . 0.0 111.433 -179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.7 p30 -73.79 137.94 76.76 Favored Pre-proline 0 CA--C 1.531 0.246 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.75 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.545 ' HB3' ' SG ' ' A' ' 23' ' ' CYS . 63.8 Cg_endo -90.88 109.73 0.34 Allowed 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 123.044 2.496 . . . . 0.0 112.609 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -91.01 113.73 0.4 Allowed 'Trans proline' 0 N--CA 1.454 -0.799 0 C-N-CA 121.948 1.765 . . . . 0.0 112.387 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -175.27 177.27 1.9 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.887 178.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.1 m -106.99 88.11 2.66 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 177.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mt -61.8 122.71 16.07 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.252 -178.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.487 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.59 -31.72 4.22 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 116.232 -0.44 . . . . 0.0 112.074 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.472 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 7.0 p30 -166.24 -179.53 5.12 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.708 0.289 . . . . 0.0 111.337 -179.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -49.98 -59.17 4.14 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.157 -0.474 . . . . 0.0 112.026 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 43.6 m -60.26 -36.64 78.27 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.792 -179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.487 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.8 t60 -62.49 -33.81 75.6 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.861 179.295 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -69.05 -34.48 75.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.184 179.232 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -70.29 -24.06 62.97 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.626 179.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 29.5 t -85.43 -12.76 51.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.315 -179.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 60.4 m -72.15 -44.17 63.52 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.756 0.312 . . . . 0.0 111.284 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.492 ' SG ' ' HA ' ' A' ' 60' ' ' ALA . 48.2 m -84.67 -25.48 28.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.069 -179.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -76.45 -20.06 57.42 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.471 0.653 . . . . 0.0 110.176 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.2 -36.53 82.2 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.946 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 1.5 pt -105.36 -4.5 9.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 112.951 0.722 . . . . 0.0 112.951 -178.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 103.98 39.59 2.46 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 120.272 -0.966 . . . . 0.0 114.133 178.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -143.94 -178.89 6.15 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 117.265 0.533 . . . . 0.0 111.069 179.228 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -114.95 149.77 36.79 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.327 -179.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.492 ' HA ' ' SG ' ' A' ' 53' ' ' CYS . . . -76.22 121.15 22.49 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.831 -179.24 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.499 HH21 ' HB2' ' A' ' 74' ' ' CYS . 11.9 ptm180 -146.08 125.62 13.26 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.692 179.423 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.648 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 10.6 t -88.95 118.16 28.47 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.539 -179.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.608 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 40.6 m -109.76 148.1 32.04 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 -178.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.783 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -99.91 149.21 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 115.041 -0.982 . . . . 0.0 111.061 -179.556 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.422 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 8.1 mt -49.37 136.84 16.42 Favored Pre-proline 0 CA--C 1.531 0.228 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.422 -179.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 27.2 Cg_exo -63.18 133.36 40.42 Favored 'Trans proline' 0 C--N 1.353 0.787 0 C-N-CA 122.562 2.175 . . . . 0.0 112.642 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 50.3 mm -129.38 106.8 14.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.664 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.748 HD22 ' O ' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -50.86 110.83 0.46 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 121.563 0.696 . . . . 0.0 111.529 -179.763 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.27 -15.58 5.79 Favored Glycine 0 C--N 1.335 0.51 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.548 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -132.37 168.3 18.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.441 0.639 . . . . 0.0 111.176 -179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -84.27 167.1 16.93 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.258 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.413 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.0 tt -83.14 125.03 40.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 121.001 0.429 . . . . 0.0 110.919 179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.575 ' HB2' HG11 ' A' ' 64' ' ' VAL . 3.9 mm? -96.28 110.73 22.99 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.164 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.499 ' HB2' HH21 ' A' ' 61' ' ' ARG . 57.4 m -145.93 135.98 23.65 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.226 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -159.83 166.67 29.85 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 120.699 0.285 . . . . 0.0 110.851 179.252 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.2 m -91.89 135.99 26.75 Favored Pre-proline 0 CA--C 1.531 0.246 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.986 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 84.1 Cg_endo -88.12 143.47 5.75 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.795 2.33 . . . . 0.0 112.817 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 64.94 4.05 2.32 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.853 179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 70.35 33.69 68.51 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.351 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 47.4 mt . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.183 -0.913 . . . . 0.0 111.078 179.981 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 78.3 p . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.599 0.238 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_endo -57.41 102.19 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.581 2.187 . . . . 0.0 112.199 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -80.37 91.87 5.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.192 -179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.05 -52.67 4.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.02 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 8.9 ttt -112.9 -7.7 13.73 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 122.031 0.919 . . . . 0.0 108.815 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.611 ' N ' ' CD ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -66.33 -164.6 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 114.256 -1.338 . . . . 0.0 110.904 -178.825 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.607 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -52.13 118.88 3.8 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.056 0.455 . . . . 0.0 110.946 -179.921 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -54.38 133.38 45.37 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.78 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.612 HG13 ' HD2' ' A' ' 10' ' ' PRO . 3.6 t -93.82 141.01 23.19 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.925 179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.612 ' HD2' HG13 ' A' ' 9' ' ' VAL . 79.8 Cg_exo -32.55 121.42 0.1 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.856 3.037 . . . . 0.0 113.209 -179.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 86.6 t80 -82.55 140.44 33.28 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.324 -179.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 54.6 m -139.44 99.91 7.76 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.232 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.67 ' HB2' ' H ' ' A' ' 21' ' ' ALA . 37.3 Cg_exo -56.13 171.24 0.87 Allowed 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.071 1.847 . . . . 0.0 111.649 179.26 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.449 ' SG ' ' N ' ' A' ' 15' ' ' SER . 3.4 p 44.98 -154.5 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.2 0.524 . . . . 0.0 111.101 -179.762 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.583 ' O ' ' O ' ' A' ' 16' ' ' GLY . 4.2 m -113.3 -157.85 0.63 Allowed 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 -178.505 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.583 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -19.49 -149.69 0.0 OUTLIER Glycine 0 CA--C 1.531 1.079 0 N-CA-C 119.086 2.394 . . . . 0.0 119.086 -179.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.507 HD13 ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -22.79 -41.09 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 115.757 1.762 . . . . 0.0 115.757 -177.252 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.705 ' HB2' ' SG ' ' A' ' 62' ' ' CYS . 2.8 m-85 -68.59 -36.67 79.03 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 118.679 0.672 . . . . 0.0 111.485 -177.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.3 -20.33 0.01 OUTLIER Glycine 0 CA--C 1.533 1.204 0 N-CA-C 117.981 1.952 . . . . 0.0 117.981 175.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.481 ' O ' ' SG ' ' A' ' 62' ' ' CYS . 76.9 m -130.04 120.58 24.93 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 120.064 1.932 . . . . 0.0 113.539 -177.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.67 ' H ' ' HB2' ' A' ' 13' ' ' PRO . . . -69.13 120.58 15.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.291 -179.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.44 ' HA ' ' HD3' ' A' ' 39' ' ' PRO . 20.4 mm-40 -138.46 -175.39 4.11 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.89 0.376 . . . . 0.0 110.781 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.8 t -145.91 134.04 21.59 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.608 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 61.7 m -148.38 162.26 39.91 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.015 0.436 . . . . 0.0 111.392 -179.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -96.32 170.35 9.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.297 179.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.1 t -130.59 157.94 41.34 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.709 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -82.09 -169.96 2.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.212 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.549 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.6 m -63.02 -43.5 99.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.678 -0.692 . . . . 0.0 112.623 -179.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.549 ' HG ' HG23 ' A' ' 28' ' ' VAL . 29.4 mt -78.37 -19.92 52.37 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 -178.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.77 -14.54 31.99 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.395 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.405 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 51.6 t -101.71 107.94 22.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-N 117.239 0.52 . . . . 0.0 111.127 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 176.4 145.38 0.09 Allowed 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.283 179.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -116.62 60.96 0.73 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.758 179.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.8 mt -84.91 153.23 22.99 Favored 'General case' 0 C--O 1.227 -0.117 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.577 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.1 t70 41.37 79.74 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.785 178.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 54.4 m -109.31 131.45 55.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.71 179.583 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -162.45 -174.8 4.18 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.931 0.395 . . . . 0.0 111.369 -179.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.566 ' H ' HD22 ' A' ' 38' ' ' ASN . 0.1 OUTLIER -78.99 133.05 62.0 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.883 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 22' ' ' GLN . 92.5 Cg_endo -85.27 117.88 1.89 Allowed 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.665 2.244 . . . . 0.0 111.78 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 63.7 Cg_endo -91.1 114.34 0.41 Allowed 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 122.229 1.953 . . . . 0.0 113.036 -179.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.447 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.62 178.02 1.65 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.915 178.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 31.7 m -106.86 88.42 2.74 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.2 mt -63.95 124.3 21.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.59 -178.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.1 -40.52 2.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.855 179.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -151.91 -167.34 2.75 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.997 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -67.16 -45.29 77.46 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.364 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 42.4 m -67.83 -40.98 83.69 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.497 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -61.15 -32.7 72.41 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.549 179.115 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -68.82 -37.32 79.12 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.437 -0.802 . . . . 0.0 110.167 179.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -67.1 -27.45 67.36 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.526 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.6 t -82.37 -13.85 56.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.936 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.447 HG23 ' CB ' ' A' ' 41' ' ' ALA . 42.8 m -69.91 -40.07 75.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.91 0.386 . . . . 0.0 111.176 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 12.2 m -88.58 -29.31 20.11 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.293 -179.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -71.31 -19.95 62.26 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.706 0.765 . . . . 0.0 109.579 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.12 -38.02 89.34 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.884 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.7 pt -103.13 -1.35 9.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -179.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.4 44.1 3.3 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 120.331 -0.938 . . . . 0.0 113.519 179.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.2 mt-30 -146.03 -172.98 4.04 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 117.227 0.514 . . . . 0.0 111.089 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 19.3 ptt180 -119.37 141.89 48.65 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 -178.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -72.05 123.24 22.4 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.213 -179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.484 HH21 ' HB2' ' A' ' 74' ' ' CYS . 14.2 ptm180 -158.55 126.15 5.06 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.337 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.705 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 18.7 t -85.43 145.36 27.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.404 -179.268 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 21.6 m -125.5 147.38 49.26 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.327 0.584 . . . . 0.0 111.723 -179.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.638 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -101.52 147.4 8.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.059 -0.973 . . . . 0.0 110.251 179.79 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.46 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 7.9 mt -49.32 133.12 17.41 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.29 -179.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 23.9 Cg_exo -63.65 139.05 67.56 Favored 'Trans proline' 0 C--N 1.351 0.691 0 C-N-CA 122.622 2.214 . . . . 0.0 112.521 -179.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.429 HD13 ' O ' ' A' ' 66' ' ' PRO . 46.0 mm -131.6 110.42 17.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.394 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.81 109.49 0.29 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.878 -179.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.84 -13.74 5.8 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.588 -179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -133.39 167.65 20.03 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-O 121.473 0.654 . . . . 0.0 111.31 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -83.53 168.56 16.32 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 114.77 -1.104 . . . . 0.0 110.181 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.439 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.8 tt -83.32 125.56 40.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.867 0.365 . . . . 0.0 110.615 179.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.524 ' HB2' HG11 ' A' ' 64' ' ' VAL . 3.9 mm? -98.28 105.85 18.05 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 120.83 0.348 . . . . 0.0 111.328 -179.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.484 ' HB2' HH21 ' A' ' 61' ' ' ARG . 48.5 m -146.89 133.63 20.0 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.099 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -161.03 166.76 27.66 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-O 120.823 0.344 . . . . 0.0 110.825 179.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.2 m -80.34 137.38 52.33 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.803 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -89.86 142.69 4.03 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.797 2.331 . . . . 0.0 112.757 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.23 4.47 1.64 Allowed 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.613 179.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 72.46 36.7 58.99 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.964 -0.636 . . . . 0.0 112.537 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 32.6 mt . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.206 -0.902 . . . . 0.0 110.875 179.94 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.564 0.221 . . . . 0.0 110.976 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -58.76 119.58 6.92 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.566 2.178 . . . . 0.0 112.384 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -113.54 87.95 2.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.961 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -107.28 -48.11 3.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.333 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 86.9 mmm -112.15 4.22 17.76 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-O 121.849 0.833 . . . . 0.0 109.301 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.585 ' N ' ' CD ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -75.8 -34.83 60.18 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.219 -1.355 . . . . 0.0 111.15 -178.586 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.64 62.19 1.22 Allowed 'General case' 0 CA--C 1.508 -0.638 0 CA-C-O 122.225 1.012 . . . . 0.0 109.987 178.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.42 ' CG ' ' N ' ' A' ' 9' ' ' VAL . 1.7 pt20 -45.44 -50.4 12.59 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 113.245 -1.798 . . . . 0.0 111.497 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.592 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.7 OUTLIER -74.39 154.95 87.95 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.882 179.823 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.592 ' HD2' HG22 ' A' ' 9' ' ' VAL . 84.5 Cg_exo -45.18 123.96 5.73 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.725 2.283 . . . . 0.0 112.586 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -63.67 156.21 27.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.99 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 59.8 m -137.17 91.3 14.78 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.088 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.422 ' O ' ' O ' ' A' ' 14' ' ' CYS . 69.0 Cg_endo -75.1 170.13 21.07 Favored 'Trans proline' 0 C--N 1.347 0.461 0 C-N-CA 122.898 2.399 . . . . 0.0 112.781 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 21' ' ' ALA . 51.3 t 31.16 104.97 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 78.1 p -96.22 115.81 28.01 Favored 'General case' 0 C--O 1.232 0.147 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 170.94 -166.56 39.74 Favored Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 120.582 -0.818 . . . . 0.0 113.26 -177.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.518 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.8 tm? -60.06 -37.51 80.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.823 -0.688 . . . . 0.0 110.27 177.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.77 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -79.43 -36.07 39.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.565 -178.653 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 59.02 -11.7 0.02 OUTLIER Glycine 0 CA--C 1.525 0.698 0 N-CA-C 115.507 0.963 . . . . 0.0 115.507 177.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.545 HG22 ' HG2' ' A' ' 22' ' ' GLN . 28.0 m -119.15 120.59 37.56 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 118.602 1.201 . . . . 0.0 112.38 -178.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.512 ' HB2' ' HB2' ' A' ' 14' ' ' CYS . . . -86.77 107.2 18.16 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.313 179.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.545 ' HG2' HG22 ' A' ' 20' ' ' THR . 29.7 mm-40 -126.14 -169.45 2.02 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.092 0.472 . . . . 0.0 111.724 -178.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 4.4 t -143.67 138.04 28.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.747 -179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.8 t -157.15 173.47 16.93 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.932 0.396 . . . . 0.0 111.215 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.98 166.23 11.54 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.691 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.6 t -125.67 156.99 38.42 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.681 -179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -84.76 -169.81 2.82 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.194 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.548 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.6 m -61.42 -44.81 99.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.557 -179.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.548 ' HG ' HG23 ' A' ' 28' ' ' VAL . 27.0 mt -79.74 -20.27 46.77 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 111.665 0.246 . . . . 0.0 111.665 -179.037 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.35 -15.42 32.72 Favored Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.596 -0.812 . . . . 0.0 113.485 179.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 31.0 t -101.77 108.1 22.97 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 CA-C-N 117.241 0.52 . . . . 0.0 111.124 179.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . 179.52 168.0 1.11 Allowed 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.044 0.45 . . . . 0.0 111.451 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -132.84 64.21 1.62 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.617 -0.719 . . . . 0.0 109.609 179.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 1.9 mt -91.51 131.33 37.03 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.526 -178.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 52.14 83.23 0.06 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.956 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 56.4 m -108.08 131.9 54.13 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.338 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -153.65 -178.03 6.76 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.879 0.371 . . . . 0.0 111.29 -179.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.3 p30 -77.96 140.51 62.38 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.633 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -90.72 111.17 0.38 Allowed 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 122.953 2.436 . . . . 0.0 111.909 179.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -90.71 113.78 0.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.664 0 C-N-CA 121.903 1.736 . . . . 0.0 112.866 -179.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.439 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.99 -178.73 1.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.651 178.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.8 m -107.01 88.28 2.7 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.4 mt -62.51 122.85 16.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.482 -178.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.486 ' HB3' ' ND1' ' A' ' 48' ' ' HIS . . . -120.77 -33.62 3.75 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.764 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.465 ' H ' ' HB3' ' A' ' 48' ' ' HIS . 6.9 p30 -163.48 -179.16 6.3 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.134 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -50.08 -60.03 3.33 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.289 -0.414 . . . . 0.0 112.025 -179.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 23.2 m -60.11 -37.78 81.01 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.756 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.486 ' ND1' ' HB3' ' A' ' 44' ' ' ALA . 1.6 t60 -61.27 -33.11 73.0 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.904 179.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.411 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 18.3 t80 -68.78 -33.6 74.14 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.042 179.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -69.29 -41.58 76.6 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.025 178.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 52.1 m -64.36 -17.47 63.75 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.237 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.439 HG23 ' CB ' ' A' ' 41' ' ' ALA . 50.8 m -71.37 -42.1 68.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.443 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 23.0 m -84.59 -30.43 25.01 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.657 -179.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.83 -19.71 63.45 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.635 0.731 . . . . 0.0 109.631 -179.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -68.56 -39.72 80.92 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.286 -179.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 23.4 pt -100.57 1.41 10.51 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.24 39.56 5.67 Favored Glycine 0 CA--C 1.522 0.516 0 C-N-CA 120.294 -0.955 . . . . 0.0 113.443 179.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -145.96 -174.13 4.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.814 0.307 . . . . 0.0 110.807 179.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 23.9 mtm180 -119.73 156.45 30.53 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.89 0.376 . . . . 0.0 111.184 -179.416 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.411 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -85.49 122.87 30.25 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.645 -179.064 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -144.14 129.67 19.04 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 120.947 0.404 . . . . 0.0 110.546 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.689 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 11.9 t -98.5 109.67 22.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.732 -179.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.539 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 91.9 m -101.07 145.75 28.34 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.308 0.575 . . . . 0.0 112.493 -178.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.77 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -95.25 148.42 5.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 115.183 -0.917 . . . . 0.0 110.495 179.704 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.431 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.5 mt -49.24 140.64 12.38 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.398 -179.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.501 ' O ' HD13 ' A' ' 67' ' ' ILE . 34.1 Cg_exo -59.79 139.65 89.47 Favored 'Trans proline' 0 C--N 1.35 0.655 0 C-N-CA 122.734 2.289 . . . . 0.0 112.327 -179.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.501 HD13 ' O ' ' A' ' 66' ' ' PRO . 30.2 mm -131.95 110.12 16.38 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.476 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -53.48 111.89 0.8 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.092 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 122.65 -2.96 10.17 Favored Glycine 0 C--N 1.335 0.485 0 C-N-CA 120.607 -0.806 . . . . 0.0 113.089 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -149.7 165.42 32.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.269 0.557 . . . . 0.0 111.163 -179.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -78.87 169.85 17.59 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.577 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.406 HG23 ' O ' ' A' ' 72' ' ' ILE . 17.2 tt -82.85 121.69 36.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.152 0.501 . . . . 0.0 110.613 179.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.537 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.7 mm? -90.49 124.64 35.16 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.466 -179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -160.27 135.84 8.22 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.217 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -159.51 162.37 35.48 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.741 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 53.1 m -82.82 136.31 44.74 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.862 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -85.74 140.88 7.26 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 122.577 2.184 . . . . 0.0 112.653 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 63.12 3.69 1.36 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.664 179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.94 38.04 60.31 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.485 179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 35.6 mt . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.232 -0.889 . . . . 0.0 111.049 179.992 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.496 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 57.8 m . . . . . 0 N--CA 1.486 1.361 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.496 ' HD2' ' N ' ' A' ' 1' ' ' SER . 17.8 Cg_endo -59.35 112.46 1.24 Allowed 'Trans proline' 0 C--N 1.356 0.938 0 C-N-CA 122.059 1.839 . . . . 0.0 112.369 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -145.58 98.92 3.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.163 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -106.15 -30.36 9.28 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.979 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 24.3 mmt -108.74 -4.09 17.26 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.778 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -98.39 -164.02 1.1 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.67 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.691 ' H ' ' HD2' ' A' ' 7' ' ' ARG . 0.0 OUTLIER -50.47 119.86 4.12 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-O 121.03 0.443 . . . . 0.0 111.329 -179.835 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -52.17 145.28 10.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.085 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.593 HG22 ' HD2' ' A' ' 10' ' ' PRO . 0.8 OUTLIER -90.88 154.34 45.38 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.921 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.593 ' HD2' HG22 ' A' ' 9' ' ' VAL . 86.3 Cg_exo -44.68 126.35 7.1 Favored 'Trans proline' 0 C--N 1.348 0.524 0 C-N-CA 122.92 2.414 . . . . 0.0 112.687 179.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -55.25 157.12 3.74 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.974 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 40.5 m -130.57 91.81 36.73 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.138 -179.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.493 ' HB2' ' HB2' ' A' ' 21' ' ' ALA . 89.7 Cg_endo -72.9 177.24 7.94 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.916 2.411 . . . . 0.0 112.521 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.488 ' C ' ' O ' ' A' ' 13' ' ' PRO . 23.1 p -15.98 115.17 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.33 0 O-C-N 123.969 0.793 . . . . 0.0 112.241 -179.605 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 77.0 p -95.32 117.96 31.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.27 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 172.25 -166.79 39.65 Favored Glycine 0 N--CA 1.441 -1.031 0 C-N-CA 120.551 -0.833 . . . . 0.0 113.161 -177.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.523 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.7 tm? -56.86 -37.21 70.99 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.764 -0.718 . . . . 0.0 110.591 177.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.746 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 0.1 OUTLIER -80.91 -38.9 27.13 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.404 0.621 . . . . 0.0 111.375 -178.551 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 56.72 -8.18 0.01 OUTLIER Glycine 0 CA--C 1.527 0.805 0 CA-C-N 114.671 -1.149 . . . . 0.0 115.739 176.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.541 HG22 ' HG2' ' A' ' 22' ' ' GLN . 18.1 m -115.69 126.12 53.7 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 118.658 1.229 . . . . 0.0 112.996 -178.024 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.493 ' HB2' ' HB2' ' A' ' 13' ' ' PRO . . . -87.43 104.89 16.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.087 179.051 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.541 ' HG2' HG22 ' A' ' 20' ' ' THR . 29.4 mm-40 -128.25 -169.41 2.06 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.126 0.488 . . . . 0.0 111.69 -178.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 1.9 t -139.68 140.73 36.94 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.974 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -161.86 155.86 21.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.085 0.469 . . . . 0.0 111.285 -179.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.521 ' HB3' ' HB2' ' A' ' 34' ' ' LEU . . . -79.5 166.46 21.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.594 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 13.0 t -134.74 158.21 44.72 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.426 ' HB3' ' HB2' ' A' ' 32' ' ' ALA . 1.6 p-10 -77.33 -168.89 1.23 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.007 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.588 HG23 ' HG ' ' A' ' 29' ' ' LEU . 11.0 m -65.24 -44.67 95.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.632 -179.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.588 ' HG ' HG23 ' A' ' 28' ' ' VAL . 29.1 mt -78.16 -19.29 54.28 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -178.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.77 -15.44 31.62 Favored Glycine 0 CA--C 1.521 0.416 0 C-N-CA 120.541 -0.838 . . . . 0.0 113.697 179.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.5 t -101.68 108.14 23.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 117.302 0.551 . . . . 0.0 111.181 179.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.426 ' HB2' ' HB3' ' A' ' 27' ' ' ASP . . . 179.51 171.33 1.0 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.124 0.488 . . . . 0.0 111.322 179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -139.41 93.45 2.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.769 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.521 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 1.7 mt -125.08 134.67 52.41 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.548 -178.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.3 t70 52.94 86.24 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.198 179.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 m -108.46 133.93 51.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.964 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -156.32 -178.09 7.07 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.937 -179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -83.31 138.21 42.06 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.541 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -90.1 114.56 0.54 Allowed 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.814 2.343 . . . . 0.0 111.928 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -90.44 114.0 0.48 Allowed 'Trans proline' 0 N--CA 1.456 -0.69 0 C-N-CA 121.982 1.788 . . . . 0.0 112.783 -179.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.42 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.48 -179.28 1.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.532 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.6 m -108.2 88.12 2.66 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 177.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.5 mt -61.41 123.18 17.08 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.284 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.64 -40.61 2.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.906 179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -152.92 -168.36 3.01 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.045 179.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.501 ' HB1' ' HG ' ' A' ' 80' ' ' LEU . . . -64.94 -44.05 90.72 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.257 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 41.3 m -70.4 -41.94 72.31 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.798 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -60.49 -33.85 73.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.118 0.485 . . . . 0.0 109.856 179.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -69.27 -35.76 76.41 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.975 179.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -67.02 -32.12 73.13 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.216 179.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 24.5 t -76.2 -12.89 60.17 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.776 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.42 HG23 ' CB ' ' A' ' 41' ' ' ALA . 52.4 m -73.81 -40.93 63.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.075 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 7.4 m -86.16 -31.95 21.52 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.51 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.8 -19.93 63.47 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.659 0.742 . . . . 0.0 109.825 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -65.03 -39.22 93.04 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.514 -1.221 . . . . 0.0 111.925 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 3.4 pt -103.34 0.79 10.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 -179.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.18 43.13 3.09 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 120.318 -0.944 . . . . 0.0 113.58 178.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -150.63 -175.03 4.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 117.097 0.448 . . . . 0.0 110.995 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 62.2 mtt180 -120.66 153.99 36.12 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.976 0.417 . . . . 0.0 111.122 -179.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -76.59 126.2 30.56 Favored 'General case' 0 CA--C 1.528 0.108 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.241 -179.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.3 ptm180 -149.64 155.41 40.2 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 121.044 0.45 . . . . 0.0 110.925 179.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.626 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 33.6 t -121.44 104.76 9.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.18 -179.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . 0.543 ' C ' ' HB3' ' A' ' 18' ' ' TYR . 5.0 m -109.95 145.0 37.65 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -178.197 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.746 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.3 OUTLIER -90.81 146.02 6.71 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.742 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.463 ' HA ' ' HD3' ' A' ' 66' ' ' PRO . 10.5 mt -49.95 138.65 18.38 Favored Pre-proline 0 CA--C 1.531 0.219 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.451 -179.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 65' ' ' LEU . 27.3 Cg_exo -62.65 138.53 70.29 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.589 2.193 . . . . 0.0 112.556 -179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.41 HD13 ' O ' ' A' ' 66' ' ' PRO . 50.3 mm -130.82 108.4 15.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.658 179.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -49.65 109.98 0.33 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.266 -179.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 128.14 -12.46 6.42 Favored Glycine 0 C--N 1.332 0.307 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.643 179.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -136.95 168.9 18.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.416 0.627 . . . . 0.0 111.25 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -82.22 166.82 19.26 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 114.81 -1.086 . . . . 0.0 110.113 179.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 18.6 tt -83.44 124.49 39.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-O 121.065 0.459 . . . . 0.0 110.995 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.619 ' O ' HG12 ' A' ' 64' ' ' VAL . 4.0 mm? -98.94 113.7 25.98 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.705 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 43.6 t -161.55 138.67 8.65 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.623 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -159.93 163.3 34.34 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.95 179.793 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 91.3 m -90.2 126.62 56.29 Favored Pre-proline 0 CA--C 1.531 0.218 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.182 -179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -53.57 108.89 0.3 Allowed 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.679 2.252 . . . . 0.0 113.178 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 53.82 34.06 18.39 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.55 179.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 62.49 20.95 61.92 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.924 179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.685 HD13 ' O ' ' A' ' 80' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--O 1.246 0.87 0 CA-C-O 118.775 -0.631 . . . . 0.0 111.063 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 54.0 m . . . . . 0 N--CA 1.485 1.296 0 CA-C-O 120.615 0.245 . . . . 0.0 110.969 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -57.4 110.52 0.62 Allowed 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.689 2.26 . . . . 0.0 112.229 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.552 ' HB1' ' HB2' ' A' ' 6' ' ' GLU . . . -102.06 99.35 9.49 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.308 -179.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -96.26 -22.35 17.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.828 179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' MET . . . . . . . . . . . . . 15.0 ptm -110.61 -38.84 5.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.622 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.552 ' HB2' ' HB1' ' A' ' 3' ' ' ALA . 19.1 mt-10 -63.16 -43.16 99.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.277 -179.723 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 7.2 ptm180 -166.71 86.67 0.3 Allowed 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.775 0.798 . . . . 0.0 110.731 -179.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -51.11 144.56 8.92 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.86 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.609 HG13 ' HD2' ' A' ' 10' ' ' PRO . 4.0 t -86.29 141.31 34.72 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.004 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.609 ' HD2' HG13 ' A' ' 9' ' ' VAL . 68.4 Cg_exo -31.3 121.45 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 124.006 3.137 . . . . 0.0 113.366 -179.176 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -47.95 144.55 3.5 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.028 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 97.6 m -156.74 97.38 2.13 Favored Pre-proline 0 C--N 1.331 -0.218 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.359 -179.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -78.47 166.14 24.43 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.673 2.249 . . . . 0.0 112.387 179.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 48.15 -163.14 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.318 0.58 . . . . 0.0 111.946 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.585 ' O ' ' O ' ' A' ' 16' ' ' GLY . 14.0 m -133.36 -157.57 0.82 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.397 -0.82 . . . . 0.0 112.711 -179.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . 0.585 ' O ' ' O ' ' A' ' 15' ' ' SER . . . -19.42 -149.78 0.0 OUTLIER Glycine 0 CA--C 1.532 1.096 0 N-CA-C 119.084 2.394 . . . . 0.0 119.084 -179.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 17' ' ' LEU . 1.2 tm? -23.21 -43.13 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 115.444 1.646 . . . . 0.0 115.444 -177.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.726 ' HA ' ' HB ' ' A' ' 64' ' ' VAL . 3.7 m-85 -68.55 -35.92 78.08 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.207 -0.597 . . . . 0.0 112.208 -176.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.31 -10.98 0.01 OUTLIER Glycine 0 CA--C 1.527 0.816 0 N-CA-C 115.554 0.982 . . . . 0.0 115.554 176.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.425 ' H ' ' C ' ' A' ' 18' ' ' TYR . 32.5 m -125.13 145.9 49.73 Favored 'General case' 0 N--CA 1.462 0.154 0 CA-C-N 118.591 1.196 . . . . 0.0 112.162 -178.163 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -111.73 109.15 18.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.794 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.597 ' HA ' HE21 ' A' ' 22' ' ' GLN . 0.1 OUTLIER -129.07 -172.03 2.63 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.153 0.501 . . . . 0.0 111.673 -178.787 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.403 ' O ' ' HA ' ' A' ' 36' ' ' CYS . 2.1 t -135.93 105.59 6.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.79 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.458 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 2.3 m -126.76 151.8 47.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.964 0.411 . . . . 0.0 111.712 -178.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -89.32 166.37 13.8 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.046 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 6.9 t -121.76 157.21 31.51 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -179.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -86.18 -170.26 3.01 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.418 -179.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.553 HG23 ' HG ' ' A' ' 29' ' ' LEU . 6.4 m -61.1 -45.12 99.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.407 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.553 ' HG ' HG23 ' A' ' 28' ' ' VAL . 24.0 mt -79.9 -20.72 45.14 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.606 0.241 . . . . 0.0 111.446 -179.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 108.63 -18.07 32.65 Favored Glycine 0 CA--C 1.524 0.626 0 C-N-CA 120.674 -0.774 . . . . 0.0 113.7 179.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.427 ' O ' ' HB2' ' A' ' 32' ' ' ALA . 39.5 t -101.96 107.72 22.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 117.497 0.649 . . . . 0.0 111.058 179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.427 ' HB2' ' O ' ' A' ' 31' ' ' VAL . . . 174.81 171.16 0.25 Allowed 'General case' 0 C--O 1.232 0.146 0 CA-C-O 121.029 0.442 . . . . 0.0 111.401 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -133.15 85.71 2.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.585 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.4 mt -109.03 137.01 47.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.043 -178.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 18.6 t70 41.63 81.23 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.075 178.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.458 ' HB2' ' HB3' ' A' ' 24' ' ' CYS . 49.1 t -128.03 139.76 52.36 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.342 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -155.71 -173.19 4.43 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.243 -179.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -64.93 133.1 95.66 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.85 179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . 0.479 ' HD3' HE21 ' A' ' 22' ' ' GLN . 90.7 Cg_endo -90.46 110.04 0.38 Allowed 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.89 2.393 . . . . 0.0 111.922 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -90.75 115.13 0.47 Allowed 'Trans proline' 0 N--CA 1.457 -0.636 0 C-N-CA 122.24 1.96 . . . . 0.0 112.887 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.414 ' CB ' HG23 ' A' ' 52' ' ' THR . . . -175.05 -179.14 1.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.784 178.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 34.9 m -105.87 88.52 2.83 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 177.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.15 123.18 19.19 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.449 -178.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -119.9 -40.64 2.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.826 179.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -151.49 -168.23 3.03 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.037 179.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.64 -49.8 71.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.415 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.8 m -65.17 -40.81 94.8 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.806 -179.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -60.65 -32.34 71.51 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.814 179.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.49 ' CE2' ' HB1' ' A' ' 60' ' ' ALA . 18.5 t80 -69.37 -37.95 77.83 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.938 178.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -64.0 -41.19 97.57 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.954 178.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 49.4 m -64.44 -20.06 65.93 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.416 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.414 HG23 ' CB ' ' A' ' 41' ' ' ALA . 51.8 m -69.52 -39.18 77.68 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.534 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.401 ' HB3' ' C ' ' A' ' 58' ' ' GLN . 2.5 m -87.72 -32.6 19.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.816 -179.305 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -69.21 -19.37 63.96 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.674 0.749 . . . . 0.0 109.686 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -66.5 -39.11 88.51 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.399 -1.273 . . . . 0.0 112.446 -179.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 5.9 pt -105.85 3.03 10.32 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.71 42.7 3.06 Favored Glycine 0 CA--C 1.523 0.563 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.784 178.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.401 ' C ' ' HB3' ' A' ' 53' ' ' CYS . 36.8 mt-30 -151.32 -174.56 4.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 117.041 0.421 . . . . 0.0 110.717 179.411 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.2 mtp180 -125.47 153.79 43.0 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.798 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.49 ' HB1' ' CE2' ' A' ' 49' ' ' PHE . . . -67.66 118.83 11.46 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.005 -179.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.7 mmm180 -130.48 123.79 30.51 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.855 0.359 . . . . 0.0 110.52 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.678 ' SG ' ' HB2' ' A' ' 18' ' ' TYR . 3.4 t -96.31 107.68 20.07 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 57.8 m -105.78 151.03 24.98 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.538 0.685 . . . . 0.0 112.635 -178.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.726 ' HB ' ' HA ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -105.3 150.33 8.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 114.802 -1.09 . . . . 0.0 110.483 179.569 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.484 HD12 ' HD2' ' A' ' 66' ' ' PRO . 1.2 tp -50.35 122.76 15.83 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.137 -179.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.484 ' HD2' HD12 ' A' ' 65' ' ' LEU . 24.3 Cg_exo -65.31 139.53 60.28 Favored 'Trans proline' 0 C--N 1.355 0.921 0 C-N-CA 122.481 2.121 . . . . 0.0 112.516 -179.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.438 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 48.2 mm -131.38 112.63 21.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.486 179.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -46.93 108.91 0.16 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.792 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 129.94 -14.56 5.71 Favored Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.525 -179.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 3.2 pt20 -129.07 166.55 19.03 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.534 0.683 . . . . 0.0 111.265 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -82.49 162.21 22.13 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.225 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.408 HG12 ' SG ' ' A' ' 74' ' ' CYS . 17.0 tt -83.35 121.02 35.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 121.138 0.494 . . . . 0.0 111.004 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.52 ' HB2' ' CG1' ' A' ' 64' ' ' VAL . 3.9 mm? -95.13 107.92 20.01 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.959 -179.581 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.408 ' SG ' HG12 ' A' ' 72' ' ' ILE . 69.7 m -144.79 130.35 18.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.11 -179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -160.37 161.91 33.24 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.879 0.371 . . . . 0.0 110.86 179.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 86.5 m -85.97 135.24 37.72 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.163 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -86.04 142.42 7.59 Favored 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.736 2.29 . . . . 0.0 112.644 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . 65.17 1.54 1.58 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.842 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 71.14 36.57 64.0 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.405 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 50.7 mt . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.253 -0.879 . . . . 0.0 111.012 179.801 . . . . . . . . 0 0 . 1 stop_ save_