data_6qk6_residue ############################ # Computer software used # ############################ 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 6qk6 _Structure_validation_residue.Date_analyzed 2019-12-13 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 ' 9' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 98.5 mttt . . . . . 0 N--CA 1.446 -0.659 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 68.4 m -69.47 156.48 38.8 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.008 0.432 . . . . 0.0 110.344 177.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 65.2 p -92.71 169.24 10.64 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.071 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.8 m -73.99 -11.27 60.29 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.85 -42.96 18.88 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.25 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.419 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 44.8 t -69.84 -23.42 63.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.325 0.583 . . . . 0.0 110.582 178.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -85.78 5.37 32.75 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.991 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.8 t -110.04 156.88 19.94 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.93 -0.766 . . . . 0.0 108.93 177.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.448 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 6.7 pt-20 -126.17 126.67 24.74 Favored Pre-proline 0 C--N 1.322 -0.604 0 C-N-CA 121.084 -0.246 . . . . 0.0 110.361 177.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.448 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 11.7 Cg_exo -68.8 170.93 51.78 Favored 'Cis proline' 0 C--N 1.346 0.425 0 C-N-CA 123.236 -1.568 . . . . 0.0 111.98 0.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t -60.09 116.74 4.4 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.645 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -86.23 8.69 20.15 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.433 -176.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 79.7 m -78.5 6.46 8.54 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.663 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.08 -20.62 65.04 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.962 -0.637 . . . . 0.0 111.61 177.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.5 m -143.37 23.55 1.81 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.055 0.455 . . . . 0.0 110.325 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 87.0 tttt -170.89 81.71 0.08 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.161 -178.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.3 t -121.42 138.63 54.19 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.837 0.351 . . . . 0.0 111.15 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -153.48 20.98 0.55 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.659 -0.701 . . . . 0.0 109.967 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 70.9 m -68.53 146.85 52.74 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -175.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.88 -146.42 16.75 Favored Glycine 0 N--CA 1.442 -0.949 0 CA-C-N 114.939 -1.028 . . . . 0.0 113.227 -178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.414 ' H ' ' CD ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -75.74 -38.63 58.3 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 122.42 0.288 . . . . 0.0 111.65 -177.433 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.83 60.19 2.99 Favored Glycine 0 C--O 1.223 -0.561 0 C-N-CA 121.267 -0.492 . . . . 0.0 112.931 -178.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 35.7 t -153.81 111.3 3.48 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.887 0.375 . . . . 0.0 110.194 179.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 t -103.92 17.48 24.0 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.81 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.7 t -74.93 107.09 6.78 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.738 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.9 -10.34 56.62 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.664 -178.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.22 -36.36 83.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.91 0.386 . . . . 0.0 110.592 178.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 6.7 p -116.69 -15.2 10.79 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.792 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp -92.43 132.56 36.68 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.116 0.484 . . . . 0.0 111.561 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.0 t -136.25 153.61 51.15 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 177.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.9 t -147.43 154.36 40.73 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.59 0.233 . . . . 0.0 110.476 -178.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -112.73 -14.8 13.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.619 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 83.9 m -67.77 138.82 56.49 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 176.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.6 p -97.65 171.15 8.52 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.426 -171.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.5 m -71.49 -17.06 62.37 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -176.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -76.6 -21.67 55.26 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.931 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . 0.401 ' O ' ' HE2' ' A' ' 47' ' ' LYS . . . 166.66 156.33 9.54 Favored Glycine 0 N--CA 1.434 -1.465 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.237 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 44.1 t -69.47 145.35 52.81 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.401 ' HE2' ' O ' ' A' ' 45' ' ' GLY . 71.8 mmtt -111.83 -35.92 5.58 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.691 0.282 . . . . 0.0 111.531 -177.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.417 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 2.8 p -76.99 -39.67 49.56 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.97 -177.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.87 4.4 19.05 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.657 -0.782 . . . . 0.0 113.468 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.417 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 11.3 mmpt? -90.39 3.32 54.14 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 117.231 0.516 . . . . 0.0 110.373 178.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 63.95 61.45 0.95 Allowed 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.842 -179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 9.5 p -136.92 145.26 44.07 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.238 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.5 p -132.04 70.15 1.47 Allowed 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.519 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 102.91 164.95 25.94 Favored Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.522 -0.846 . . . . 0.0 112.014 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -61.28 -11.68 20.3 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 C-N-CA 123.555 2.836 . . . . 0.0 113.221 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -69.97 -24.02 63.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.998 0.428 . . . . 0.0 111.321 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.6 m -144.79 29.77 1.21 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.058 0.456 . . . . 0.0 110.57 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 37.5 t -85.87 109.14 18.51 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.032 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 51.5 mttp -73.04 -25.15 60.83 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.659 0.742 . . . . 0.0 109.206 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.9 m -64.52 124.32 21.54 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 114.645 -1.161 . . . . 0.0 111.844 -176.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -97.38 56.38 1.22 Allowed Glycine 0 N--CA 1.443 -0.884 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 41.2 m 68.07 176.32 0.26 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.108 0.563 . . . . 0.0 111.116 -178.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.1 t 65.11 19.48 11.8 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 122.682 0.393 . . . . 0.0 111.658 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . 0.437 ' SG ' ' N ' ' A' ' 65' ' ' SER . 50.0 t -108.25 173.35 6.36 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.854 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.437 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 9.5 m -61.33 -37.73 84.33 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 122.878 0.471 . . . . 0.0 111.863 -178.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.503 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 31.9 p -84.51 17.41 2.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.995 0.426 . . . . 0.0 111.153 -178.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.503 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 43.0 mmtm . . . . . 0 C--O 1.263 1.763 0 CA-C-O 117.704 -1.141 . . . . 0.0 110.809 -179.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp . . . . . 0 CA--C 1.513 -0.453 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.0 m -76.35 153.66 35.63 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-O 121.422 0.629 . . . . 0.0 111.831 -179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.54 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 43.4 p -90.89 174.28 7.53 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.281 -177.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 m -69.85 -27.87 65.2 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.41 ' HB1' ' C ' ' A' ' 20' ' ' GLN . . . -68.6 -41.11 80.03 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.278 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 44.4 t -70.82 -26.49 63.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.038 0.447 . . . . 0.0 110.255 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.54 ' HG3' ' O ' ' A' ' 11' ' ' THR . 22.2 mtm180 -82.01 -7.94 59.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.191 0.519 . . . . 0.0 110.126 178.202 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 49.0 m -91.87 156.22 17.65 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.371 178.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.432 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 7.5 pt-20 -132.04 125.75 20.26 Favored Pre-proline 0 C--N 1.311 -1.074 0 CA-C-O 120.689 0.28 . . . . 0.0 111.219 -178.472 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.432 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 55.3 Cg_endo -69.3 168.66 64.95 Favored 'Cis proline' 0 C--N 1.349 0.574 0 C-N-CA 123.159 -1.6 . . . . 0.0 112.001 -0.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.2 t -53.61 128.59 29.8 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.41 ' C ' ' HB1' ' A' ' 13' ' ' ALA . 31.0 mm-40 -108.14 19.74 19.56 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.189 -0.46 . . . . 0.0 112.031 -175.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 58.7 m -82.5 9.7 8.74 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -177.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.57 123.19 13.22 Favored Glycine 0 N--CA 1.442 -0.908 0 C-N-CA 120.63 -0.795 . . . . 0.0 111.376 177.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.1 m 72.74 1.83 4.14 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.439 0.696 . . . . 0.0 111.91 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -162.95 80.45 0.48 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 121.182 0.515 . . . . 0.0 110.471 177.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 47.4 t -112.62 137.22 51.18 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.365 177.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -136.95 17.95 3.02 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.973 -177.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 96.4 m -67.31 152.89 44.91 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.385 179.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.2 -144.55 5.64 Favored Glycine 0 N--CA 1.44 -1.035 0 C-N-CA 120.566 -0.826 . . . . 0.0 112.708 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.12 -18.44 23.54 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-O 121.007 0.432 . . . . 0.0 111.194 -179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -94.57 74.18 1.02 Allowed Glycine 0 N--CA 1.44 -1.088 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.04 178.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.405 ' O ' ' HD2' ' A' ' 37' ' ' LYS . 45.0 t -146.04 119.48 9.04 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.045 0.45 . . . . 0.0 109.917 177.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.8 t -102.66 14.74 31.2 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.057 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.3 t -76.56 118.88 19.66 Favored 'General case' 0 N--CA 1.461 0.122 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.97 -14.91 62.93 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -177.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.8 -52.43 30.21 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -178.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 6.1 p -99.0 -17.57 18.22 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -177.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.405 ' HD2' ' O ' ' A' ' 31' ' ' CYS . 87.9 tttt -87.49 116.06 25.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.073 0.463 . . . . 0.0 111.095 179.237 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.8 t -125.95 -176.68 3.7 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.42 178.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.2 t -160.24 139.29 10.69 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 -89.53 -18.51 26.51 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.558 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 71.9 m -70.67 153.86 42.41 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.358 0.599 . . . . 0.0 111.464 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.7 p -127.5 -169.56 2.07 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.749 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 47.5 m -76.47 7.95 3.96 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.215 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.65 -34.14 77.19 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 175.184 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 123.06 52.42 0.21 Allowed Glycine 0 N--CA 1.438 -1.228 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.775 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 47.8 t 70.45 151.68 0.1 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.377 0.608 . . . . 0.0 111.27 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.2 tmtp? -123.25 -50.45 1.9 Allowed 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.767 -177.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 28.6 p -73.91 -35.34 64.62 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.911 -178.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.41 18.69 6.52 Favored Glycine 0 CA--C 1.522 0.481 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.914 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -101.49 9.46 41.34 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 122.648 -0.324 . . . . 0.0 111.58 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 66.84 34.99 5.14 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.409 0.684 . . . . 0.0 111.457 177.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 3.5 p -111.74 148.3 33.79 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.312 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.5 p -136.04 37.72 2.78 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-O 121.243 0.544 . . . . 0.0 111.509 -177.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.01 157.44 7.23 Favored Glycine 0 C--O 1.219 -0.807 0 C-N-CA 120.516 -0.849 . . . . 0.0 111.998 -178.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -45.31 -55.81 3.21 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.985 3.123 . . . . 0.0 114.971 -178.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -67.18 -35.37 79.51 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.906 0.384 . . . . 0.0 111.094 -177.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.2 m -89.45 9.92 24.63 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.01 -178.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 43.7 t -89.8 134.02 34.4 Favored 'General case' 0 N--CA 1.435 -1.202 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.136 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 47.8 mttt -101.19 -4.97 26.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.32 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.3 m -87.63 152.69 21.97 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.815 -174.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -81.84 -165.34 35.29 Favored Glycine 0 N--CA 1.44 -1.069 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.7 p -82.02 -17.01 48.26 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 117.1 0.45 . . . . 0.0 110.782 -178.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.1 t -99.47 69.05 1.63 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 121.269 0.557 . . . . 0.0 110.307 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 14.4 t -138.99 166.78 23.6 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.984 178.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -69.11 -26.33 64.86 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.321 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.714 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 11.8 p -84.09 6.53 21.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.008 0.432 . . . . 0.0 110.353 179.205 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.714 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 30.1 mmtp . . . . . 0 C--O 1.263 1.779 0 CA-C-O 117.601 -1.19 . . . . 0.0 110.355 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.542 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 5.6 mptt . . . . . 0 N--CA 1.445 -0.683 0 CA-C-O 120.473 0.178 . . . . 0.0 111.164 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.5 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 37.8 m -62.8 143.42 57.55 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-O 121.174 0.511 . . . . 0.0 111.38 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.417 ' CG2' ' HB2' ' A' ' 26' ' ' GLN . 40.8 p -90.12 168.67 11.79 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.341 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.7 m -72.35 -14.84 61.83 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.384 0.611 . . . . 0.0 109.499 175.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.14 -35.43 42.06 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.492 177.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.3 t -76.2 -16.47 59.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.682 177.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -86.17 4.72 37.32 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.228 176.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.2 t -114.08 153.54 29.28 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.714 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.478 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -130.82 127.01 22.07 Favored Pre-proline 0 C--N 1.315 -0.893 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.264 -178.701 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.478 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 36.6 Cg_endo -66.24 164.51 65.51 Favored 'Cis proline' 0 C--O 1.242 0.69 0 C-N-CA 123.341 -1.524 . . . . 0.0 111.996 -1.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.488 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 33.9 t -53.73 128.08 28.22 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.091 -178.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -98.6 22.77 9.45 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.573 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.507 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 89.9 m -96.67 22.33 8.25 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.59 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.26 -40.95 77.7 Favored Glycine 0 CA--C 1.52 0.363 0 C-N-CA 121.282 -0.485 . . . . 0.0 113.162 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.9 t -144.36 2.07 1.1 Allowed 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.956 0.408 . . . . 0.0 110.803 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -114.82 21.24 14.54 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.061 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.402 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 49.8 t -65.41 144.74 56.87 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.34 0.59 . . . . 0.0 112.042 -176.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.417 ' HB2' ' CG2' ' A' ' 11' ' ' THR . 34.2 mt-30 -147.34 16.17 1.16 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.378 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.542 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 79.9 m -68.82 171.3 8.1 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.435 0.636 . . . . 0.0 112.364 -177.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -115.78 -151.51 9.83 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.874 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -83.82 -18.18 38.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.022 0.411 . . . . 0.0 110.614 179.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.23 42.34 2.74 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 121.091 -0.576 . . . . 0.0 111.926 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.4 t -127.58 126.55 42.31 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-O 121.085 0.469 . . . . 0.0 109.969 -179.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 t -102.57 4.4 38.4 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.501 0.667 . . . . 0.0 110.029 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 35.1 t -82.24 116.0 21.57 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.601 -178.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.86 -0.77 49.73 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.309 -179.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.26 -42.26 69.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.996 0.427 . . . . 0.0 110.697 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.507 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 5.7 p -101.33 -39.93 7.36 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.126 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -73.15 99.99 2.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.105 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.1 t -114.5 -179.13 3.54 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.276 179.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.426 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 34.1 t -163.34 136.2 5.45 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 122.835 0.454 . . . . 0.0 109.803 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -92.58 -15.99 26.23 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.491 ' SG ' ' HB2' ' A' ' 47' ' ' LYS . 88.8 m -69.15 147.4 51.43 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.205 0.526 . . . . 0.0 111.215 178.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 16.5 p -123.32 179.43 4.72 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.474 -175.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.4 m -66.27 -5.25 9.8 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.897 -179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -58.79 -35.23 72.47 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 120.87 0.367 . . . . 0.0 110.213 177.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 136.99 50.62 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.24 -0.981 . . . . 0.0 113.152 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 44.4 t 66.4 166.69 0.21 Allowed 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 120.944 0.402 . . . . 0.0 111.165 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.491 ' HB2' ' SG ' ' A' ' 41' ' ' CYS . 98.1 mttt -139.92 -46.62 0.44 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.849 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.53 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 20.8 p -73.7 -34.61 64.92 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.458 -177.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.73 21.95 4.86 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.502 -0.856 . . . . 0.0 113.136 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.53 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 75.1 mmtt -107.19 6.5 28.77 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.921 0.361 . . . . 0.0 110.463 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 62.5 26.42 15.72 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.979 0.912 . . . . 0.0 111.368 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 11.6 p -95.91 151.77 19.11 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.441 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.9 p -138.19 80.95 1.83 Allowed 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.196 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 88.79 160.26 36.11 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.545 -0.835 . . . . 0.0 111.703 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.426 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 18.1 Cg_endo -59.3 -21.4 60.28 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.87 2.38 . . . . 0.0 112.788 -178.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.21 -30.11 71.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.87 178.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.3 t -139.54 63.96 1.48 Allowed 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 121.505 0.669 . . . . 0.0 109.314 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.408 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 48.8 t -133.3 132.09 40.96 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.257 -179.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -110.72 -3.25 15.89 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.168 0.509 . . . . 0.0 110.004 178.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.4 m -74.29 137.91 43.22 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.389 -176.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.24 169.77 53.77 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.306 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.3 m -64.94 -12.94 55.29 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -177.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.1 m -101.58 17.65 22.28 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.629 0.252 . . . . 0.0 111.627 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . 0.415 ' SG ' ' N ' ' A' ' 65' ' ' SER . 37.5 t -83.49 172.43 12.42 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 111.357 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.415 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 14.7 m -72.72 -20.37 61.22 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.232 -177.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.475 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 23.4 p -89.93 11.45 20.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.876 0.37 . . . . 0.0 111.002 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.408 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 57.9 mmtt . . . . . 0 C--O 1.269 2.117 0 CA-C-O 117.744 -1.122 . . . . 0.0 110.515 -179.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.594 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 29.8 mmtp . . . . . 0 CA--C 1.51 -0.57 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.3 m -87.07 157.36 19.43 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.368 0.604 . . . . 0.0 111.692 -177.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.588 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 61.7 p -95.31 175.47 6.58 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.694 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.6 m -70.53 -17.43 62.94 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.007 0.432 . . . . 0.0 110.858 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.17 -40.07 53.38 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.024 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 53.1 t -74.72 -23.22 58.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.171 0.51 . . . . 0.0 110.229 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.588 ' HG3' ' O ' ' A' ' 11' ' ' THR . 86.5 mtt180 -77.41 0.23 23.31 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.76 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 t -102.21 158.58 16.07 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -128.87 123.03 21.74 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-O 120.679 0.276 . . . . 0.0 110.707 178.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -71.33 178.61 28.46 Favored 'Cis proline' 0 C--O 1.235 0.375 0 C-N-CA 123.412 -1.495 . . . . 0.0 111.868 -0.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.8 t -61.66 134.66 57.06 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.639 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -115.17 20.62 14.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.742 -176.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.485 ' HB3' ' HB2' ' A' ' 25' ' ' CYS . 81.3 m -81.13 59.76 4.01 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -178.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.69 -57.67 4.44 Favored Glycine 0 C--N 1.302 -1.335 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 176.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.5 m -125.66 5.74 7.49 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.125 0.488 . . . . 0.0 110.378 178.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -113.8 34.33 4.67 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.341 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.485 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 13.8 t -92.95 115.93 28.58 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 120.059 -0.657 . . . . 0.0 111.328 -179.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.522 ' HB2' ' CG2' ' A' ' 11' ' ' THR . 15.2 mm100 -131.23 14.87 5.11 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.203 -0.908 . . . . 0.0 108.905 177.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.594 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 73.9 m -61.61 140.33 58.16 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.976 -177.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.422 ' H ' ' HB3' ' A' ' 9' ' ' LYS . . . -113.98 -164.23 15.2 Favored Glycine 0 C--N 1.312 -0.789 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.105 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.463 ' O ' ' HG3' ' A' ' 9' ' ' LYS . 1.0 OUTLIER -65.72 134.56 53.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.998 0.428 . . . . 0.0 110.209 179.033 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 117.46 -10.52 14.51 Favored Glycine 0 N--CA 1.438 -1.207 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -175.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 47.5 t -80.0 123.94 28.27 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.9 t -106.78 12.14 29.39 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.337 0.589 . . . . 0.0 110.914 -176.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.8 t -82.44 141.12 33.0 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.098 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -100.17 0.86 41.33 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.061 0.458 . . . . 0.0 110.765 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.48 -51.52 9.86 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.507 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 5.1 p -100.04 -19.4 16.55 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -175.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -75.95 131.55 39.67 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.484 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.56 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 10.8 t -133.26 -176.92 4.3 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.44 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 37.4 t -162.12 153.85 18.69 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 122.793 0.437 . . . . 0.0 109.913 -179.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -112.1 -12.5 13.67 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.4 m -78.25 130.03 35.77 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.2 p -103.91 175.8 5.36 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.479 -174.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.4 t -65.39 -7.2 12.68 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.038 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -71.55 -27.44 63.17 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 153.31 155.09 7.0 Favored Glycine 0 N--CA 1.437 -1.243 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.675 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.6 t -74.77 137.72 42.17 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -118.75 -3.58 10.79 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.369 -0.532 . . . . 0.0 112.332 -177.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.615 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 8.0 p -102.53 -35.72 8.64 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.035 -0.666 . . . . 0.0 110.495 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.98 13.83 7.55 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.182 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.635 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 32.5 mmtp -101.1 -1.67 33.45 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 117.077 0.438 . . . . 0.0 110.61 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 67.47 27.93 7.84 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.993 -179.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 25.0 p -99.3 150.94 21.61 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.707 178.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.2 p -142.71 62.03 1.41 Allowed 'General case' 0 C--N 1.312 -1.051 0 CA-C-O 121.146 0.498 . . . . 0.0 110.364 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 124.44 156.05 9.32 Favored Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.362 -0.695 . . . . 0.0 111.362 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.21 -38.66 81.69 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 123.054 2.503 . . . . 0.0 113.435 -177.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.38 -38.54 87.38 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.955 0.407 . . . . 0.0 111.494 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.9 t -98.37 2.75 48.27 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.598 -178.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 54.0 t -92.48 133.53 35.83 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.138 0.495 . . . . 0.0 111.709 -177.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -116.87 11.02 14.3 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.091 179.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.635 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 18.8 m -83.28 157.61 22.56 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.922 -178.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.472 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -88.4 -166.16 42.01 Favored Glycine 0 N--CA 1.437 -1.3 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 175.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.6 m -79.82 -15.38 57.53 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 117.467 0.634 . . . . 0.0 111.774 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.8 m -99.96 73.68 1.76 Allowed 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.887 0.375 . . . . 0.0 110.99 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.2 t -144.71 165.96 26.57 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.929 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 10.0 m -63.38 -28.97 70.35 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.712 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.465 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 16.3 p -92.83 19.29 7.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.076 0.465 . . . . 0.0 110.564 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.56 ' HE3' ' O ' ' A' ' 38' ' ' THR . 48.7 mmtm . . . . . 0 C--O 1.262 1.748 0 CA-C-O 117.681 -1.152 . . . . 0.0 111.041 -179.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 97.9 mttt . . . . . 0 CA--C 1.509 -0.617 0 CA-C-O 121.355 0.597 . . . . 0.0 110.02 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.618 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 38.0 m -74.13 149.44 41.03 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.254 177.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.595 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 61.6 p -77.2 164.26 25.78 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.018 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.0 m -63.15 -24.9 68.1 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.2 -46.47 70.55 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.355 177.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.597 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 47.9 t -70.22 -29.83 66.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.101 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.595 ' HG3' ' O ' ' A' ' 11' ' ' THR . 85.6 mtt180 -70.72 -8.9 55.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.042 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.8 m -90.93 166.41 13.06 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.842 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -132.25 120.47 17.09 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-O 120.47 0.176 . . . . 0.0 110.985 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -73.53 -177.31 19.01 Favored 'Cis proline' 0 C--N 1.351 0.669 0 C-N-CA 123.589 -1.421 . . . . 0.0 112.038 0.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.8 t -60.76 139.68 57.83 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.128 -178.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 81.3 mm-40 -111.55 12.11 21.3 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.223 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.597 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 78.9 m -82.89 26.89 0.57 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.86 0.362 . . . . 0.0 110.749 178.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.03 -47.29 88.62 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.854 -178.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.3 m -128.64 25.28 5.71 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 120.791 0.329 . . . . 0.0 110.649 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -164.89 95.87 0.71 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.746 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 49.1 t -122.84 145.85 48.07 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.574 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -149.75 14.84 0.85 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.851 -179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.618 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 95.1 m -61.7 142.85 56.96 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -177.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.54 -157.79 29.14 Favored Glycine 0 N--CA 1.438 -1.224 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.718 177.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -5.12 50.68 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 117.242 0.521 . . . . 0.0 110.971 178.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -95.26 54.01 1.81 Allowed Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.264 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.5 t -128.99 146.05 51.08 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.2 t -123.89 14.7 9.27 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.178 0.513 . . . . 0.0 110.08 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 8.6 t -92.0 136.76 32.91 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.502 -177.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -96.3 -3.65 43.56 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.129 0.49 . . . . 0.0 110.616 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.1 -31.39 58.67 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.309 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.6 p -114.88 -16.02 11.76 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -177.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.418 ' HE2' ' O ' ' A' ' 55' ' ' PRO . 85.2 tttt -84.77 109.51 18.11 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.949 -0.3 . . . . 0.0 110.755 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 t -121.38 176.2 5.77 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.881 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.463 ' HB3' ' N ' ' A' ' 55' ' ' PRO . 42.6 t -162.85 148.32 12.04 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 122.554 0.342 . . . . 0.0 110.342 -178.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -107.29 -14.88 14.78 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 83.5 m -77.78 144.36 37.2 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 177.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 49.5 p -127.78 -179.78 5.13 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.548 0.213 . . . . 0.0 111.435 -175.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 40.3 m -62.83 -16.08 56.91 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -177.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -66.09 -34.42 78.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.167 0.508 . . . . 0.0 110.11 177.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.93 151.29 6.18 Favored Glycine 0 N--CA 1.435 -1.407 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.741 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 39.6 t -73.99 139.08 44.55 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -108.74 -15.21 14.45 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -177.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.611 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 15.2 p -102.17 -33.21 9.74 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 120.186 -0.605 . . . . 0.0 110.867 -179.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.36 10.46 17.44 Favored Glycine 0 CA--C 1.523 0.564 0 C-N-CA 120.762 -0.732 . . . . 0.0 113.53 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.724 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 31.7 mmtp -90.81 1.64 56.76 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 117.12 0.46 . . . . 0.0 111.519 -179.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' A' ' 50' ' ' LYS . 37.5 mm-40 70.17 21.41 5.96 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.58 0.55 . . . . 0.0 111.163 -179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.0 p -96.86 146.74 24.65 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.137 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.1 p -135.09 35.74 3.04 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-O 120.929 0.395 . . . . 0.0 110.874 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 158.83 157.28 8.42 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.429 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.463 ' N ' ' HB3' ' A' ' 39' ' ' CYS . 10.8 Cg_endo -52.22 -51.26 11.54 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 124.078 3.185 . . . . 0.0 115.104 -177.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -71.22 -35.04 71.35 Favored 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.938 -176.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.2 m -84.9 -0.91 55.74 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.754 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.488 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 44.2 t -74.68 146.15 42.57 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.909 -179.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -108.98 -4.88 16.34 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.64 -179.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.724 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 11.0 m -81.44 151.35 27.92 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.474 -177.003 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -109.34 62.24 0.29 Allowed Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.956 -0.565 . . . . 0.0 112.306 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.475 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 49.2 m 69.79 -37.95 0.39 Allowed 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 177.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.3 p -84.37 67.69 9.95 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -177.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 35.8 t -146.13 169.97 17.65 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.723 176.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.1 t -75.09 -21.53 58.88 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.384 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.461 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 9.3 p -82.15 22.49 0.8 Allowed 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.246 0.546 . . . . 0.0 110.574 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.488 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 66.8 mmtt . . . . . 0 C--O 1.271 2.208 0 CA-C-O 117.338 -1.315 . . . . 0.0 110.109 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 27.8 mtpp . . . . . 0 N--CA 1.444 -0.753 0 CA-C-O 120.662 0.268 . . . . 0.0 111.359 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.9 m -77.73 163.95 25.69 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 121.031 0.443 . . . . 0.0 110.119 175.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 65.6 p -104.23 162.78 12.9 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.838 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.2 m -70.19 -13.75 62.32 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.285 0.564 . . . . 0.0 110.313 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.09 -34.38 32.67 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.899 176.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.432 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 43.1 t -75.53 -29.0 59.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.573 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.4 mtt180 -77.67 8.94 3.82 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.261 0.553 . . . . 0.0 111.018 177.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 39.2 t -108.08 150.14 27.55 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.415 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 11.2 pt-20 -127.85 124.37 23.24 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-O 120.601 0.239 . . . . 0.0 110.526 178.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.415 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 7.9 Cg_exo -70.15 169.83 63.1 Favored 'Cis proline' 0 C--O 1.239 0.565 0 C-N-CA 123.069 -1.638 . . . . 0.0 112.007 0.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 13.4 t -56.89 138.18 54.13 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.31 -177.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -112.37 16.25 20.0 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.167 -178.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.51 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 56.6 m -89.32 14.25 11.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.293 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.59 -49.1 76.52 Favored Glycine 0 CA--C 1.521 0.432 0 C-N-CA 121.293 -0.48 . . . . 0.0 113.103 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.7 m -113.0 13.13 19.42 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.898 0.38 . . . . 0.0 111.265 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.51 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 57.3 tttm -164.93 101.5 0.77 Allowed 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.391 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.418 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 45.1 t -132.18 149.7 52.33 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.196 -179.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -153.38 22.25 0.55 Allowed 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.901 178.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 91.0 m -68.44 144.97 54.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.095 0.474 . . . . 0.0 111.271 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.426 ' HA3' ' HE3' ' A' ' 9' ' ' LYS . . . -81.19 -156.78 15.81 Favored Glycine 0 N--CA 1.441 -0.972 0 CA-C-N 115.48 -0.782 . . . . 0.0 112.816 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.44 ' H ' ' CD ' ' A' ' 29' ' ' GLU . 0.2 OUTLIER -78.55 -31.49 47.46 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.793 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -78.87 60.69 4.13 Favored Glycine 0 N--CA 1.444 -0.803 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.209 178.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 48.4 t -129.11 142.33 50.92 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 177.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.8 t -120.43 12.61 11.67 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.13 0.49 . . . . 0.0 110.753 -178.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.9 t -90.27 115.88 27.82 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.042 0.448 . . . . 0.0 110.172 179.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.96 4.73 16.0 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.454 -178.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.77 -42.83 21.13 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.812 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 8.9 p -106.34 -36.13 6.93 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.375 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -80.61 116.42 20.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.207 0.527 . . . . 0.0 110.424 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.0 t -123.31 -176.2 3.38 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.471 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 41.8 t -154.24 140.35 18.41 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.33 -17.26 27.66 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.299 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 99.6 m -73.81 154.53 39.48 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.126 0.489 . . . . 0.0 111.305 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.2 p -115.44 -173.63 2.37 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.477 -175.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.0 m -71.56 -6.01 37.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.599 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -60.03 -37.91 81.16 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.054 0.454 . . . . 0.0 110.817 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 129.03 56.4 0.1 Allowed Glycine 0 N--CA 1.443 -0.852 0 C-N-CA 119.997 -1.096 . . . . 0.0 112.784 178.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.435 ' SG ' ' N ' ' A' ' 51' ' ' GLU . 44.8 t 72.34 142.04 0.06 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.444 0.64 . . . . 0.0 112.353 178.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 35.9 mmtp -122.88 -40.58 2.41 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.801 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.426 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 13.5 p -72.64 -38.13 67.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.771 0.32 . . . . 0.0 110.89 -178.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 122.97 0.29 9.78 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.134 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -92.87 14.63 16.89 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 117.078 0.439 . . . . 0.0 111.893 -179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.435 ' N ' ' SG ' ' A' ' 46' ' ' CYS . 34.6 mt-10 60.24 36.46 20.8 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.538 -0.755 . . . . 0.0 112.627 175.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 3.5 p -111.13 151.55 28.01 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 120.879 0.371 . . . . 0.0 111.182 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.6 p -137.76 77.79 1.65 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.928 0.394 . . . . 0.0 110.893 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 99.37 155.48 28.6 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.246 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -43.34 -51.72 5.62 Favored 'Trans proline' 0 N--CA 1.478 0.612 0 C-N-CA 124.1 3.2 . . . . 0.0 114.712 -177.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -62.33 -35.8 80.21 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.012 0.434 . . . . 0.0 111.555 -177.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.3 m -99.27 19.85 14.67 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.188 -178.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 53.4 t -103.62 129.61 50.93 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-O 121.143 0.496 . . . . 0.0 110.997 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -109.8 4.31 21.61 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.471 0.653 . . . . 0.0 109.79 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 5.0 m -82.14 156.72 24.34 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.373 -178.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -83.64 -178.7 51.99 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.01 178.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.1 p -79.63 -6.97 58.21 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.3 m -100.79 10.52 41.04 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.783 0.325 . . . . 0.0 110.937 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 30.8 t -84.64 164.86 18.39 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.944 0.402 . . . . 0.0 111.69 -177.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.6 m -64.16 -34.31 77.78 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.321 0.649 . . . . 0.0 112.185 -177.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.473 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 19.7 p -82.26 20.13 1.1 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.946 0.403 . . . . 0.0 111.033 -179.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.473 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 48.1 mmtm . . . . . 0 C--O 1.263 1.773 0 CA-C-O 117.863 -1.065 . . . . 0.0 110.47 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.423 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 14.0 mptt . . . . . 0 N--CA 1.45 -0.454 0 CA-C-O 120.654 0.264 . . . . 0.0 111.326 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.677 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 73.8 m -65.28 137.11 57.34 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.162 0.506 . . . . 0.0 111.138 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.659 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 44.5 p -78.0 175.13 10.37 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.017 -177.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.6 m -70.21 -25.44 63.41 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 175.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.462 ' HB3' ' HB2' ' A' ' 20' ' ' GLN . . . -69.95 -40.55 75.4 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.033 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.521 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 40.5 t -69.35 -25.13 64.04 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.339 0.59 . . . . 0.0 110.773 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.659 ' HG3' ' O ' ' A' ' 11' ' ' THR . 60.0 mtt180 -81.21 -2.66 49.59 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.016 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.1 m -104.68 156.34 18.07 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.502 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 8.8 pt-20 -128.12 129.92 23.63 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-O 120.779 0.323 . . . . 0.0 111.179 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.502 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 44.4 Cg_endo -67.61 169.3 52.94 Favored 'Cis proline' 0 C--N 1.351 0.706 0 C-N-CA 123.143 -1.607 . . . . 0.0 111.15 -0.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.521 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 26.3 t -59.07 133.84 56.46 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-O 121.159 0.504 . . . . 0.0 110.636 -177.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.462 ' HB2' ' HB3' ' A' ' 13' ' ' ALA . 27.4 mm-40 -97.01 12.1 33.73 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.858 -177.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.539 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 91.6 m -96.23 23.66 6.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.314 176.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -46.77 -52.44 11.45 Favored Glycine 0 C--N 1.338 0.667 0 O-C-N 123.438 0.461 . . . . 0.0 113.595 -177.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.1 p -120.97 -20.48 6.86 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 120.857 0.36 . . . . 0.0 110.989 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -114.88 81.35 1.55 Allowed 'General case' 0 CA--C 1.507 -0.696 0 CA-C-O 121.122 0.487 . . . . 0.0 110.585 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.593 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 53.6 t -95.57 143.95 26.44 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.31 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -140.68 19.46 2.34 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.245 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.677 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 85.5 m -77.8 179.17 6.84 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.875 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -129.93 -135.2 3.83 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.318 -179.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.429 ' HA ' ' HA3' ' A' ' 61' ' ' GLY . 0.5 OUTLIER -89.7 -10.44 45.73 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.122 0.487 . . . . 0.0 110.639 179.461 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -94.09 36.94 3.55 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.774 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.411 ' HA ' ' SG ' ' A' ' 10' ' ' CYS . 43.0 t -112.8 135.65 53.3 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.8 t -118.89 12.59 12.92 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-O 121.012 0.434 . . . . 0.0 110.111 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.2 t -81.43 166.26 20.53 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.064 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.06 -7.74 11.29 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 120.936 0.398 . . . . 0.0 110.935 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.24 -54.79 5.41 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.411 -178.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.593 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 3.5 p -82.9 -15.99 49.25 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.797 -178.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.498 ' HE2' ' O ' ' A' ' 55' ' ' PRO . 87.8 tttt -75.0 100.5 4.18 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.073 0.464 . . . . 0.0 110.865 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 t -108.32 -178.77 3.69 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.047 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.1 t -161.48 150.35 15.98 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -108.3 -18.71 13.69 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.1 m -75.36 133.88 41.12 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.0 p -103.53 176.34 5.18 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 120.886 0.374 . . . . 0.0 111.685 -175.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.483 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.6 m -70.04 0.8 5.4 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.847 -178.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -86.96 -22.88 25.32 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.218 0.532 . . . . 0.0 110.095 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 158.59 153.59 6.84 Favored Glycine 0 N--CA 1.436 -1.354 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.006 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 54.1 t -74.05 136.95 43.09 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -107.74 -27.31 10.36 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -177.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 9.4 p -86.35 -31.82 21.33 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.966 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.19 2.58 33.62 Favored Glycine 0 CA--C 1.522 0.473 0 C-N-CA 120.563 -0.827 . . . . 0.0 113.599 177.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.419 ' O ' ' HE2' ' A' ' 59' ' ' LYS . 45.4 mmtm -88.64 0.25 56.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.061 0.458 . . . . 0.0 110.28 178.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 64.51 65.2 0.65 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.053 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.6 p -136.34 144.19 44.5 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.028 176.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.483 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 22.6 p -131.79 63.71 1.61 Allowed 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.205 0.526 . . . . 0.0 111.097 -179.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.52 159.63 10.39 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 120.831 -0.699 . . . . 0.0 111.705 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.498 ' O ' ' HE2' ' A' ' 37' ' ' LYS . 10.9 Cg_endo -54.01 -40.04 82.81 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 123.212 2.608 . . . . 0.0 113.332 -177.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -67.72 -37.7 82.59 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.898 0.38 . . . . 0.0 110.99 -178.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.2 t -91.49 3.31 55.28 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.948 -178.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 53.1 t -84.77 143.18 29.29 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.109 0.481 . . . . 0.0 110.979 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.419 ' HE2' ' O ' ' A' ' 50' ' ' LYS . 63.3 pttt -122.77 14.05 10.02 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.338 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 12.2 m -96.04 162.26 13.63 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.577 -178.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.469 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -96.1 -178.38 36.03 Favored Glycine 0 N--CA 1.427 -1.916 0 N-CA-C 109.946 -1.261 . . . . 0.0 109.946 175.164 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 14.1 m -75.86 25.05 0.12 Allowed 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 117.21 0.505 . . . . 0.0 111.421 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.449 ' H ' ' C ' ' A' ' 61' ' ' GLY . 17.4 m -125.76 19.22 7.91 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.521 -178.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.0 t -102.76 171.4 7.43 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 178.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.3 m -72.13 -22.0 61.39 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.764 0.316 . . . . 0.0 111.397 -178.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.472 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 15.1 p -91.12 26.96 2.0 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.178 0.513 . . . . 0.0 110.279 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.472 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 43.5 mmtm . . . . . 0 C--O 1.263 1.799 0 CA-C-O 117.888 -1.053 . . . . 0.0 111.17 -179.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.556 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 31.2 mmtp . . . . . 0 CA--C 1.507 -0.707 0 CA-C-O 121.0 0.428 . . . . 0.0 110.172 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.471 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 64.2 m -78.46 157.01 29.06 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.151 178.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.4 p -96.1 168.4 10.63 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.777 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.6 m -71.24 -16.89 62.51 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.443 0.64 . . . . 0.0 109.537 175.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.67 -38.36 47.82 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.259 178.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.512 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 50.5 t -71.85 -28.42 63.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.715 179.247 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 48.2 mtp180 -82.39 9.19 9.55 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.032 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.5 m -108.06 157.57 18.14 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -127.83 121.95 22.22 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.651 0.263 . . . . 0.0 110.996 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.35 175.31 44.19 Favored 'Cis proline' 0 C--N 1.351 0.663 0 C-N-CA 123.246 -1.564 . . . . 0.0 112.048 0.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 20.0 t -61.85 129.91 43.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.082 0.468 . . . . 0.0 110.526 -178.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.0 mm-40 -102.83 11.02 38.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.958 -177.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.512 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 87.0 m -76.72 2.97 12.77 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -56.65 103.38 0.26 Allowed Glycine 0 CA--C 1.518 0.223 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.385 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.5 t 64.33 24.0 13.17 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.481 0.657 . . . . 0.0 110.68 -179.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.401 ' HG2' ' O ' ' A' ' 24' ' ' LYS . 40.1 ttmt -144.9 14.55 1.52 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.514 -179.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.493 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 46.4 t -70.11 141.26 52.76 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.07 -175.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -138.65 11.75 2.71 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.172 178.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 64.3 m -63.9 139.86 58.81 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.381 -178.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.416 ' C ' ' H ' ' A' ' 30' ' ' GLY . . . -81.67 -171.85 46.21 Favored Glycine 0 N--CA 1.44 -1.08 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.89 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.93 17.28 0.34 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.223 0.535 . . . . 0.0 112.214 -178.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.416 ' H ' ' C ' ' A' ' 28' ' ' GLY . . . -116.04 37.0 3.58 Favored Glycine 0 N--CA 1.439 -1.106 0 N-CA-C 111.508 -0.637 . . . . 0.0 111.508 178.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.7 t -123.12 156.77 34.33 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 t -131.06 7.23 4.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.331 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 16.5 t -76.81 116.02 17.11 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.07 -3.91 25.77 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.295 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -81.68 -13.48 57.82 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.643 -179.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.493 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 6.3 p -134.38 -31.35 1.09 Allowed 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -177.265 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -91.51 115.3 27.92 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.441 -0.503 . . . . 0.0 109.781 -177.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.57 164.93 12.06 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.381 -176.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 39.2 t -160.21 159.03 31.06 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.773 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.4 m-80 -123.81 -6.91 7.92 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 95.0 m -73.12 157.78 36.59 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.835 178.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 23.8 p -126.47 -177.36 3.96 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.679 -0.692 . . . . 0.0 111.728 -174.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.1 m -70.88 -1.47 11.88 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.002 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -59.04 -26.48 64.63 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.08 176.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 125.18 42.65 0.32 Allowed Glycine 0 CA--C 1.501 -0.843 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.232 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 48.3 t 69.1 138.96 0.04 OUTLIER 'General case' 0 C--N 1.341 0.207 0 C-N-CA 123.051 0.541 . . . . 0.0 110.395 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.4 mtpt -123.19 1.76 9.15 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.375 -177.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.522 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 2.8 p -111.65 -40.92 4.19 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.023 0.44 . . . . 0.0 110.015 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 119.96 14.63 5.52 Favored Glycine 0 CA--C 1.525 0.681 0 C-N-CA 120.811 -0.709 . . . . 0.0 113.228 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.692 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.3 mmtt -102.18 5.14 40.08 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 117.198 0.499 . . . . 0.0 110.778 178.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.45 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 17.7 tt0 70.93 16.82 6.45 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.387 0.675 . . . . 0.0 110.793 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.477 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 25.9 p -93.59 143.55 26.2 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 120.975 0.417 . . . . 0.0 110.514 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.3 p -124.2 31.78 5.7 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.283 0.563 . . . . 0.0 110.749 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 140.86 171.88 12.74 Favored Glycine 0 N--CA 1.441 -0.972 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 -177.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.55 -29.61 85.54 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.893 2.395 . . . . 0.0 112.628 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -62.57 -37.5 86.43 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.854 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 12.1 m -113.04 3.66 16.27 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -176.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.477 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 48.5 t -74.82 135.22 41.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.787 0.327 . . . . 0.0 110.629 -179.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 17.1 ttpp -136.22 33.48 2.82 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.671 -177.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.692 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 2.7 m -96.32 -179.05 4.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.015 0.436 . . . . 0.0 110.05 176.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -99.55 -143.41 14.51 Favored Glycine 0 N--CA 1.432 -1.57 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 174.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.9 p -91.62 -28.77 17.29 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 116.923 0.361 . . . . 0.0 111.205 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.8 m -87.71 67.5 9.22 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -176.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 7.1 t -142.76 155.06 44.79 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.207 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.0 m -70.1 -24.35 63.19 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -175.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.478 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 17.5 p -86.03 7.84 22.95 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.939 0.4 . . . . 0.0 111.191 -178.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.478 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 47.3 mmtm . . . . . 0 C--O 1.262 1.741 0 CA-C-O 117.56 -1.209 . . . . 0.0 111.144 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 31.4 mmtp . . . . . 0 N--CA 1.441 -0.901 0 CA-C-O 121.066 0.46 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.609 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 66.3 m -73.43 150.95 41.32 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.041 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 46.9 p -87.11 167.28 14.32 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.744 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.9 m -63.93 -27.26 69.02 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 177.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.68 -43.08 76.89 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.458 178.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.481 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 44.0 t -69.83 -34.9 74.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.921 0.391 . . . . 0.0 110.301 178.163 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -70.31 -14.37 62.56 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.199 179.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.5 m -81.72 151.1 27.66 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -129.64 123.22 21.1 Favored Pre-proline 0 C--N 1.313 -1.012 0 CA-C-O 120.726 0.298 . . . . 0.0 111.508 -177.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.2 167.56 68.95 Favored 'Cis proline' 0 C--O 1.242 0.687 0 C-N-CA 123.314 -1.536 . . . . 0.0 111.805 -1.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.481 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 49.7 t -52.77 147.08 9.39 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.06 0.457 . . . . 0.0 111.947 -177.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -124.33 15.8 9.01 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.942 -178.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.429 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 67.5 m -69.0 -77.34 0.08 Allowed 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.751 0.31 . . . . 0.0 111.625 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 63.7 -106.9 1.52 Allowed Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.501 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.3 m -97.92 -1.18 43.44 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 120.976 0.417 . . . . 0.0 110.847 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -106.37 27.22 8.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.621 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 47.6 t -73.98 142.77 45.82 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.233 0.539 . . . . 0.0 112.224 -177.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -148.79 25.0 0.95 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.164 -0.926 . . . . 0.0 109.964 178.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.609 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 67.7 m -72.27 -175.33 1.52 Allowed 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.109 0.48 . . . . 0.0 111.909 -178.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -117.61 -172.75 16.06 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.757 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -70.86 -12.28 61.45 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 122.858 0.463 . . . . 0.0 111.576 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -96.34 20.06 51.92 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.628 -178.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.0 t -93.49 140.7 29.29 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.075 0.464 . . . . 0.0 110.327 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.0 t -122.3 17.9 10.64 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.129 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.4 ' SG ' ' HB2' ' A' ' 35' ' ' ALA . 45.0 t -87.67 117.61 26.61 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.78 -11.72 60.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.341 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.4 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . . . -66.15 -45.37 81.23 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.019 179.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.429 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 6.1 p -106.34 -17.96 14.13 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.412 ' HD3' ' O ' ' A' ' 55' ' ' PRO . 21.4 ttmm -63.49 107.02 1.03 Allowed 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 178.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.2 t -127.08 152.62 47.04 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 120.819 0.342 . . . . 0.0 110.997 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.446 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 19.8 t -154.26 144.9 22.38 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.591 178.07 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -98.18 -26.29 14.61 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -178.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 74.7 m -67.96 144.17 55.31 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 177.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 26.8 p -123.09 -172.2 2.45 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.847 -176.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.0 m -70.4 -8.14 48.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.169 0.509 . . . . 0.0 110.575 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -67.09 -28.7 68.39 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.654 175.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.75 157.67 7.27 Favored Glycine 0 N--CA 1.439 -1.165 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.989 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.4 ' SG ' ' N ' ' A' ' 51' ' ' GLU . 42.9 t -74.26 139.13 44.09 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -127.15 -3.82 6.28 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -178.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.417 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 12.3 p -97.6 -29.67 13.3 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.49 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.44 9.01 18.24 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 120.4 -0.905 . . . . 0.0 113.584 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.723 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 47.0 mmtm -98.55 -1.08 41.93 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 117.352 0.576 . . . . 0.0 111.264 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.4 ' N ' ' SG ' ' A' ' 46' ' ' CYS . 48.5 mt-10 66.43 22.67 10.68 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.153 0.581 . . . . 0.0 111.1 -177.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 27.2 p -95.2 142.16 27.96 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.95 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.1 p -121.91 33.93 5.34 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-O 121.282 0.563 . . . . 0.0 110.593 -179.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 144.07 170.61 13.63 Favored Glycine 0 N--CA 1.435 -1.395 0 C-N-CA 120.762 -0.733 . . . . 0.0 111.33 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.446 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 28.6 Cg_endo -62.93 -15.69 49.18 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.834 2.356 . . . . 0.0 112.728 -178.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -66.78 -45.32 78.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.862 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.7 m -113.01 16.7 19.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.057 0.456 . . . . 0.0 110.769 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.513 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 38.9 t -77.82 122.44 25.44 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -124.43 18.03 8.94 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.478 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.723 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 8.3 m -68.58 147.19 52.3 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.218 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -82.29 43.15 2.98 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 120.818 -0.706 . . . . 0.0 113.231 -178.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.6 m 69.09 -48.89 0.59 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.957 0.903 . . . . 0.0 113.033 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.1 t -76.01 76.39 2.88 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.081 0.467 . . . . 0.0 110.18 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.9 t -140.01 170.53 15.69 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.056 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.2 t -76.3 -30.52 57.78 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.322 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.51 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 7.8 p -84.26 17.62 2.48 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 120.96 0.409 . . . . 0.0 111.323 -178.195 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.513 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 48.6 mmtm . . . . . 0 C--O 1.256 1.409 0 CA-C-O 117.735 -1.126 . . . . 0.0 110.921 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.445 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 71.2 mmtt . . . . . 0 CA--C 1.505 -0.783 0 CA-C-O 120.613 0.244 . . . . 0.0 111.621 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.2 m -97.23 159.24 15.03 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 121.298 0.57 . . . . 0.0 111.539 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.463 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 41.9 p -93.55 -178.67 4.79 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.498 -176.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.0 m -80.44 -20.84 42.92 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.308 0.575 . . . . 0.0 109.676 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.2 -35.83 48.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.859 179.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.456 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 43.9 t -71.67 -13.67 61.81 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.712 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.463 ' HG2' ' O ' ' A' ' 11' ' ' THR . 12.5 mmt180 -72.24 -20.59 61.52 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.812 179.388 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.2 m -91.72 164.78 13.6 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -175.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.442 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 14.1 pt-20 -140.84 118.04 7.83 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.506 177.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.442 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 13.1 Cg_exo -66.69 171.45 39.7 Favored 'Cis proline' 0 C--N 1.352 0.732 0 C-N-CA 123.1 -1.625 . . . . 0.0 112.033 0.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.456 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 13.7 t -66.28 150.07 49.38 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.854 -175.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -113.89 7.06 16.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.489 -178.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.4 m -68.12 -75.61 0.1 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.699 0.285 . . . . 0.0 111.22 179.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 65.91 -109.23 2.77 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.586 -0.816 . . . . 0.0 111.418 -177.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.5 t -95.19 -17.96 21.3 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.456 0.646 . . . . 0.0 109.28 178.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -92.71 55.93 2.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.94 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 48.1 t -103.06 143.86 32.04 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.701 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.422 ' H ' HG22 ' A' ' 11' ' ' THR . 28.8 mm-40 -139.41 17.45 2.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.084 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.445 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 76.3 m -70.61 148.21 48.37 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.144 0.497 . . . . 0.0 111.928 -177.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -98.98 -160.63 29.55 Favored Glycine 0 N--CA 1.441 -1.019 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.552 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -73.28 -4.89 36.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.851 0.358 . . . . 0.0 111.781 -178.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -93.37 22.89 32.6 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.99 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.0 t -115.69 149.48 38.33 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.901 0.382 . . . . 0.0 110.919 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.2 t -133.62 12.58 4.08 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.138 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 37.8 t -72.51 119.96 17.45 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.222 0.534 . . . . 0.0 110.436 -178.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.11 -0.54 22.31 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.607 -178.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.78 -29.26 23.97 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.503 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.6 p -119.88 -26.12 5.69 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -83.29 107.05 15.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.987 0.422 . . . . 0.0 110.361 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.0 t -114.82 175.73 5.36 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.237 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 45.0 t -156.64 154.26 29.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.287 -178.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -114.6 -12.91 12.18 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 81.6 m -77.38 127.66 32.93 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 174.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 70.6 p -93.36 173.67 7.59 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.711 -172.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.505 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.7 m -66.94 -2.6 5.47 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.099 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -80.69 -36.45 32.3 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.987 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 168.09 151.58 7.14 Favored Glycine 0 N--CA 1.442 -0.945 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.669 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.7 t -78.59 138.87 38.57 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 122.48 0.312 . . . . 0.0 110.421 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -129.06 2.16 5.26 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 4.3 p -93.94 -37.68 11.57 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.006 -0.678 . . . . 0.0 109.737 177.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 124.32 -4.35 8.86 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.831 -0.699 . . . . 0.0 113.294 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.801 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 43.0 mmtm -87.62 -1.54 58.02 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 117.384 0.592 . . . . 0.0 111.527 -178.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 63.96 36.93 9.72 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.992 0.901 . . . . 0.0 109.865 -178.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 28.6 p -108.84 141.26 41.13 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.443 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.505 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 36.1 p -131.13 79.98 1.92 Allowed 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 177.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 105.72 159.9 22.83 Favored Glycine 0 N--CA 1.437 -1.263 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.468 -177.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -52.21 -31.15 44.64 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 123.437 2.758 . . . . 0.0 113.806 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -63.95 -44.44 92.82 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.988 0.423 . . . . 0.0 111.602 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.47 ' HB2' ' H ' ' A' ' 53' ' ' THR . 19.5 m -89.62 -12.66 39.06 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.691 -178.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 49.0 t -68.05 131.56 45.67 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.948 -177.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -118.13 14.96 14.09 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.592 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.801 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.8 m -103.34 164.41 11.66 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.278 -176.019 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -96.85 -166.3 33.11 Favored Glycine 0 N--CA 1.439 -1.121 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 177.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.6 m -85.1 25.24 0.99 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 117.106 0.453 . . . . 0.0 111.312 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.5 m -131.48 20.08 4.75 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 120.739 0.304 . . . . 0.0 111.638 -178.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . 0.423 ' SG ' ' N ' ' A' ' 65' ' ' SER . 46.0 t -99.68 171.26 8.01 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.79 0.329 . . . . 0.0 110.953 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.423 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 51.0 m -60.89 -34.51 74.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.556 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.441 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 31.9 p -82.89 21.84 0.99 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 120.969 0.414 . . . . 0.0 111.104 -179.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.441 ' HD3' ' O ' ' A' ' 66' ' ' CYS . 54.8 mmtt . . . . . 0 C--O 1.261 1.672 0 CA-C-O 117.494 -1.241 . . . . 0.0 110.061 178.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp . . . . . 0 C--O 1.237 0.438 0 CA-C-O 120.868 0.366 . . . . 0.0 111.465 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.6 m -72.85 160.53 32.0 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.402 0.62 . . . . 0.0 111.494 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.403 HG23 ' HB2' ' A' ' 26' ' ' GLN . 77.6 p -97.47 170.13 9.26 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.906 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.8 m -64.77 -26.22 68.26 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.11 0.481 . . . . 0.0 109.971 177.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.82 -48.21 72.47 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.597 177.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.1 t -73.56 -24.66 60.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.044 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -79.57 -1.81 39.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.011 0.434 . . . . 0.0 111.424 179.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.3 m -105.35 150.0 25.59 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 176.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.406 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 10.7 pt-20 -119.09 129.8 25.19 Favored Pre-proline 0 C--N 1.322 -0.594 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.926 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.406 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 4.9 Cg_exo -72.45 175.04 45.57 Favored 'Cis proline' 0 C--O 1.236 0.395 0 C-N-CA 123.231 -1.571 . . . . 0.0 111.482 -0.195 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.9 t -55.39 135.33 50.35 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.009 0.433 . . . . 0.0 111.06 -178.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -110.55 20.11 18.03 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.694 -177.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 81.8 m -87.7 27.45 1.13 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.859 0.362 . . . . 0.0 110.695 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.98 -42.08 99.64 Favored Glycine 0 CA--C 1.52 0.389 0 CA-C-N 116.1 -0.5 . . . . 0.0 113.224 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.3 p -128.96 15.76 6.29 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.969 0.414 . . . . 0.0 111.125 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -162.16 101.28 1.1 Allowed 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.91 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 53.7 t -120.75 121.16 37.62 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-O 120.926 0.394 . . . . 0.0 109.952 177.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.403 ' HB2' HG23 ' A' ' 11' ' ' THR . 82.9 mt-30 -129.63 19.22 5.68 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.104 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.543 ' O ' ' HB2' ' A' ' 62' ' ' SER . 70.8 m -64.93 134.11 53.26 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.97 -91.42 0.37 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.822 -177.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -139.25 159.53 41.94 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 84.11 26.07 42.1 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 110.761 -0.936 . . . . 0.0 110.761 -177.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.8 t -124.08 132.85 53.71 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.207 -0.497 . . . . 0.0 110.263 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.2 t -165.55 71.87 0.16 Allowed 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.492 0.663 . . . . 0.0 111.171 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 10.4 p -101.23 8.82 42.37 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 121.241 0.543 . . . . 0.0 110.318 178.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 69.4 -16.87 0.24 Allowed 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 114.797 -1.092 . . . . 0.0 113.43 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.78 -54.07 7.1 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -178.006 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 26.9 p -92.74 -25.2 18.3 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.885 0.374 . . . . 0.0 110.925 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -49.09 113.17 0.74 Allowed 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.424 -178.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.5 t -124.68 165.12 18.48 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.448 -178.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.7 t -162.58 139.47 7.84 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -98.8 -10.05 23.55 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.725 0.297 . . . . 0.0 111.478 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 70.8 m -74.33 139.41 44.14 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 177.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 76.8 p -112.07 -174.09 2.39 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.578 -176.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.1 m -70.5 3.73 2.84 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.127 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -58.63 -36.71 74.51 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.148 0.499 . . . . 0.0 109.71 176.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 132.04 40.61 0.21 Allowed Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.257 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 43.2 t 71.47 148.01 0.08 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.98 0.512 . . . . 0.0 111.37 -178.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -126.59 -16.36 5.32 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.887 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.492 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 14.4 p -95.45 -36.06 11.47 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.464 -0.494 . . . . 0.0 111.503 -177.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.31 -3.86 20.18 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.215 -0.993 . . . . 0.0 112.908 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.468 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 76.0 mmtt -82.67 -4.5 57.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.911 0.386 . . . . 0.0 110.042 178.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 67.08 67.91 0.41 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.298 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.4 p -139.34 154.76 47.94 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.265 178.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.3 p -139.59 81.47 1.83 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.819 0.342 . . . . 0.0 111.18 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 98.58 160.46 29.97 Favored Glycine 0 C--N 1.315 -0.637 0 C-N-CA 120.548 -0.834 . . . . 0.0 112.03 178.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -56.98 -36.79 99.41 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.047 2.498 . . . . 0.0 112.655 -178.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -75.45 -11.5 60.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.198 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.6 m -129.05 25.93 5.52 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.121 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.461 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 47.1 t -103.34 150.91 23.33 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.423 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -121.15 -9.22 9.18 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-O 121.886 0.85 . . . . 0.0 108.726 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.9 m -86.32 144.17 27.51 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 114.645 -1.161 . . . . 0.0 111.511 -174.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -80.97 176.86 54.57 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.543 ' HB2' ' O ' ' A' ' 27' ' ' CYS . 18.2 m -66.4 -7.14 17.3 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 117.016 0.408 . . . . 0.0 111.778 -178.262 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.3 m -100.56 35.98 2.01 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.333 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 22.7 t -112.53 174.27 5.97 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 120.761 0.315 . . . . 0.0 111.081 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.0 m -71.43 -25.19 62.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.69 -178.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.492 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 32.1 p -87.02 16.91 4.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.822 0.344 . . . . 0.0 111.043 -179.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.461 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 53.8 mmtt . . . . . 0 C--O 1.257 1.452 0 CA-C-O 117.525 -1.226 . . . . 0.0 110.763 -179.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.4 mttp . . . . . 0 CA--C 1.498 -1.054 0 CA-C-O 121.52 0.676 . . . . 0.0 110.642 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.3 m -117.6 156.32 28.33 Favored 'General case' 0 C--N 1.273 -2.751 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.198 177.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.618 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 82.2 p -83.46 175.1 10.06 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.054 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.2 m -76.91 -16.39 59.4 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 176.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.58 -42.91 40.87 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.558 178.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 50.0 t -69.37 -27.72 65.57 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.186 0.517 . . . . 0.0 110.223 178.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.618 ' HG3' ' O ' ' A' ' 11' ' ' THR . 37.6 mtt180 -85.46 1.86 47.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.392 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.7 t -94.33 161.68 14.14 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -122.28 115.94 29.9 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-O 120.537 0.208 . . . . 0.0 110.646 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -79.14 -178.09 22.74 Favored 'Cis proline' 0 C--N 1.351 0.664 0 C-N-CA 124.068 -1.222 . . . . 0.0 111.717 -0.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.7 t -58.81 123.43 16.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.017 0.436 . . . . 0.0 110.001 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -101.07 18.76 18.93 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.655 -176.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 72.7 m -83.33 9.4 11.0 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.83 -36.95 93.96 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.507 -0.854 . . . . 0.0 111.224 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.7 m -97.85 -32.84 11.49 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 120.592 0.234 . . . . 0.0 111.324 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 9.5 ptpp? -139.04 103.75 4.86 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.14 0.495 . . . . 0.0 111.673 -178.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 44.5 t -112.39 114.88 27.83 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-O 121.2 0.524 . . . . 0.0 109.801 176.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -127.39 22.97 6.44 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.461 -177.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 98.2 m -61.31 157.62 16.14 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.666 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.33 -101.92 1.29 Allowed Glycine 0 N--CA 1.437 -1.269 0 C-N-CA 120.587 -0.816 . . . . 0.0 115.115 -174.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.578 ' HG3' ' H ' ' A' ' 30' ' ' GLY . 5.4 pt-20 -105.71 -84.34 0.5 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -172.212 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.578 ' H ' ' HG3' ' A' ' 29' ' ' GLU . . . -83.99 66.76 3.84 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 121.003 -0.617 . . . . 0.0 113.909 -175.127 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.1 t -74.43 139.49 44.02 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 176.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.7 t -112.39 14.75 20.4 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 121.298 0.57 . . . . 0.0 110.93 -176.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 43.7 t -96.16 148.83 22.3 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.697 178.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.9 5.94 26.84 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.869 0.366 . . . . 0.0 110.815 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -84.86 -44.91 12.79 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.035 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 6.0 p -101.47 -5.02 25.79 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.867 -178.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -81.85 115.63 21.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.868 0.366 . . . . 0.0 110.32 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 t -126.46 171.67 10.84 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.836 -179.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 48.0 t -155.95 148.5 23.85 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -179.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -109.65 -12.47 14.65 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -178.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 73.9 m -79.17 133.99 36.71 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.8 p -100.34 176.31 5.41 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-O 120.838 0.351 . . . . 0.0 111.514 -175.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.56 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 50.2 m -74.33 6.56 3.52 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.259 0.552 . . . . 0.0 110.899 178.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -85.84 -30.02 23.28 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.519 176.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 161.2 151.5 6.27 Favored Glycine 0 N--CA 1.437 -1.285 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.74 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.3 t -72.38 143.38 48.6 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -121.63 -25.72 5.05 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 8.1 p -77.97 -34.68 50.85 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.923 -177.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.76 -0.49 27.43 Favored Glycine 0 CA--C 1.523 0.565 0 C-N-CA 120.535 -0.84 . . . . 0.0 113.023 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -90.2 0.08 57.36 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.917 0.358 . . . . 0.0 110.729 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 64.38 62.72 0.8 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.966 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.9 p -134.43 154.97 51.11 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.412 176.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.56 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 19.3 p -137.7 51.13 1.92 Allowed 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.396 0.617 . . . . 0.0 110.78 -178.441 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 128.12 164.9 11.7 Favored Glycine 0 N--CA 1.439 -1.114 0 C-N-CA 120.838 -0.696 . . . . 0.0 111.363 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -57.77 -20.85 45.17 Favored 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 122.968 2.445 . . . . 0.0 113.632 -178.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -74.42 -41.85 60.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.902 0.382 . . . . 0.0 111.168 -179.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.7 p -98.29 1.08 46.79 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.173 0.511 . . . . 0.0 111.104 -178.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 43.4 t -86.03 129.9 34.7 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.943 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -117.96 7.18 12.25 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.799 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 5.6 m -75.14 154.7 37.62 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.813 -178.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -84.07 -156.05 22.88 Favored Glycine 0 N--CA 1.441 -1.0 0 C-N-CA 120.81 -0.709 . . . . 0.0 111.838 178.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 p -86.89 -8.81 56.92 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 120.745 0.307 . . . . 0.0 111.704 -178.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.7 m -115.37 60.34 0.7 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.133 0.492 . . . . 0.0 111.533 -177.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . 0.403 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 39.6 t -126.19 167.65 15.14 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.815 177.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 31.8 t -61.76 -32.77 73.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.388 -178.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 27.3 p -88.56 22.27 2.64 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 120.799 0.333 . . . . 0.0 111.404 -178.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.403 ' HG2' ' HB3' ' A' ' 64' ' ' CYS . 52.4 mmtt . . . . . 0 C--O 1.257 1.493 0 CA-C-O 117.458 -1.258 . . . . 0.0 110.778 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 5.9 tmtt? . . . . . 0 CA--C 1.511 -0.541 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.471 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 62.8 m -65.39 147.31 53.65 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.676 178.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.6 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 68.4 p -88.86 171.07 10.19 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.851 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.0 m -67.21 -26.87 66.82 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.393 0.616 . . . . 0.0 109.604 176.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.408 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . . . -69.82 -40.2 76.05 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.352 -179.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 50.4 t -74.36 -20.63 60.02 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.361 0.601 . . . . 0.0 110.518 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.6 ' HG3' ' O ' ' A' ' 11' ' ' THR . 62.4 mtt180 -84.29 0.92 47.21 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.206 0.526 . . . . 0.0 109.948 178.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.2 m -102.78 159.06 15.81 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.493 178.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -128.8 124.38 22.51 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-O 120.7 0.286 . . . . 0.0 111.317 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.22 -178.65 21.11 Favored 'Cis proline' 0 C--N 1.351 0.679 0 C-N-CA 123.283 -1.549 . . . . 0.0 111.618 -1.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.9 t -61.72 135.31 57.56 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 120.887 0.375 . . . . 0.0 110.697 -178.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.3 mm-40 -112.08 16.96 19.99 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.802 -177.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.428 ' HB3' ' HB2' ' A' ' 25' ' ' CYS . 93.2 m -86.51 26.08 1.13 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -177.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.46 -42.99 99.23 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 120.527 -0.844 . . . . 0.0 111.602 178.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.5 p -139.39 20.04 2.57 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.308 0.575 . . . . 0.0 110.321 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 57.3 mttm -131.67 31.13 4.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.815 -177.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.428 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 18.1 t -91.82 145.63 24.41 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -174.354 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -156.81 16.72 0.3 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.192 178.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.473 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 99.6 m -64.99 164.15 13.28 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -176.322 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -146.3 -145.0 4.16 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 114.965 -1.016 . . . . 0.0 111.346 -179.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -68.02 154.14 42.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.12 0.46 . . . . 0.0 110.324 177.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.55 -33.8 5.6 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -174.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 24.0 t -74.24 147.78 42.13 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 t -145.12 27.19 1.29 Allowed 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.5 0.667 . . . . 0.0 109.762 -178.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 47.6 t -94.86 119.47 33.48 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.26 -176.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.24 -7.72 48.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.709 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.18 -27.46 60.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.663 -0.244 . . . . 0.0 111.456 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 10.1 p -134.64 11.47 3.72 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 112.33 0.492 . . . . 0.0 112.33 -177.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.0 mmtp -91.09 138.71 31.39 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.83 133.32 37.7 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.97 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 27.3 t -150.88 145.51 25.7 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.198 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -101.63 -19.75 15.31 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 121.018 -0.273 . . . . 0.0 111.732 179.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 74.0 m -74.39 133.3 42.48 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.8 p -109.89 -173.77 2.33 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.048 -175.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.4 m -69.66 -14.69 62.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.438 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.68 -40.06 95.9 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.916 177.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 164.07 155.2 8.17 Favored Glycine 0 N--CA 1.43 -1.759 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.42 179.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 47.0 t -77.49 130.43 36.98 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 178.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.446 ' HB3' ' HZ1' ' A' ' 47' ' ' LYS . 9.1 mtpm? -105.68 -26.52 11.78 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 8.3 p -78.89 -40.99 30.8 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.744 -177.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.91 12.82 10.79 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.045 178.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.465 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 74.8 mmtt -95.67 3.75 53.66 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.989 0.394 . . . . 0.0 110.549 178.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.403 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 34.0 tt0 66.12 29.64 9.78 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.929 178.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.5 p -102.19 150.99 22.73 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.564 178.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.8 p -141.11 66.05 1.38 Allowed 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.425 0.631 . . . . 0.0 110.255 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 121.24 154.52 9.27 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.563 179.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -53.65 -31.66 61.21 Favored 'Trans proline' 0 N--CA 1.48 0.728 0 C-N-CA 124.146 3.231 . . . . 0.0 115.039 -176.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -69.13 -41.89 76.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.866 0.365 . . . . 0.0 111.191 -178.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.6 m -96.69 0.02 49.03 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.804 -177.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.462 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 14.9 t -92.24 126.15 37.2 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.082 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -119.41 14.23 12.82 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.557 177.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 20.7 m -69.61 150.23 47.28 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.36 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -69.59 164.88 50.68 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.389 -179.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.8 p -72.93 -3.3 25.0 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.202 0.525 . . . . 0.0 111.606 -178.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.2 t -111.94 13.01 20.81 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.294 0.568 . . . . 0.0 109.78 178.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 65' ' ' SER . 47.1 t -73.85 169.72 16.81 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.828 -177.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.401 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 8.6 m -63.89 -34.49 78.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.789 -178.092 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 21.6 p -87.43 25.11 1.48 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.713 0.292 . . . . 0.0 111.324 -178.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.462 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 61.1 mmtt . . . . . 0 C--O 1.271 2.195 0 CA-C-O 118.087 -0.959 . . . . 0.0 110.866 179.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp . . . . . 0 CA--C 1.51 -0.573 0 CA-C-O 121.334 0.588 . . . . 0.0 109.748 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.505 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 35.7 m -73.75 166.07 23.97 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.466 -176.36 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.541 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 72.5 p -90.61 173.32 8.11 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.231 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.1 m -71.81 -20.44 61.84 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 120.956 0.408 . . . . 0.0 109.997 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.89 -38.67 37.01 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.829 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.7 t -67.07 -20.72 65.87 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.225 0.536 . . . . 0.0 110.04 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.541 ' HG2' ' O ' ' A' ' 11' ' ' THR . 27.9 mmt180 -67.36 -25.94 66.22 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.048 177.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.2 m -85.75 147.08 26.5 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.035 -179.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.541 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 10.2 pt-20 -132.15 126.91 20.75 Favored Pre-proline 0 C--N 1.32 -0.699 0 CA-C-O 120.678 0.275 . . . . 0.0 111.052 -179.619 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 30.6 Cg_endo -63.25 160.53 60.41 Favored 'Cis proline' 0 C--O 1.241 0.662 0 C-N-CA 123.27 -1.554 . . . . 0.0 112.302 -0.694 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 32.3 t -52.96 149.15 6.78 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.888 0.743 . . . . 0.0 112.167 -176.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.403 ' HA ' ' OE1' ' A' ' 20' ' ' GLN . 16.3 mm-40 -122.7 14.18 10.09 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -176.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 63.8 m -61.31 -67.97 0.36 Allowed 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.027 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 60.04 -96.34 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 121.084 -0.579 . . . . 0.0 112.31 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.3 t -91.35 -29.24 17.22 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.747 0.308 . . . . 0.0 110.698 179.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -103.18 73.86 1.25 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -177.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 42.4 t -103.02 136.42 42.88 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 174.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -142.93 22.49 1.93 Allowed 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.505 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 91.3 m -69.48 143.52 53.48 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.605 -178.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.98 -171.27 47.16 Favored Glycine 0 N--CA 1.433 -1.557 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 176.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -63.75 -21.79 66.58 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.092 0.473 . . . . 0.0 110.633 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.68 63.27 4.48 Favored Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.301 178.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 50.4 t -133.02 128.64 36.77 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 178.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.8 t -106.35 9.27 31.91 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.082 0.468 . . . . 0.0 110.61 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 36.9 t -91.64 129.17 37.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.129 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -96.91 7.06 47.46 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.961 0.41 . . . . 0.0 111.132 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -82.46 -37.62 25.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.135 0.493 . . . . 0.0 111.006 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 9.9 p -103.04 -41.43 6.11 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.989 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.5 ttpt -69.38 103.16 1.93 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.161 0.505 . . . . 0.0 110.535 -179.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.8 t -106.15 169.01 8.75 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.375 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.9 t -149.91 145.0 26.26 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -178.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -99.43 -24.16 14.88 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -179.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.2 m -66.41 140.21 58.04 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 75.0 p -113.66 177.64 4.56 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.88 0.371 . . . . 0.0 111.507 -175.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.506 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 17.6 m -70.32 -9.66 56.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.869 179.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -69.44 -40.71 77.03 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 176.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 170.28 149.27 6.3 Favored Glycine 0 N--CA 1.44 -1.073 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.885 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.1 t -69.95 146.64 51.01 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 178.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -115.34 -38.71 3.74 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.66 -177.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.514 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 11.7 p -75.37 -35.47 61.1 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.359 -176.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.8 -0.15 30.41 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.601 -0.809 . . . . 0.0 113.014 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.433 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.1 mmtt -82.8 0.23 44.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.863 0.363 . . . . 0.0 110.393 179.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 67.34 50.32 0.97 Allowed 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.705 178.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 17.7 p -124.74 152.85 43.27 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.238 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.506 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 23.7 p -134.03 38.34 3.18 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-O 121.199 0.523 . . . . 0.0 110.966 -178.655 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 142.78 161.95 9.04 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -177.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -50.04 -42.92 44.31 Favored 'Trans proline' 0 N--CA 1.481 0.739 0 C-N-CA 123.411 2.741 . . . . 0.0 113.918 -177.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -65.4 -38.29 89.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.911 0.386 . . . . 0.0 111.5 -178.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.6 t -92.64 8.95 36.85 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.96 0.409 . . . . 0.0 110.126 -179.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 50.3 t -100.4 136.19 40.66 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.764 -178.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -126.43 16.71 7.66 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.653 0.74 . . . . 0.0 109.376 178.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.433 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 11.8 m -83.26 149.54 26.72 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.072 -178.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -83.12 -155.69 19.64 Favored Glycine 0 N--CA 1.443 -0.882 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 176.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 28.6 m -78.64 -33.5 47.19 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 120.849 0.357 . . . . 0.0 111.139 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.1 m -83.75 67.85 9.67 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.991 -177.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 11.2 t -142.45 161.99 36.62 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-O 120.933 0.397 . . . . 0.0 111.028 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.9 m -68.17 -33.25 74.11 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.998 -177.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.514 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 16.0 p -84.18 11.42 8.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.696 0.284 . . . . 0.0 111.443 -177.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm . . . . . 0 C--O 1.259 1.587 0 CA-C-O 117.246 -1.359 . . . . 0.0 111.341 -179.296 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt . . . . . 0 N--CA 1.449 -0.516 0 CA-C-O 120.886 0.374 . . . . 0.0 110.347 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 86.7 m -70.68 165.88 21.98 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.427 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.492 HG21 ' H ' ' A' ' 26' ' ' GLN . 55.2 p -100.96 174.32 6.07 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.372 -179.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.1 m -74.87 -20.2 59.84 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 176.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.475 ' HB3' ' C ' ' A' ' 20' ' ' GLN . . . -74.72 -33.04 62.31 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.374 178.262 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.512 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 42.7 t -74.38 -12.38 60.5 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.596 0.712 . . . . 0.0 109.325 177.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.0 mmt180 -86.15 -1.0 57.02 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.953 176.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.3 m -96.54 154.4 17.3 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 120.847 0.356 . . . . 0.0 111.1 -178.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -136.26 112.46 10.21 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.755 178.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -66.82 165.28 66.54 Favored 'Cis proline' 0 C--N 1.356 0.927 0 C-N-CA 123.607 -1.414 . . . . 0.0 112.417 -0.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.512 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 5.1 t -57.81 151.84 16.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.494 -176.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.475 ' C ' ' HB3' ' A' ' 13' ' ' ALA . 27.8 mm-40 -129.52 17.51 5.88 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -174.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.0 m -66.74 -76.6 0.08 Allowed 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 57.47 -114.36 5.46 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 121.036 -0.602 . . . . 0.0 112.66 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.4 p -76.53 -17.99 58.95 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.84 0.352 . . . . 0.0 111.351 -178.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -101.13 20.87 14.84 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.348 -177.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.0 t -72.93 119.24 16.89 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 121.442 0.639 . . . . 0.0 111.122 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.492 ' H ' HG21 ' A' ' 11' ' ' THR . 76.4 mt-30 -121.42 6.75 10.1 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.833 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 93.8 m -55.87 117.52 3.76 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.368 -178.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -87.76 -170.52 46.27 Favored Glycine 0 N--CA 1.44 -1.088 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.009 -179.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -63.84 115.01 4.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.411 0.624 . . . . 0.0 110.349 179.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 143.16 -14.1 2.33 Favored Glycine 0 N--CA 1.442 -0.937 0 N-CA-C 110.934 -0.866 . . . . 0.0 110.934 -177.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.3 t -75.27 151.39 38.37 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 177.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.6 t -136.72 15.7 3.12 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 121.537 0.685 . . . . 0.0 109.921 -178.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.5 t -93.28 122.97 36.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.269 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -84.67 5.98 25.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -177.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.99 -34.62 32.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.141 0.496 . . . . 0.0 110.781 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 2.6 p -108.72 -33.2 7.06 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.197 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -63.2 110.5 1.88 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.656 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.3 t -111.29 170.0 8.41 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.518 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 41.7 t -157.06 149.23 22.92 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -116.5 -7.67 11.63 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 72.4 m -81.64 132.15 35.29 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 32.7 p -112.98 177.84 4.49 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-O 120.622 0.248 . . . . 0.0 111.596 -174.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.4 p -60.09 -16.99 36.53 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.386 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -57.59 -37.77 73.77 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 176.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 154.85 152.66 6.21 Favored Glycine 0 N--CA 1.43 -1.766 0 N-CA-C 110.534 -1.027 . . . . 0.0 110.534 -179.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 43.3 t -67.87 144.89 55.08 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -117.35 -21.48 8.68 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.543 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 12.2 p -89.76 -32.42 16.97 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.13 -177.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.8 -5.31 14.17 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.469 -0.872 . . . . 0.0 113.252 178.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.678 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 67.2 mmtt -79.99 -5.23 55.34 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.932 0.366 . . . . 0.0 111.05 -179.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 68.6 23.89 7.08 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.775 -178.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 25.5 p -93.18 151.29 19.92 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.266 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.3 p -139.46 81.85 1.85 Allowed 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.078 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.23 153.48 15.28 Favored Glycine 0 C--O 1.223 -0.539 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.03 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -53.43 -40.75 77.33 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 123.324 2.683 . . . . 0.0 113.755 -177.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -73.24 -23.13 60.31 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.017 0.437 . . . . 0.0 111.501 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.1 t -105.0 12.11 32.66 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.222 0.534 . . . . 0.0 109.974 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.424 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 37.1 t -101.63 150.72 22.81 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.713 -177.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -110.43 -27.54 8.97 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.166 0.508 . . . . 0.0 109.818 176.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.678 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.0 OUTLIER -63.4 126.7 28.34 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.746 -178.504 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -86.95 -60.61 1.66 Allowed Glycine 0 N--CA 1.442 -0.943 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.917 -179.299 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.7 t -157.12 171.35 20.6 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.8 m 64.85 23.77 12.69 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.446 0.698 . . . . 0.0 111.969 178.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . 0.402 ' SG ' ' N ' ' A' ' 65' ' ' SER . 46.3 t -106.58 169.76 8.34 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 120.884 -0.327 . . . . 0.0 110.798 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.402 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 36.2 m -71.36 -22.14 61.94 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.075 -178.226 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.543 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 18.4 p -93.68 18.29 10.41 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.867 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.424 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 63.2 mmtt . . . . . 0 C--O 1.261 1.708 0 CA-C-O 117.478 -1.249 . . . . 0.0 110.051 179.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.564 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 88.4 mttt . . . . . 0 N--CA 1.444 -0.726 0 CA-C-O 120.674 0.273 . . . . 0.0 111.327 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.557 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 89.8 m -77.65 153.81 32.78 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 176.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.443 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 46.9 p -91.72 168.06 11.74 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.799 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.0 m -67.91 -20.8 65.13 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.189 0.518 . . . . 0.0 109.768 177.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.49 -38.55 59.46 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.735 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.473 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 52.9 t -70.82 -22.46 62.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.371 0.605 . . . . 0.0 110.016 178.525 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.443 ' HG3' ' O ' ' A' ' 11' ' ' THR . 40.2 mtp180 -89.74 20.29 4.17 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.983 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.5 m -113.47 171.56 7.49 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.564 178.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -129.83 112.89 17.54 Favored Pre-proline 0 CA--C 1.54 0.56 0 CA-C-O 120.675 0.274 . . . . 0.0 110.958 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -79.27 -172.8 11.72 Favored 'Cis proline' 0 C--N 1.348 0.535 0 C-N-CA 123.89 -1.296 . . . . 0.0 111.598 -0.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.7 t -61.15 137.36 58.24 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.763 0.316 . . . . 0.0 110.158 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -121.35 26.78 8.69 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.429 -175.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.473 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 77.6 m -88.34 17.71 5.02 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.746 0.308 . . . . 0.0 111.622 -178.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.38 107.1 1.33 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 121.296 -0.478 . . . . 0.0 113.145 -178.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.6 m 64.36 18.54 11.37 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.083 0.553 . . . . 0.0 111.768 178.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -146.01 29.51 1.09 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.822 0.82 . . . . 0.0 108.811 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 34.1 t -84.98 149.5 25.56 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.362 -175.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.1 mm-40 -146.41 14.84 1.27 Allowed 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.339 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.564 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 60.0 m -66.44 136.37 55.62 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 121.247 0.546 . . . . 0.0 112.153 -178.367 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -106.21 -151.44 19.13 Favored Glycine 0 N--CA 1.44 -1.083 0 CA-C-N 115.195 -0.911 . . . . 0.0 112.1 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.438 ' HG2' ' HD2' ' A' ' 9' ' ' LYS . 13.6 pt-20 -65.05 155.12 35.77 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.952 0.406 . . . . 0.0 110.314 178.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.76 -35.46 4.83 Favored Glycine 0 N--CA 1.444 -0.811 0 N-CA-C 110.779 -0.929 . . . . 0.0 110.779 -177.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.8 t -80.96 128.93 34.24 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 121.059 0.457 . . . . 0.0 110.301 178.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.426 ' HA ' ' NZ ' ' A' ' 37' ' ' LYS . 6.4 t -123.56 18.45 9.62 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 121.407 0.622 . . . . 0.0 110.101 177.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 52.7 t -63.85 123.95 20.26 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.568 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.19 -10.46 59.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.991 -177.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.2 -41.47 61.36 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -178.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.6 p -111.37 -13.48 13.9 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -177.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.426 ' NZ ' ' HA ' ' A' ' 32' ' ' THR . 39.5 ttmt -77.89 108.43 11.13 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.576 177.301 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.9 t -124.91 162.45 24.39 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.78 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.5 t -143.11 156.71 44.86 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 120.678 0.275 . . . . 0.0 110.677 -178.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -107.59 -21.04 13.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.79 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 77.0 m -78.91 136.73 37.36 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 175.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.5 p -119.46 -177.12 3.29 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 -175.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.7 p -62.4 -12.48 21.84 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.76 -178.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -67.18 -29.46 69.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.206 0.527 . . . . 0.0 109.892 176.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 148.74 157.6 7.64 Favored Glycine 0 N--CA 1.44 -1.087 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.861 179.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 53.3 t -72.73 134.91 45.22 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -121.33 -3.17 9.46 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.599 -177.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 1.2 p -99.02 -37.74 9.24 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.146 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.82 19.12 5.38 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.696 -0.764 . . . . 0.0 113.037 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -113.61 8.25 17.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 117.035 0.418 . . . . 0.0 111.124 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 64.61 17.42 10.89 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.689 178.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 17.3 p -89.89 153.35 20.7 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.283 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.9 p -139.17 40.3 2.1 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.95 0.405 . . . . 0.0 110.724 -179.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.42 163.88 10.02 Favored Glycine 0 N--CA 1.439 -1.155 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.409 -178.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.3 -28.94 86.36 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.108 2.539 . . . . 0.0 113.918 -176.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -74.3 -36.78 63.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.858 0.361 . . . . 0.0 111.019 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.2 p -93.96 -10.6 33.16 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.091 0.472 . . . . 0.0 111.03 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 45.6 t -69.63 133.48 47.63 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.664 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -112.71 -7.2 13.83 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.843 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.538 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 9.0 m -64.33 124.79 22.64 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.315 -177.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.25 50.07 3.57 Favored Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.486 -179.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 57.6 m 66.34 -177.31 0.19 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.102 0.561 . . . . 0.0 111.127 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.3 m 66.19 6.85 4.43 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.36 0.6 . . . . 0.0 111.048 -178.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.7 t -100.09 167.5 10.43 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.064 -179.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.2 p -65.97 -30.18 70.69 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -176.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 22.0 p -94.36 -4.49 48.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.77 0.319 . . . . 0.0 111.454 -177.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.538 ' HE3' ' O ' ' A' ' 60' ' ' CYS . 1.8 mmmp? . . . . . 0 C--O 1.27 2.162 0 CA-C-O 118.016 -0.992 . . . . 0.0 111.342 -178.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 12.1 mptt . . . . . 0 CA--C 1.504 -0.8 0 CA-C-O 121.104 0.478 . . . . 0.0 110.314 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.1 m -83.49 168.73 16.2 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 121.841 0.829 . . . . 0.0 112.034 -177.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.458 HG21 ' H ' ' A' ' 26' ' ' GLN . 59.9 p -100.19 168.68 9.65 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-N 114.381 -1.282 . . . . 0.0 109.309 178.033 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.0 m -67.62 -17.55 64.65 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.349 0.595 . . . . 0.0 109.764 177.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.474 ' HB3' ' C ' ' A' ' 20' ' ' GLN . . . -79.57 -39.48 31.66 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.718 -178.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 50.2 t -69.99 -25.48 63.63 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.183 0.516 . . . . 0.0 110.475 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 -83.43 8.64 13.22 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.828 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.8 t -115.46 148.53 39.32 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 177.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.523 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 16.3 pt-20 -124.82 130.12 24.35 Favored Pre-proline 0 C--N 1.323 -0.551 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.984 179.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.523 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 15.2 Cg_exo -66.97 166.94 59.94 Favored 'Cis proline' 0 C--N 1.35 0.627 0 C-N-CA 123.095 -1.627 . . . . 0.0 111.92 -0.029 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.2 t -56.35 123.18 13.77 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.186 -178.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.474 ' C ' ' HB3' ' A' ' 13' ' ' ALA . 84.2 mm-40 -100.86 19.69 16.76 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.953 -175.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 56.3 m -85.35 8.15 19.82 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.68 -23.93 69.29 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.289 -0.957 . . . . 0.0 110.821 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.2 p -99.05 -56.33 2.46 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.218 -0.491 . . . . 0.0 110.228 178.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -121.99 113.85 20.14 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.966 -178.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 17.3 t -130.97 129.65 42.39 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-O 121.001 0.429 . . . . 0.0 110.235 176.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.458 ' H ' HG21 ' A' ' 11' ' ' THR . 8.4 tt0 -143.11 14.69 1.87 Allowed 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.308 -178.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 72.6 m -59.61 131.44 50.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.657 -177.04 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.25 -156.15 32.48 Favored Glycine 0 N--CA 1.441 -0.985 0 CA-C-N 115.077 -0.965 . . . . 0.0 113.952 -176.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -67.42 148.27 51.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.249 -0.476 . . . . 0.0 111.016 -179.012 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.9 -26.47 24.34 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.426 -178.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 48.6 t -77.36 116.76 18.22 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-O 121.089 0.471 . . . . 0.0 109.845 179.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.8 t -115.35 17.6 16.44 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.017 -179.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 47.1 t -62.08 110.07 1.48 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.467 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.51 -13.4 13.66 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -176.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.19 -53.19 15.31 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.445 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.9 p -102.75 -9.45 19.99 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -72.14 103.89 3.45 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.453 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 12.7 t -120.24 166.98 12.75 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.194 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.454 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 40.6 t -159.55 143.54 14.8 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.155 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -102.22 -15.7 16.55 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -179.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 76.5 m -77.93 136.37 38.0 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 175.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.1 p -115.08 -178.76 3.45 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -175.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.9 p -61.05 -15.15 29.13 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.101 -179.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -66.74 -33.67 76.15 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.209 0.528 . . . . 0.0 109.959 177.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 154.33 160.14 9.64 Favored Glycine 0 N--CA 1.435 -1.393 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.123 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.3 t -76.71 151.09 36.22 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -135.45 7.77 3.34 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 179.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.8 p -116.31 -19.61 10.1 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.855 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.25 14.91 29.36 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.683 -0.77 . . . . 0.0 113.494 178.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.619 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 42.1 mmtm -103.65 4.44 35.52 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 117.046 0.423 . . . . 0.0 111.25 179.212 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 62.26 21.49 12.52 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.244 178.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.4 p -95.35 146.7 24.19 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.376 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 47.4 p -133.05 38.91 3.33 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.244 0.545 . . . . 0.0 110.171 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.95 162.5 9.44 Favored Glycine 0 N--CA 1.436 -1.332 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -177.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.454 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 13.8 Cg_endo -56.66 -28.58 75.96 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.937 2.425 . . . . 0.0 112.713 -178.122 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -68.23 -35.61 78.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.724 -178.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.3 p -105.27 8.44 33.87 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.228 0.537 . . . . 0.0 110.841 -179.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 42.6 t -92.32 123.36 35.59 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.131 -176.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -90.42 -22.63 21.34 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.996 177.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.619 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.9 m -62.37 146.63 50.77 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.217 -177.598 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -105.49 -86.66 1.93 Allowed Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 110.954 -0.859 . . . . 0.0 110.954 177.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.1 m -130.16 171.75 12.52 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 178.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 37.8 m 64.61 33.81 10.4 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 177.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 35.3 t -119.73 160.38 22.66 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.68 0.276 . . . . 0.0 110.266 177.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.3 m -65.8 -23.03 66.61 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -178.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.508 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 8.9 p -95.01 13.42 25.12 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.293 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.508 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 47.2 mmtm . . . . . 0 C--O 1.259 1.56 0 CA-C-O 117.112 -1.423 . . . . 0.0 110.912 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 67.8 mttm . . . . . 0 CA--C 1.505 -0.767 0 CA-C-O 120.995 0.426 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 85.9 m -89.15 177.12 6.71 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-O 121.348 0.594 . . . . 0.0 111.663 -177.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.522 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 40.7 p -108.68 171.77 7.23 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.072 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.1 m -70.79 -26.9 63.53 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.47 -38.55 81.14 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.387 178.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 52.7 t -72.11 -34.6 68.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.244 178.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 11' ' ' THR . 70.3 mtp180 -65.87 -29.04 69.42 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.275 178.42 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 49.1 m -67.77 152.25 45.89 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.142 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -126.26 120.04 23.57 Favored Pre-proline 0 C--N 1.318 -0.77 0 CA-C-O 120.763 0.316 . . . . 0.0 111.048 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -73.77 174.6 50.13 Favored 'Cis proline' 0 C--O 1.237 0.442 0 C-N-CA 123.426 -1.489 . . . . 0.0 112.141 0.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.0 t -55.5 136.22 50.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.092 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -111.98 17.6 19.54 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.289 0.566 . . . . 0.0 110.703 -178.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.402 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 93.3 m -81.85 29.54 0.39 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.333 -179.041 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.52 -45.72 95.29 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 176.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.2 m -131.58 4.29 4.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.048 0.451 . . . . 0.0 110.098 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -118.61 31.14 6.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.24 -177.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.547 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 16.7 t -82.97 127.28 33.39 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.13 -0.628 . . . . 0.0 111.18 -178.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.46 ' HB2' ' CG2' ' A' ' 11' ' ' THR . 84.4 mt-30 -142.77 18.83 1.99 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.181 -0.918 . . . . 0.0 108.904 -178.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 86.5 m -67.33 145.66 54.88 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.415 -176.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -96.62 -154.59 30.26 Favored Glycine 0 N--CA 1.438 -1.187 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.312 177.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -78.38 14.46 1.22 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.053 0.454 . . . . 0.0 111.263 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -110.21 34.62 5.31 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 121.102 -0.571 . . . . 0.0 111.865 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.5 t -130.92 148.68 52.71 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.045 0.45 . . . . 0.0 110.346 179.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.9 t -136.53 16.8 3.13 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.35 178.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.6 t -80.63 124.47 29.02 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.362 -178.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -81.18 9.11 7.34 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.439 -178.467 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -93.14 -13.08 28.91 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.976 0.417 . . . . 0.0 110.806 179.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.547 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 7.5 p -139.15 -27.78 0.8 Allowed 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 116.125 -0.488 . . . . 0.0 112.144 -178.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.413 ' HE3' ' O ' ' A' ' 60' ' ' CYS . 88.0 tttt -79.44 126.81 31.32 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 178.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.0 t -132.33 175.26 9.42 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.854 -177.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.428 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 40.6 t -158.92 148.26 18.85 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.346 -179.005 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -109.46 -12.35 14.72 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 179.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.7 m -81.07 133.63 35.51 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 177.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 75.4 p -113.73 176.6 4.96 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.412 -176.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.44 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 22.7 t -62.66 -18.71 62.85 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.905 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -64.86 -20.6 66.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.482 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.84 146.7 4.38 Favored Glycine 0 N--CA 1.439 -1.145 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.399 178.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 38.1 t -75.32 142.33 43.25 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -120.41 -6.92 9.78 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.458 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 11.2 p -99.71 -38.09 8.84 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.833 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.49 -0.98 16.11 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.67 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.632 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 73.4 mmtt -84.96 0.52 51.0 Favored 'General case' 0 C--O 1.239 0.551 0 O-C-N 122.625 -0.338 . . . . 0.0 110.852 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 63.92 35.39 10.9 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.268 178.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 24.1 p -107.85 155.48 20.21 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.901 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.44 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 50.1 p -140.75 50.18 1.67 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 120.971 0.415 . . . . 0.0 110.676 179.105 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 133.87 154.05 7.21 Favored Glycine 0 C--O 1.225 -0.429 0 C-N-CA 120.449 -0.881 . . . . 0.0 112.368 -179.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.428 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 76.0 Cg_exo -50.25 -41.46 50.27 Favored 'Trans proline' 0 C--N 1.36 1.139 0 C-N-CA 123.687 2.925 . . . . 0.0 114.022 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -64.37 -34.86 79.13 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.779 0.323 . . . . 0.0 111.616 -177.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 41.7 m -107.06 21.94 16.77 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.314 0.578 . . . . 0.0 110.079 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.468 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 49.4 t -98.45 123.88 42.84 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.671 -178.098 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -91.55 -17.67 25.28 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.865 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.632 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.7 m -71.66 154.05 41.65 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.797 -178.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.483 ' O ' ' HE3' ' A' ' 67' ' ' LYS . . . -92.76 -106.84 1.71 Allowed Glycine 0 N--CA 1.443 -0.871 0 C-N-CA 120.682 -0.77 . . . . 0.0 111.962 178.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.5 p -124.62 -26.0 3.91 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 120.894 0.378 . . . . 0.0 111.198 -179.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.3 m -89.4 50.05 1.86 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.36 -177.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 34.8 t -125.19 168.06 13.97 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 120.963 0.411 . . . . 0.0 111.345 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -70.25 -28.5 65.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.792 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.458 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 18.2 p -84.77 16.96 2.99 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.977 0.418 . . . . 0.0 111.122 -179.095 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.483 ' HE3' ' O ' ' A' ' 61' ' ' GLY . 58.0 mmtt . . . . . 0 C--O 1.26 1.624 0 CA-C-O 117.585 -1.198 . . . . 0.0 110.691 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.514 -0.435 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.534 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 87.7 m -65.94 136.72 56.47 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.18 176.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.625 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 68.7 p -72.76 171.46 12.56 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.07 -178.051 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.8 m -70.18 -11.78 61.14 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.327 0.584 . . . . 0.0 109.904 177.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.76 -39.21 15.11 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.338 -179.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.549 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 54.0 t -73.26 -24.11 60.41 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.005 0.431 . . . . 0.0 111.316 -179.101 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.625 ' HG3' ' O ' ' A' ' 11' ' ' THR . 86.9 mtt180 -73.59 -10.53 59.8 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.093 0.473 . . . . 0.0 110.188 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 30.8 t -88.84 159.99 17.45 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.132 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -131.82 116.96 16.05 Favored Pre-proline 0 C--N 1.317 -0.838 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.985 177.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -73.51 176.01 43.42 Favored 'Cis proline' 0 C--O 1.242 0.704 0 C-N-CA 123.536 -1.444 . . . . 0.0 112.583 1.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.2 t -59.72 141.07 55.9 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.807 -179.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -115.75 11.82 15.76 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.372 -178.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.549 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 58.1 m -81.89 20.46 0.97 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.733 0.301 . . . . 0.0 111.667 -179.057 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.5 108.29 2.13 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.075 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.1 m 63.03 15.09 8.14 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.18 0.592 . . . . 0.0 111.421 -178.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -152.31 81.4 1.25 Allowed 'General case' 0 N--CA 1.438 -1.027 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.436 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 49.5 t -130.38 150.27 51.68 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.172 -176.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -148.12 23.19 1.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.256 178.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 35.2 m -65.59 171.43 4.13 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.227 0.537 . . . . 0.0 112.361 -178.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.21 -165.7 40.08 Favored Glycine 0 N--CA 1.438 -1.173 0 CA-C-N 115.639 -0.71 . . . . 0.0 113.01 -177.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -84.23 -24.2 30.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 120.919 0.39 . . . . 0.0 110.975 -178.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -91.51 48.51 2.86 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.796 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 21.5 t -120.64 126.71 50.93 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.8 t -109.02 7.97 26.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.262 -178.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.2 t -69.17 115.1 8.06 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.299 179.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.86 -5.36 29.9 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -176.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.16 -40.9 51.45 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.805 0.336 . . . . 0.0 111.044 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.431 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 7.8 p -111.38 -18.45 12.89 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.934 -178.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -80.48 113.49 18.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.786 0.327 . . . . 0.0 110.347 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.457 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 12.6 t -120.72 167.11 12.82 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.741 -178.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.465 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 41.7 t -156.4 145.12 20.12 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 178.385 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -102.43 -13.52 17.23 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.498 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 70.0 m -88.9 135.63 33.43 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 175.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 81.4 p -127.94 -166.65 1.65 Allowed 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.571 -177.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.3 m -60.61 -15.04 24.04 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 120.91 0.386 . . . . 0.0 110.723 178.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -67.75 -30.22 69.63 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.634 178.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 147.55 157.97 7.67 Favored Glycine 0 N--CA 1.439 -1.152 0 C-N-CA 120.991 -0.623 . . . . 0.0 112.209 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.5 t -87.76 135.12 33.51 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.422 ' NZ ' ' HB3' ' A' ' 47' ' ' LYS . 8.0 mtpm? -126.75 5.46 6.69 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -179.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.449 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 13.7 p -99.63 -32.05 11.27 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 119.984 -0.686 . . . . 0.0 110.138 178.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.69 5.97 25.35 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.888 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.697 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 74.4 mmtt -93.32 0.43 56.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 117.03 0.415 . . . . 0.0 111.334 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 64.19 30.65 13.59 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.568 0.699 . . . . 0.0 110.624 178.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.0 p -104.17 151.34 23.45 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.243 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 26.7 p -140.25 79.7 1.72 Allowed 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.084 0.469 . . . . 0.0 110.025 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.9 152.38 13.9 Favored Glycine 0 N--CA 1.442 -0.918 0 C-N-CA 121.13 -0.557 . . . . 0.0 111.858 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.465 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 11.4 Cg_endo -54.31 -34.62 80.85 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 123.435 2.757 . . . . 0.0 113.32 -177.701 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -64.05 -36.35 83.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.968 0.413 . . . . 0.0 111.378 -178.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.3 m -106.86 22.96 15.13 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.691 -177.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 26.6 t -113.54 139.45 48.97 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.127 -178.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -124.72 12.79 8.58 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.851 0.357 . . . . 0.0 110.872 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.697 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 8.1 m -76.85 148.75 36.34 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.77 -179.021 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.671 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -81.79 -170.0 43.66 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 177.52 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.6 m -86.62 10.37 15.77 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 117.121 0.46 . . . . 0.0 111.616 -177.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.4 t -116.92 31.61 6.65 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.182 0.515 . . . . 0.0 109.866 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . 0.4 ' SG ' ' N ' ' A' ' 65' ' ' SER . 42.4 t -109.11 167.86 9.79 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.227 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.4 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 31.2 t -68.49 -29.27 67.84 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.451 -178.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.49 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 14.1 p -90.5 23.73 2.89 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.199 0.523 . . . . 0.0 110.411 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.671 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 47.3 mmtm . . . . . 0 C--O 1.273 2.29 0 CA-C-O 117.713 -1.137 . . . . 0.0 110.768 -179.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.519 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 25.9 mtmm . . . . . 0 CA--C 1.518 -0.28 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 10.7 m -82.09 162.2 22.61 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 174.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 80.6 p -100.54 -177.62 3.55 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 120.841 0.353 . . . . 0.0 110.616 -178.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.4 m -80.61 -30.26 36.81 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 175.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.66 -30.59 68.31 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.333 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.533 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 52.0 t -71.58 -22.76 61.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.169 0.509 . . . . 0.0 110.578 178.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -87.03 -2.65 58.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.914 0.388 . . . . 0.0 110.684 179.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.4 m -80.14 168.94 18.49 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.799 -179.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -136.63 108.84 9.31 Favored Pre-proline 0 C--N 1.32 -0.713 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.736 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -74.64 178.77 32.78 Favored 'Cis proline' 0 C--O 1.24 0.62 0 C-N-CA 123.535 -1.444 . . . . 0.0 111.919 -0.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.533 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 16.7 t -58.72 138.91 56.82 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -179.469 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 87.9 mm-40 -114.37 24.33 12.01 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -174.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.55 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 63.9 m -96.67 29.39 3.0 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.831 0.348 . . . . 0.0 110.555 178.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.06 -53.23 47.48 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.875 -0.602 . . . . 0.0 113.068 -179.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -111.51 -6.9 14.36 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.784 0.326 . . . . 0.0 111.339 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -139.07 91.72 2.54 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.863 0.363 . . . . 0.0 110.435 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 44.0 t -118.43 128.23 54.41 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.91 -179.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -127.0 15.92 7.34 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.612 178.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.519 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 93.5 m -70.01 132.41 45.87 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 121.208 0.528 . . . . 0.0 110.513 179.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.75 -166.95 42.29 Favored Glycine 0 N--CA 1.437 -1.275 0 CA-C-N 115.226 -0.897 . . . . 0.0 113.654 -176.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -53.74 -26.44 23.34 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.039 0.936 . . . . 0.0 112.167 -179.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -90.08 47.65 3.15 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 120.642 -0.79 . . . . 0.0 113.447 -177.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 49.8 t -120.44 139.35 52.98 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 117.117 0.459 . . . . 0.0 109.899 177.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.6 t -123.15 18.68 9.96 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 121.417 0.627 . . . . 0.0 109.857 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 42.9 t -93.54 113.54 25.68 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.586 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.39 -4.32 29.38 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.673 -179.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.68 -41.04 39.51 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.334 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 19.8 p -106.95 -15.3 14.74 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.914 0.388 . . . . 0.0 111.979 -178.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -85.64 102.05 13.24 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.564 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.4 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 11.0 t -108.18 178.52 4.48 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.297 179.543 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 48.1 t -156.72 149.13 23.34 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -106.78 -17.05 14.32 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 73.9 m -76.62 137.27 39.37 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 176.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 65.6 p -93.39 170.13 9.85 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.852 -173.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.482 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 20.2 m -69.38 -4.17 17.28 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.3 -179.253 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -84.02 -31.78 25.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.814 179.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 172.3 156.76 12.82 Favored Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.378 -179.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 53.8 t -74.84 142.18 44.19 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.704 0.287 . . . . 0.0 110.519 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.481 ' HZ2' ' HB3' ' A' ' 47' ' ' LYS . 7.1 mtpm? -117.42 -18.6 9.79 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.735 -178.443 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 7.2 p -93.3 -33.23 14.0 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.857 -178.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.15 4.76 23.78 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.507 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.0 mmmp? -92.16 10.64 28.53 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 122.577 -0.366 . . . . 0.0 111.229 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 63.12 24.19 14.31 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.917 176.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 8.2 p -102.6 143.99 31.57 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.599 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.482 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 68.5 p -132.34 52.47 2.07 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-O 121.195 0.521 . . . . 0.0 110.198 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.87 161.18 9.79 Favored Glycine 0 N--CA 1.445 -0.704 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.52 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.33 -41.12 68.45 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.518 2.812 . . . . 0.0 114.129 -177.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -74.44 -22.96 58.87 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.012 0.434 . . . . 0.0 111.134 -178.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.4 m -96.44 -0.46 49.14 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.873 179.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 44.1 t -98.26 147.65 24.42 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.082 -176.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -138.16 11.59 2.82 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.935 0.874 . . . . 0.0 108.832 176.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.2 m -81.71 142.49 32.63 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.618 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.422 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -67.53 167.31 41.02 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.453 -0.88 . . . . 0.0 111.332 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 30.7 m -69.18 5.68 1.17 Allowed 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -178.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 33.5 t -108.7 5.7 25.04 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.652 0.263 . . . . 0.0 111.192 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 49.7 t -77.37 169.07 18.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.88 0.371 . . . . 0.0 111.105 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.8 m -64.62 -28.74 69.83 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.697 -178.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.431 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 18.7 p -89.82 25.7 2.0 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.007 0.432 . . . . 0.0 110.763 -179.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.431 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 47.9 mmtm . . . . . 0 C--O 1.263 1.773 0 CA-C-O 117.43 -1.272 . . . . 0.0 111.402 -178.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 N-CA-C 112.039 -0.424 . . . . 0.0 112.039 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.6 m -86.38 150.14 24.52 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.796 0.332 . . . . 0.0 110.662 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 126.33 -18.06 6.52 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -110.32 119.04 37.95 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.906 0.384 . . . . 0.0 110.48 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 134.86 -164.3 24.73 Favored Glycine 0 N--CA 1.438 -1.193 0 N-CA-C 111.296 -0.721 . . . . 0.0 111.296 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.69 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 32.5 mmtp -125.53 171.42 10.53 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 120.838 0.352 . . . . 0.0 110.742 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -95.24 -178.11 37.34 Favored Glycine 0 N--CA 1.44 -1.085 0 C-N-CA 121.005 -0.617 . . . . 0.0 113.01 -177.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -77.53 -24.86 49.88 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.998 0.428 . . . . 0.0 110.81 -178.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.402 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 98.5 mttt -92.14 6.34 46.95 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.955 -178.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.69 ' SG ' ' HB3' ' A' ' 6' ' ' LYS . 68.4 m -69.47 156.48 38.8 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.008 0.432 . . . . 0.0 110.344 177.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 65.2 p -92.71 169.24 10.64 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.071 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.8 m -73.99 -11.27 60.29 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.85 -42.96 18.88 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.25 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.419 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 44.8 t -69.84 -23.42 63.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.325 0.583 . . . . 0.0 110.582 178.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -85.78 5.37 32.75 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.991 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.8 t -110.04 156.88 19.94 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.93 -0.766 . . . . 0.0 108.93 177.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.448 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 6.7 pt-20 -126.17 126.67 24.74 Favored Pre-proline 0 C--N 1.322 -0.604 0 C-N-CA 121.084 -0.246 . . . . 0.0 110.361 177.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.448 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 11.7 Cg_exo -68.8 170.93 51.78 Favored 'Cis proline' 0 C--N 1.346 0.425 0 C-N-CA 123.236 -1.568 . . . . 0.0 111.98 0.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t -60.09 116.74 4.4 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.645 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -86.23 8.69 20.15 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.433 -176.066 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 79.7 m -78.5 6.46 8.54 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.663 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.08 -20.62 65.04 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.962 -0.637 . . . . 0.0 111.61 177.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.5 m -143.37 23.55 1.81 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.055 0.455 . . . . 0.0 110.325 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 87.0 tttt -170.89 81.71 0.08 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.161 -178.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.3 t -121.42 138.63 54.19 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.837 0.351 . . . . 0.0 111.15 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -153.48 20.98 0.55 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.659 -0.701 . . . . 0.0 109.967 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 70.9 m -68.53 146.85 52.74 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -175.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.88 -146.42 16.75 Favored Glycine 0 N--CA 1.442 -0.949 0 CA-C-N 114.939 -1.028 . . . . 0.0 113.227 -178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.414 ' H ' ' CD ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -75.74 -38.63 58.3 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 122.42 0.288 . . . . 0.0 111.65 -177.433 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.83 60.19 2.99 Favored Glycine 0 C--O 1.223 -0.561 0 C-N-CA 121.267 -0.492 . . . . 0.0 112.931 -178.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 35.7 t -153.81 111.3 3.48 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.887 0.375 . . . . 0.0 110.194 179.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 t -103.92 17.48 24.0 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.81 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.7 t -74.93 107.09 6.78 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.738 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.9 -10.34 56.62 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.664 -178.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.22 -36.36 83.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.91 0.386 . . . . 0.0 110.592 178.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 6.7 p -116.69 -15.2 10.79 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.792 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp -92.43 132.56 36.68 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.116 0.484 . . . . 0.0 111.561 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.0 t -136.25 153.61 51.15 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 177.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.9 t -147.43 154.36 40.73 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.59 0.233 . . . . 0.0 110.476 -178.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -112.73 -14.8 13.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.619 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 83.9 m -67.77 138.82 56.49 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 176.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.6 p -97.65 171.15 8.52 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.426 -171.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.5 m -71.49 -17.06 62.37 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -176.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -76.6 -21.67 55.26 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.931 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.401 ' O ' ' HE2' ' A' ' 47' ' ' LYS . . . 166.66 156.33 9.54 Favored Glycine 0 N--CA 1.434 -1.465 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.237 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 44.1 t -69.47 145.35 52.81 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.401 ' HE2' ' O ' ' A' ' 45' ' ' GLY . 71.8 mmtt -111.83 -35.92 5.58 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.691 0.282 . . . . 0.0 111.531 -177.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.417 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 2.8 p -76.99 -39.67 49.56 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.97 -177.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.87 4.4 19.05 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.657 -0.782 . . . . 0.0 113.468 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.417 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 11.3 mmpt? -90.39 3.32 54.14 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 117.231 0.516 . . . . 0.0 110.373 178.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 63.95 61.45 0.95 Allowed 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.842 -179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 9.5 p -136.92 145.26 44.07 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.238 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.5 p -132.04 70.15 1.47 Allowed 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.519 178.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 102.91 164.95 25.94 Favored Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.522 -0.846 . . . . 0.0 112.014 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -61.28 -11.68 20.3 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 C-N-CA 123.555 2.836 . . . . 0.0 113.221 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -69.97 -24.02 63.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.998 0.428 . . . . 0.0 111.321 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.6 m -144.79 29.77 1.21 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.058 0.456 . . . . 0.0 110.57 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 37.5 t -85.87 109.14 18.51 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.032 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 51.5 mttp -73.04 -25.15 60.83 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.659 0.742 . . . . 0.0 109.206 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.9 m -64.52 124.32 21.54 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 114.645 -1.161 . . . . 0.0 111.844 -176.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -97.38 56.38 1.22 Allowed Glycine 0 N--CA 1.443 -0.884 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 41.2 m 68.07 176.32 0.26 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.108 0.563 . . . . 0.0 111.116 -178.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.1 t 65.11 19.48 11.8 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 122.682 0.393 . . . . 0.0 111.658 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . 0.437 ' SG ' ' N ' ' A' ' 65' ' ' SER . 50.0 t -108.25 173.35 6.36 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.854 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.437 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 9.5 m -61.33 -37.73 84.33 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 122.878 0.471 . . . . 0.0 111.863 -178.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.503 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 31.9 p -84.51 17.41 2.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.995 0.426 . . . . 0.0 111.153 -178.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.503 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 43.0 mmtm . . . . . 0 C--O 1.263 1.763 0 CA-C-O 117.704 -1.141 . . . . 0.0 110.809 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.367 0 N-CA-C 112.227 -0.349 . . . . 0.0 112.227 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.3 t -66.69 120.91 14.28 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 152.07 -82.99 0.17 Allowed Glycine 0 N--CA 1.436 -1.313 0 C-N-CA 120.248 -0.977 . . . . 0.0 112.534 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -156.25 130.89 8.94 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.653 0.263 . . . . 0.0 111.578 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.06 -51.17 4.07 Favored Glycine 0 C--N 1.331 0.291 0 N-CA-C 114.984 0.754 . . . . 0.0 114.984 174.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.468 ' NZ ' ' SG ' ' A' ' 14' ' ' CYS . 24.6 mtpp -75.21 72.95 2.32 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -175.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -113.79 -103.21 2.55 Favored Glycine 0 N--CA 1.437 -1.269 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.38 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -82.0 -18.19 44.22 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.913 0.387 . . . . 0.0 111.204 -177.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -71.79 -27.33 62.87 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.844 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.0 m -76.35 153.66 35.63 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-O 121.422 0.629 . . . . 0.0 111.831 -179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.54 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 43.4 p -90.89 174.28 7.53 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.281 -177.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 m -69.85 -27.87 65.2 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.41 ' HB1' ' C ' ' A' ' 20' ' ' GLN . . . -68.6 -41.11 80.03 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.278 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.468 ' SG ' ' NZ ' ' A' ' 6' ' ' LYS . 44.4 t -70.82 -26.49 63.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.038 0.447 . . . . 0.0 110.255 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.54 ' HG3' ' O ' ' A' ' 11' ' ' THR . 22.2 mtm180 -82.01 -7.94 59.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.191 0.519 . . . . 0.0 110.126 178.202 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 49.0 m -91.87 156.22 17.65 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.371 178.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.432 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 7.5 pt-20 -132.04 125.75 20.26 Favored Pre-proline 0 C--N 1.311 -1.074 0 CA-C-O 120.689 0.28 . . . . 0.0 111.219 -178.472 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.432 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 55.3 Cg_endo -69.3 168.66 64.95 Favored 'Cis proline' 0 C--N 1.349 0.574 0 C-N-CA 123.159 -1.6 . . . . 0.0 112.001 -0.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.2 t -53.61 128.59 29.8 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.41 ' C ' ' HB1' ' A' ' 13' ' ' ALA . 31.0 mm-40 -108.14 19.74 19.56 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.189 -0.46 . . . . 0.0 112.031 -175.015 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 58.7 m -82.5 9.7 8.74 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -177.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.57 123.19 13.22 Favored Glycine 0 N--CA 1.442 -0.908 0 C-N-CA 120.63 -0.795 . . . . 0.0 111.376 177.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.1 m 72.74 1.83 4.14 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.439 0.696 . . . . 0.0 111.91 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -162.95 80.45 0.48 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 121.182 0.515 . . . . 0.0 110.471 177.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 47.4 t -112.62 137.22 51.18 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.365 177.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -136.95 17.95 3.02 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.973 -177.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 96.4 m -67.31 152.89 44.91 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.385 179.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.2 -144.55 5.64 Favored Glycine 0 N--CA 1.44 -1.035 0 C-N-CA 120.566 -0.826 . . . . 0.0 112.708 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.12 -18.44 23.54 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-O 121.007 0.432 . . . . 0.0 111.194 -179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -94.57 74.18 1.02 Allowed Glycine 0 N--CA 1.44 -1.088 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.04 178.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.405 ' O ' ' HD2' ' A' ' 37' ' ' LYS . 45.0 t -146.04 119.48 9.04 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.045 0.45 . . . . 0.0 109.917 177.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.8 t -102.66 14.74 31.2 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.057 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.3 t -76.56 118.88 19.66 Favored 'General case' 0 N--CA 1.461 0.122 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.97 -14.91 62.93 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -177.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.8 -52.43 30.21 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -178.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 6.1 p -99.0 -17.57 18.22 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -177.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.405 ' HD2' ' O ' ' A' ' 31' ' ' CYS . 87.9 tttt -87.49 116.06 25.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.073 0.463 . . . . 0.0 111.095 179.237 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.8 t -125.95 -176.68 3.7 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.42 178.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.2 t -160.24 139.29 10.69 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 -89.53 -18.51 26.51 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.558 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 71.9 m -70.67 153.86 42.41 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.358 0.599 . . . . 0.0 111.464 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.7 p -127.5 -169.56 2.07 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.749 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 47.5 m -76.47 7.95 3.96 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.215 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.65 -34.14 77.19 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 175.184 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 123.06 52.42 0.21 Allowed Glycine 0 N--CA 1.438 -1.228 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.775 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 47.8 t 70.45 151.68 0.1 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.377 0.608 . . . . 0.0 111.27 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.2 tmtp? -123.25 -50.45 1.9 Allowed 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.767 -177.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 28.6 p -73.91 -35.34 64.62 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.911 -178.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.41 18.69 6.52 Favored Glycine 0 CA--C 1.522 0.481 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.914 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -101.49 9.46 41.34 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 122.648 -0.324 . . . . 0.0 111.58 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 66.84 34.99 5.14 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.409 0.684 . . . . 0.0 111.457 177.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 3.5 p -111.74 148.3 33.79 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.312 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.5 p -136.04 37.72 2.78 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-O 121.243 0.544 . . . . 0.0 111.509 -177.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.01 157.44 7.23 Favored Glycine 0 C--O 1.219 -0.807 0 C-N-CA 120.516 -0.849 . . . . 0.0 111.998 -178.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -45.31 -55.81 3.21 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.985 3.123 . . . . 0.0 114.971 -178.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -67.18 -35.37 79.51 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.906 0.384 . . . . 0.0 111.094 -177.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.2 m -89.45 9.92 24.63 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.01 -178.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 43.7 t -89.8 134.02 34.4 Favored 'General case' 0 N--CA 1.435 -1.202 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.136 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 47.8 mttt -101.19 -4.97 26.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.32 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.3 m -87.63 152.69 21.97 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.815 -174.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -81.84 -165.34 35.29 Favored Glycine 0 N--CA 1.44 -1.069 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.7 p -82.02 -17.01 48.26 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 117.1 0.45 . . . . 0.0 110.782 -178.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.1 t -99.47 69.05 1.63 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 121.269 0.557 . . . . 0.0 110.307 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 14.4 t -138.99 166.78 23.6 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.984 178.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -69.11 -26.33 64.86 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.321 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.714 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 11.8 p -84.09 6.53 21.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.008 0.432 . . . . 0.0 110.353 179.205 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.714 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 30.1 mmtp . . . . . 0 C--O 1.263 1.779 0 CA-C-O 117.601 -1.19 . . . . 0.0 110.355 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.477 0 N-CA-C 112.186 -0.366 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.1 p -154.26 162.21 41.32 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.63 61.55 4.73 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.817 -0.706 . . . . 0.0 111.893 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -119.16 -168.65 1.6 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.56 0.219 . . . . 0.0 110.538 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.97 -45.49 3.43 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.345 -0.702 . . . . 0.0 111.345 -178.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.745 ' HG2' ' SG ' ' A' ' 10' ' ' CYS . 35.2 ttpt -148.87 122.49 9.19 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 178.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 172.39 -152.44 16.82 Favored Glycine 0 N--CA 1.444 -0.792 0 C-N-CA 119.441 -1.361 . . . . 0.0 113.299 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 70.94 -68.01 0.23 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.022 0.929 . . . . 0.0 111.56 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.542 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 5.6 mptt -107.07 4.62 27.15 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 116.695 -0.229 . . . . 0.0 111.164 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.745 ' SG ' ' HG2' ' A' ' 6' ' ' LYS . 37.8 m -62.8 143.42 57.55 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-O 121.174 0.511 . . . . 0.0 111.38 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.417 ' CG2' ' HB2' ' A' ' 26' ' ' GLN . 40.8 p -90.12 168.67 11.79 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.341 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.7 m -72.35 -14.84 61.83 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.384 0.611 . . . . 0.0 109.499 175.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.14 -35.43 42.06 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.492 177.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.3 t -76.2 -16.47 59.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.682 177.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -86.17 4.72 37.32 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.228 176.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.2 t -114.08 153.54 29.28 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.714 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.478 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -130.82 127.01 22.07 Favored Pre-proline 0 C--N 1.315 -0.893 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.264 -178.701 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.478 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 36.6 Cg_endo -66.24 164.51 65.51 Favored 'Cis proline' 0 C--O 1.242 0.69 0 C-N-CA 123.341 -1.524 . . . . 0.0 111.996 -1.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.488 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 33.9 t -53.73 128.08 28.22 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.091 -178.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -98.6 22.77 9.45 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.573 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.507 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 89.9 m -96.67 22.33 8.25 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.59 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.26 -40.95 77.7 Favored Glycine 0 CA--C 1.52 0.363 0 C-N-CA 121.282 -0.485 . . . . 0.0 113.162 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.9 t -144.36 2.07 1.1 Allowed 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.956 0.408 . . . . 0.0 110.803 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -114.82 21.24 14.54 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.061 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.402 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 49.8 t -65.41 144.74 56.87 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.34 0.59 . . . . 0.0 112.042 -176.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.417 ' HB2' ' CG2' ' A' ' 11' ' ' THR . 34.2 mt-30 -147.34 16.17 1.16 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.378 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.542 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 79.9 m -68.82 171.3 8.1 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.435 0.636 . . . . 0.0 112.364 -177.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -115.78 -151.51 9.83 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.874 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -83.82 -18.18 38.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.022 0.411 . . . . 0.0 110.614 179.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.23 42.34 2.74 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 121.091 -0.576 . . . . 0.0 111.926 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.4 t -127.58 126.55 42.31 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-O 121.085 0.469 . . . . 0.0 109.969 -179.141 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 t -102.57 4.4 38.4 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.501 0.667 . . . . 0.0 110.029 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 35.1 t -82.24 116.0 21.57 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.601 -178.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.86 -0.77 49.73 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.309 -179.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.26 -42.26 69.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.996 0.427 . . . . 0.0 110.697 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.507 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 5.7 p -101.33 -39.93 7.36 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.126 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -73.15 99.99 2.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.105 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.1 t -114.5 -179.13 3.54 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.276 179.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.426 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 34.1 t -163.34 136.2 5.45 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 122.835 0.454 . . . . 0.0 109.803 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -92.58 -15.99 26.23 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.491 ' SG ' ' HB2' ' A' ' 47' ' ' LYS . 88.8 m -69.15 147.4 51.43 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.205 0.526 . . . . 0.0 111.215 178.344 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 16.5 p -123.32 179.43 4.72 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.474 -175.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.4 m -66.27 -5.25 9.8 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.897 -179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -58.79 -35.23 72.47 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 120.87 0.367 . . . . 0.0 110.213 177.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 136.99 50.62 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.24 -0.981 . . . . 0.0 113.152 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 44.4 t 66.4 166.69 0.21 Allowed 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 120.944 0.402 . . . . 0.0 111.165 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.491 ' HB2' ' SG ' ' A' ' 41' ' ' CYS . 98.1 mttt -139.92 -46.62 0.44 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.849 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.53 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 20.8 p -73.7 -34.61 64.92 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.458 -177.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.73 21.95 4.86 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.502 -0.856 . . . . 0.0 113.136 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.53 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 75.1 mmtt -107.19 6.5 28.77 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.921 0.361 . . . . 0.0 110.463 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 62.5 26.42 15.72 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.979 0.912 . . . . 0.0 111.368 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 11.6 p -95.91 151.77 19.11 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.441 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.9 p -138.19 80.95 1.83 Allowed 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.196 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 88.79 160.26 36.11 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.545 -0.835 . . . . 0.0 111.703 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.426 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 18.1 Cg_endo -59.3 -21.4 60.28 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.87 2.38 . . . . 0.0 112.788 -178.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.21 -30.11 71.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.87 178.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.3 t -139.54 63.96 1.48 Allowed 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 121.505 0.669 . . . . 0.0 109.314 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.408 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 48.8 t -133.3 132.09 40.96 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.257 -179.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -110.72 -3.25 15.89 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.168 0.509 . . . . 0.0 110.004 178.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.4 m -74.29 137.91 43.22 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.389 -176.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.24 169.77 53.77 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.306 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.3 m -64.94 -12.94 55.29 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -177.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.1 m -101.58 17.65 22.28 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.629 0.252 . . . . 0.0 111.627 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . 0.415 ' SG ' ' N ' ' A' ' 65' ' ' SER . 37.5 t -83.49 172.43 12.42 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 111.357 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.415 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 14.7 m -72.72 -20.37 61.22 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.232 -177.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.475 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 23.4 p -89.93 11.45 20.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.876 0.37 . . . . 0.0 111.002 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.408 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 57.9 mmtt . . . . . 0 C--O 1.269 2.117 0 CA-C-O 117.744 -1.122 . . . . 0.0 110.515 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.428 0 N-CA-C 112.344 -0.302 . . . . 0.0 112.344 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.3 m -133.69 146.83 51.19 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -77.12 -34.54 41.32 Favored Glycine 0 N--CA 1.444 -0.832 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 176.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 67.7 mmtt -101.87 -164.53 1.1 Allowed 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.407 -0.396 . . . . 0.0 110.221 177.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -177.35 172.9 45.74 Favored Glycine 0 N--CA 1.439 -1.109 0 N-CA-C 110.892 -0.883 . . . . 0.0 110.892 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.802 ' HA ' ' SG ' ' A' ' 10' ' ' CYS . 24.0 pttm -71.22 112.5 7.41 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.149 0.5 . . . . 0.0 111.222 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -175.32 -95.44 0.1 OUTLIER Glycine 0 N--CA 1.439 -1.136 0 C-N-CA 120.383 -0.913 . . . . 0.0 113.525 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -47.04 -51.49 17.31 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 -175.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.594 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 29.8 mmtp -95.91 -6.67 38.64 Favored 'General case' 0 C--N 1.308 -1.196 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -176.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.802 ' SG ' ' HA ' ' A' ' 6' ' ' LYS . 61.3 m -87.07 157.36 19.43 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.368 0.604 . . . . 0.0 111.692 -177.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.588 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 61.7 p -95.31 175.47 6.58 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.694 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.6 m -70.53 -17.43 62.94 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.007 0.432 . . . . 0.0 110.858 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.17 -40.07 53.38 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.024 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 53.1 t -74.72 -23.22 58.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.171 0.51 . . . . 0.0 110.229 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.588 ' HG3' ' O ' ' A' ' 11' ' ' THR . 86.5 mtt180 -77.41 0.23 23.31 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.76 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 t -102.21 158.58 16.07 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -128.87 123.03 21.74 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-O 120.679 0.276 . . . . 0.0 110.707 178.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -71.33 178.61 28.46 Favored 'Cis proline' 0 C--O 1.235 0.375 0 C-N-CA 123.412 -1.495 . . . . 0.0 111.868 -0.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.8 t -61.66 134.66 57.06 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.639 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -115.17 20.62 14.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.742 -176.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.485 ' HB3' ' HB2' ' A' ' 25' ' ' CYS . 81.3 m -81.13 59.76 4.01 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -178.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.69 -57.67 4.44 Favored Glycine 0 C--N 1.302 -1.335 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 176.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.5 m -125.66 5.74 7.49 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.125 0.488 . . . . 0.0 110.378 178.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -113.8 34.33 4.67 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.341 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.485 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 13.8 t -92.95 115.93 28.58 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 120.059 -0.657 . . . . 0.0 111.328 -179.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.522 ' HB2' ' CG2' ' A' ' 11' ' ' THR . 15.2 mm100 -131.23 14.87 5.11 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.203 -0.908 . . . . 0.0 108.905 177.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.594 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 73.9 m -61.61 140.33 58.16 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.976 -177.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.422 ' H ' ' HB3' ' A' ' 9' ' ' LYS . . . -113.98 -164.23 15.2 Favored Glycine 0 C--N 1.312 -0.789 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.105 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.463 ' O ' ' HG3' ' A' ' 9' ' ' LYS . 1.0 OUTLIER -65.72 134.56 53.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.998 0.428 . . . . 0.0 110.209 179.033 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 117.46 -10.52 14.51 Favored Glycine 0 N--CA 1.438 -1.207 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -175.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 47.5 t -80.0 123.94 28.27 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.9 t -106.78 12.14 29.39 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.337 0.589 . . . . 0.0 110.914 -176.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.8 t -82.44 141.12 33.0 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.098 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -100.17 0.86 41.33 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.061 0.458 . . . . 0.0 110.765 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.48 -51.52 9.86 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.507 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 5.1 p -100.04 -19.4 16.55 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -175.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -75.95 131.55 39.67 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.484 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.56 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 10.8 t -133.26 -176.92 4.3 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.44 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 37.4 t -162.12 153.85 18.69 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 122.793 0.437 . . . . 0.0 109.913 -179.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -112.1 -12.5 13.67 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.4 m -78.25 130.03 35.77 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.2 p -103.91 175.8 5.36 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.479 -174.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.4 t -65.39 -7.2 12.68 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.038 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -71.55 -27.44 63.17 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 153.31 155.09 7.0 Favored Glycine 0 N--CA 1.437 -1.243 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.675 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.6 t -74.77 137.72 42.17 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -118.75 -3.58 10.79 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.369 -0.532 . . . . 0.0 112.332 -177.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.615 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 8.0 p -102.53 -35.72 8.64 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.035 -0.666 . . . . 0.0 110.495 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.98 13.83 7.55 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.182 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.635 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 32.5 mmtp -101.1 -1.67 33.45 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 117.077 0.438 . . . . 0.0 110.61 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 67.47 27.93 7.84 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.993 -179.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 25.0 p -99.3 150.94 21.61 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.707 178.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.2 p -142.71 62.03 1.41 Allowed 'General case' 0 C--N 1.312 -1.051 0 CA-C-O 121.146 0.498 . . . . 0.0 110.364 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 124.44 156.05 9.32 Favored Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.362 -0.695 . . . . 0.0 111.362 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.21 -38.66 81.69 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 123.054 2.503 . . . . 0.0 113.435 -177.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.38 -38.54 87.38 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.955 0.407 . . . . 0.0 111.494 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.9 t -98.37 2.75 48.27 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.598 -178.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 54.0 t -92.48 133.53 35.83 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.138 0.495 . . . . 0.0 111.709 -177.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -116.87 11.02 14.3 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.091 179.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.635 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 18.8 m -83.28 157.61 22.56 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.922 -178.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.472 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -88.4 -166.16 42.01 Favored Glycine 0 N--CA 1.437 -1.3 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 175.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.6 m -79.82 -15.38 57.53 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 117.467 0.634 . . . . 0.0 111.774 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.8 m -99.96 73.68 1.76 Allowed 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.887 0.375 . . . . 0.0 110.99 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.2 t -144.71 165.96 26.57 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.929 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 10.0 m -63.38 -28.97 70.35 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.712 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.465 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 16.3 p -92.83 19.29 7.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.076 0.465 . . . . 0.0 110.564 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.56 ' HE3' ' O ' ' A' ' 38' ' ' THR . 48.7 mmtm . . . . . 0 C--O 1.262 1.748 0 CA-C-O 117.681 -1.152 . . . . 0.0 111.041 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.337 0 N-CA-C 112.54 -0.224 . . . . 0.0 112.54 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.4 m 60.17 30.93 20.3 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 122.886 0.474 . . . . 0.0 111.818 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 177.28 -119.95 0.71 Allowed Glycine 0 N--CA 1.44 -1.091 0 C-N-CA 119.878 -1.153 . . . . 0.0 113.173 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.2 mtmt -102.67 6.75 39.77 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.815 0.34 . . . . 0.0 111.498 -177.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.39 166.6 19.39 Favored Glycine 0 N--CA 1.442 -0.911 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.553 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -76.8 -28.47 55.63 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.923 0.392 . . . . 0.0 110.903 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 155.47 179.19 30.41 Favored Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 111.149 -0.781 . . . . 0.0 111.149 -179.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -115.29 -22.09 9.57 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.05 0.452 . . . . 0.0 110.976 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -82.71 2.03 35.69 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.355 0.597 . . . . 0.0 110.02 176.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.618 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 38.0 m -74.13 149.44 41.03 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.254 177.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.595 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 61.6 p -77.2 164.26 25.78 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.018 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.0 m -63.15 -24.9 68.1 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.2 -46.47 70.55 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.355 177.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.597 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 47.9 t -70.22 -29.83 66.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.101 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.595 ' HG3' ' O ' ' A' ' 11' ' ' THR . 85.6 mtt180 -70.72 -8.9 55.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.042 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.8 m -90.93 166.41 13.06 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.842 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -132.25 120.47 17.09 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-O 120.47 0.176 . . . . 0.0 110.985 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -73.53 -177.31 19.01 Favored 'Cis proline' 0 C--N 1.351 0.669 0 C-N-CA 123.589 -1.421 . . . . 0.0 112.038 0.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.8 t -60.76 139.68 57.83 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.128 -178.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 81.3 mm-40 -111.55 12.11 21.3 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.223 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.597 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 78.9 m -82.89 26.89 0.57 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.86 0.362 . . . . 0.0 110.749 178.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.03 -47.29 88.62 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.854 -178.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.3 m -128.64 25.28 5.71 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 120.791 0.329 . . . . 0.0 110.649 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -164.89 95.87 0.71 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.746 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 49.1 t -122.84 145.85 48.07 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.574 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.7 tt0 -149.75 14.84 0.85 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.851 -179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.618 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 95.1 m -61.7 142.85 56.96 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -177.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.54 -157.79 29.14 Favored Glycine 0 N--CA 1.438 -1.224 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.718 177.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -5.12 50.68 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 117.242 0.521 . . . . 0.0 110.971 178.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -95.26 54.01 1.81 Allowed Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.264 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.5 t -128.99 146.05 51.08 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.2 t -123.89 14.7 9.27 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.178 0.513 . . . . 0.0 110.08 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 8.6 t -92.0 136.76 32.91 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.502 -177.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -96.3 -3.65 43.56 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.129 0.49 . . . . 0.0 110.616 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.1 -31.39 58.67 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.309 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.6 p -114.88 -16.02 11.76 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -177.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.418 ' HE2' ' O ' ' A' ' 55' ' ' PRO . 85.2 tttt -84.77 109.51 18.11 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.949 -0.3 . . . . 0.0 110.755 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 t -121.38 176.2 5.77 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.881 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.463 ' HB3' ' N ' ' A' ' 55' ' ' PRO . 42.6 t -162.85 148.32 12.04 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 122.554 0.342 . . . . 0.0 110.342 -178.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -107.29 -14.88 14.78 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 83.5 m -77.78 144.36 37.2 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 177.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 49.5 p -127.78 -179.78 5.13 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.548 0.213 . . . . 0.0 111.435 -175.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 40.3 m -62.83 -16.08 56.91 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -177.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -66.09 -34.42 78.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.167 0.508 . . . . 0.0 110.11 177.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.93 151.29 6.18 Favored Glycine 0 N--CA 1.435 -1.407 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.741 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 39.6 t -73.99 139.08 44.55 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -108.74 -15.21 14.45 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -177.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.611 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 15.2 p -102.17 -33.21 9.74 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 120.186 -0.605 . . . . 0.0 110.867 -179.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.36 10.46 17.44 Favored Glycine 0 CA--C 1.523 0.564 0 C-N-CA 120.762 -0.732 . . . . 0.0 113.53 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.724 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 31.7 mmtp -90.81 1.64 56.76 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 117.12 0.46 . . . . 0.0 111.519 -179.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.413 ' HB2' ' O ' ' A' ' 50' ' ' LYS . 37.5 mm-40 70.17 21.41 5.96 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.58 0.55 . . . . 0.0 111.163 -179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.0 p -96.86 146.74 24.65 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.137 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.1 p -135.09 35.74 3.04 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-O 120.929 0.395 . . . . 0.0 110.874 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 158.83 157.28 8.42 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.429 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.463 ' N ' ' HB3' ' A' ' 39' ' ' CYS . 10.8 Cg_endo -52.22 -51.26 11.54 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 124.078 3.185 . . . . 0.0 115.104 -177.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -71.22 -35.04 71.35 Favored 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.938 -176.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.2 m -84.9 -0.91 55.74 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.754 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.488 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 44.2 t -74.68 146.15 42.57 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.909 -179.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -108.98 -4.88 16.34 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.64 -179.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.724 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 11.0 m -81.44 151.35 27.92 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.474 -177.003 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -109.34 62.24 0.29 Allowed Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.956 -0.565 . . . . 0.0 112.306 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.475 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 49.2 m 69.79 -37.95 0.39 Allowed 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 177.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.3 p -84.37 67.69 9.95 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -177.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 35.8 t -146.13 169.97 17.65 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.723 176.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.1 t -75.09 -21.53 58.88 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.384 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.461 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 9.3 p -82.15 22.49 0.8 Allowed 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.246 0.546 . . . . 0.0 110.574 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.488 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 66.8 mmtt . . . . . 0 C--O 1.271 2.208 0 CA-C-O 117.338 -1.315 . . . . 0.0 110.109 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.35 0 N-CA-C 112.188 -0.365 . . . . 0.0 112.188 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.0 m -78.51 110.23 13.41 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 110.199 -0.297 . . . . 0.0 110.199 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -66.45 104.91 1.14 Allowed Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -69.54 96.43 0.92 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.365 0.602 . . . . 0.0 111.732 -177.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -132.71 125.6 4.2 Favored Glycine 0 N--CA 1.429 -1.808 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 177.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.664 ' HA ' ' SG ' ' A' ' 10' ' ' CYS . 38.4 ttmt 77.37 95.18 0.06 Allowed 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 123.812 0.845 . . . . 0.0 111.417 -178.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 167.35 168.74 29.96 Favored Glycine 0 N--CA 1.436 -1.327 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.628 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 66.9 -70.35 0.11 Allowed 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.469 0.708 . . . . 0.0 112.474 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 27.8 mtpp -101.01 4.74 42.68 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 120.662 0.268 . . . . 0.0 111.359 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.664 ' SG ' ' HA ' ' A' ' 6' ' ' LYS . 6.9 m -77.73 163.95 25.69 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 121.031 0.443 . . . . 0.0 110.119 175.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 65.6 p -104.23 162.78 12.9 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.838 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.2 m -70.19 -13.75 62.32 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.285 0.564 . . . . 0.0 110.313 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.09 -34.38 32.67 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.899 176.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.607 ' SG ' ' HE2' ' A' ' 6' ' ' LYS . 43.1 t -75.53 -29.0 59.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.573 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.4 mtt180 -77.67 8.94 3.82 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.261 0.553 . . . . 0.0 111.018 177.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 39.2 t -108.08 150.14 27.55 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.415 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 11.2 pt-20 -127.85 124.37 23.24 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-O 120.601 0.239 . . . . 0.0 110.526 178.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.415 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 7.9 Cg_exo -70.15 169.83 63.1 Favored 'Cis proline' 0 C--O 1.239 0.565 0 C-N-CA 123.069 -1.638 . . . . 0.0 112.007 0.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 13.4 t -56.89 138.18 54.13 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.31 -177.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -112.37 16.25 20.0 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.167 -178.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.51 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 56.6 m -89.32 14.25 11.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.293 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.59 -49.1 76.52 Favored Glycine 0 CA--C 1.521 0.432 0 C-N-CA 121.293 -0.48 . . . . 0.0 113.103 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.7 m -113.0 13.13 19.42 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.898 0.38 . . . . 0.0 111.265 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.51 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 57.3 tttm -164.93 101.5 0.77 Allowed 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.391 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.418 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 45.1 t -132.18 149.7 52.33 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.196 -179.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -153.38 22.25 0.55 Allowed 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.901 178.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 91.0 m -68.44 144.97 54.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.095 0.474 . . . . 0.0 111.271 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.426 ' HA3' ' HE3' ' A' ' 9' ' ' LYS . . . -81.19 -156.78 15.81 Favored Glycine 0 N--CA 1.441 -0.972 0 CA-C-N 115.48 -0.782 . . . . 0.0 112.816 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.44 ' H ' ' CD ' ' A' ' 29' ' ' GLU . 0.2 OUTLIER -78.55 -31.49 47.46 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.793 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -78.87 60.69 4.13 Favored Glycine 0 N--CA 1.444 -0.803 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.209 178.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 48.4 t -129.11 142.33 50.92 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 177.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.8 t -120.43 12.61 11.67 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.13 0.49 . . . . 0.0 110.753 -178.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.9 t -90.27 115.88 27.82 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.042 0.448 . . . . 0.0 110.172 179.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.96 4.73 16.0 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.454 -178.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.77 -42.83 21.13 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.812 179.377 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 8.9 p -106.34 -36.13 6.93 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.375 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -80.61 116.42 20.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.207 0.527 . . . . 0.0 110.424 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.0 t -123.31 -176.2 3.38 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.471 -179.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 41.8 t -154.24 140.35 18.41 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.33 -17.26 27.66 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.299 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 99.6 m -73.81 154.53 39.48 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.126 0.489 . . . . 0.0 111.305 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.2 p -115.44 -173.63 2.37 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.477 -175.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.0 m -71.56 -6.01 37.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.599 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -60.03 -37.91 81.16 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.054 0.454 . . . . 0.0 110.817 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 129.03 56.4 0.1 Allowed Glycine 0 N--CA 1.443 -0.852 0 C-N-CA 119.997 -1.096 . . . . 0.0 112.784 178.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.435 ' SG ' ' N ' ' A' ' 51' ' ' GLU . 44.8 t 72.34 142.04 0.06 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.444 0.64 . . . . 0.0 112.353 178.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 35.9 mmtp -122.88 -40.58 2.41 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.801 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.426 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 13.5 p -72.64 -38.13 67.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.771 0.32 . . . . 0.0 110.89 -178.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 122.97 0.29 9.78 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.134 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -92.87 14.63 16.89 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 117.078 0.439 . . . . 0.0 111.893 -179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.435 ' N ' ' SG ' ' A' ' 46' ' ' CYS . 34.6 mt-10 60.24 36.46 20.8 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.538 -0.755 . . . . 0.0 112.627 175.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 3.5 p -111.13 151.55 28.01 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 120.879 0.371 . . . . 0.0 111.182 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.6 p -137.76 77.79 1.65 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.928 0.394 . . . . 0.0 110.893 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 99.37 155.48 28.6 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.246 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -43.34 -51.72 5.62 Favored 'Trans proline' 0 N--CA 1.478 0.612 0 C-N-CA 124.1 3.2 . . . . 0.0 114.712 -177.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -62.33 -35.8 80.21 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.012 0.434 . . . . 0.0 111.555 -177.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.3 m -99.27 19.85 14.67 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.188 -178.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 53.4 t -103.62 129.61 50.93 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-O 121.143 0.496 . . . . 0.0 110.997 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -109.8 4.31 21.61 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.471 0.653 . . . . 0.0 109.79 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 5.0 m -82.14 156.72 24.34 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.373 -178.014 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -83.64 -178.7 51.99 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.01 178.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.1 p -79.63 -6.97 58.21 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.3 m -100.79 10.52 41.04 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.783 0.325 . . . . 0.0 110.937 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 30.8 t -84.64 164.86 18.39 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.944 0.402 . . . . 0.0 111.69 -177.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.6 m -64.16 -34.31 77.78 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.321 0.649 . . . . 0.0 112.185 -177.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.473 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 19.7 p -82.26 20.13 1.1 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.946 0.403 . . . . 0.0 111.033 -179.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.473 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 48.1 mmtm . . . . . 0 C--O 1.263 1.773 0 CA-C-O 117.863 -1.065 . . . . 0.0 110.47 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.219 0 N-CA-C 112.114 -0.394 . . . . 0.0 112.114 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.2 t -109.61 88.26 2.7 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -134.53 30.31 2.9 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 111.187 -0.765 . . . . 0.0 111.187 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -102.82 9.01 39.2 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.636 0.255 . . . . 0.0 111.42 -177.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.91 -136.52 12.89 Favored Glycine 0 N--CA 1.44 -1.079 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.261 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.515 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 23.2 pttm -91.39 135.69 33.64 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.783 0.325 . . . . 0.0 110.743 -179.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 175.76 152.04 9.17 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.37 -0.919 . . . . 0.0 112.476 179.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 66.76 -71.93 0.09 Allowed 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.636 0.774 . . . . 0.0 112.7 178.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.423 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 14.0 mptt -69.89 -32.96 71.58 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.326 -178.129 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.677 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 73.8 m -65.28 137.11 57.34 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.162 0.506 . . . . 0.0 111.138 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.659 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 44.5 p -78.0 175.13 10.37 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.017 -177.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.6 m -70.21 -25.44 63.41 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 175.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.462 ' HB3' ' HB2' ' A' ' 20' ' ' GLN . . . -69.95 -40.55 75.4 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.033 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.521 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 40.5 t -69.35 -25.13 64.04 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.339 0.59 . . . . 0.0 110.773 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.659 ' HG3' ' O ' ' A' ' 11' ' ' THR . 60.0 mtt180 -81.21 -2.66 49.59 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.016 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.1 m -104.68 156.34 18.07 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.502 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 8.8 pt-20 -128.12 129.92 23.63 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-O 120.779 0.323 . . . . 0.0 111.179 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.502 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 44.4 Cg_endo -67.61 169.3 52.94 Favored 'Cis proline' 0 C--N 1.351 0.706 0 C-N-CA 123.143 -1.607 . . . . 0.0 111.15 -0.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.521 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 26.3 t -59.07 133.84 56.46 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-O 121.159 0.504 . . . . 0.0 110.636 -177.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.462 ' HB2' ' HB3' ' A' ' 13' ' ' ALA . 27.4 mm-40 -97.01 12.1 33.73 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.858 -177.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.539 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 91.6 m -96.23 23.66 6.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.314 176.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -46.77 -52.44 11.45 Favored Glycine 0 C--N 1.338 0.667 0 O-C-N 123.438 0.461 . . . . 0.0 113.595 -177.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.1 p -120.97 -20.48 6.86 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 120.857 0.36 . . . . 0.0 110.989 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -114.88 81.35 1.55 Allowed 'General case' 0 CA--C 1.507 -0.696 0 CA-C-O 121.122 0.487 . . . . 0.0 110.585 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.589 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 53.6 t -95.57 143.95 26.44 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.31 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -140.68 19.46 2.34 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.245 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.677 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 85.5 m -77.8 179.17 6.84 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.875 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -129.93 -135.2 3.83 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.318 -179.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.429 ' HA ' ' HA3' ' A' ' 61' ' ' GLY . 0.5 OUTLIER -89.7 -10.44 45.73 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.122 0.487 . . . . 0.0 110.639 179.461 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -94.09 36.94 3.55 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.774 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.411 ' HA ' ' SG ' ' A' ' 10' ' ' CYS . 43.0 t -112.8 135.65 53.3 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.8 t -118.89 12.59 12.92 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-O 121.012 0.434 . . . . 0.0 110.111 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.2 t -81.43 166.26 20.53 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.064 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.06 -7.74 11.29 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 120.936 0.398 . . . . 0.0 110.935 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.24 -54.79 5.41 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.411 -178.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.589 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 3.5 p -82.9 -15.99 49.25 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.797 -178.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.498 ' HE2' ' O ' ' A' ' 55' ' ' PRO . 87.8 tttt -75.0 100.5 4.18 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.073 0.464 . . . . 0.0 110.865 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 t -108.32 -178.77 3.69 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.047 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.1 t -161.48 150.35 15.98 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -108.3 -18.71 13.69 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.1 m -75.36 133.88 41.12 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.0 p -103.53 176.34 5.18 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 120.886 0.374 . . . . 0.0 111.685 -175.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.483 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.6 m -70.04 0.8 5.4 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.847 -178.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -86.96 -22.88 25.32 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.218 0.532 . . . . 0.0 110.095 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 158.59 153.59 6.84 Favored Glycine 0 N--CA 1.436 -1.354 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.006 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 54.1 t -74.05 136.95 43.09 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -107.74 -27.31 10.36 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -177.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 9.4 p -86.35 -31.82 21.33 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.966 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.19 2.58 33.62 Favored Glycine 0 CA--C 1.522 0.473 0 C-N-CA 120.563 -0.827 . . . . 0.0 113.599 177.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.419 ' O ' ' HE2' ' A' ' 59' ' ' LYS . 45.4 mmtm -88.64 0.25 56.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.061 0.458 . . . . 0.0 110.28 178.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 64.51 65.2 0.65 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.053 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.6 p -136.34 144.19 44.5 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.028 176.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.483 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 22.6 p -131.79 63.71 1.61 Allowed 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.205 0.526 . . . . 0.0 111.097 -179.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.52 159.63 10.39 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 120.831 -0.699 . . . . 0.0 111.705 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.498 ' O ' ' HE2' ' A' ' 37' ' ' LYS . 10.9 Cg_endo -54.01 -40.04 82.81 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 123.212 2.608 . . . . 0.0 113.332 -177.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -67.72 -37.7 82.59 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.898 0.38 . . . . 0.0 110.99 -178.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.2 t -91.49 3.31 55.28 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.948 -178.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 53.1 t -84.77 143.18 29.29 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.109 0.481 . . . . 0.0 110.979 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.419 ' HE2' ' O ' ' A' ' 50' ' ' LYS . 63.3 pttt -122.77 14.05 10.02 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.338 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 12.2 m -96.04 162.26 13.63 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.577 -178.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.469 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -96.1 -178.38 36.03 Favored Glycine 0 N--CA 1.427 -1.916 0 N-CA-C 109.946 -1.261 . . . . 0.0 109.946 175.164 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 14.1 m -75.86 25.05 0.12 Allowed 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 117.21 0.505 . . . . 0.0 111.421 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.449 ' H ' ' C ' ' A' ' 61' ' ' GLY . 17.4 m -125.76 19.22 7.91 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.521 -178.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.0 t -102.76 171.4 7.43 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 178.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.3 m -72.13 -22.0 61.39 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.764 0.316 . . . . 0.0 111.397 -178.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.472 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 15.1 p -91.12 26.96 2.0 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.178 0.513 . . . . 0.0 110.279 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.472 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 43.5 mmtm . . . . . 0 C--O 1.263 1.799 0 CA-C-O 117.888 -1.053 . . . . 0.0 111.17 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.512 0 N-CA-C 112.378 -0.289 . . . . 0.0 112.378 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.5 m -104.41 -30.69 9.91 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.052 0.453 . . . . 0.0 110.66 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -157.73 133.14 3.41 Favored Glycine 0 N--CA 1.439 -1.149 0 N-CA-C 111.289 -0.724 . . . . 0.0 111.289 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.4 mtmt -90.89 105.2 17.66 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.554 0.216 . . . . 0.0 111.013 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -91.57 10.06 75.61 Favored Glycine 0 C--N 1.318 -0.455 0 C-N-CA 120.597 -0.811 . . . . 0.0 111.411 177.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.715 ' HD2' ' SG ' ' A' ' 10' ' ' CYS . 39.1 pttt -142.69 -168.13 2.68 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 122.639 0.376 . . . . 0.0 110.048 -179.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -135.49 -145.48 5.13 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 119.801 -1.19 . . . . 0.0 113.794 -176.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -86.83 13.57 8.69 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -177.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.556 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 31.2 mmtp -87.94 -6.18 58.17 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.0 0.428 . . . . 0.0 110.172 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.715 ' SG ' ' HD2' ' A' ' 6' ' ' LYS . 64.2 m -78.46 157.01 29.06 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.151 178.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.4 p -96.1 168.4 10.63 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.777 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.6 m -71.24 -16.89 62.51 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.443 0.64 . . . . 0.0 109.537 175.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.67 -38.36 47.82 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.259 178.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.512 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 50.5 t -71.85 -28.42 63.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.715 179.247 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 48.2 mtp180 -82.39 9.19 9.55 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.032 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.5 m -108.06 157.57 18.14 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -127.83 121.95 22.22 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.651 0.263 . . . . 0.0 110.996 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.35 175.31 44.19 Favored 'Cis proline' 0 C--N 1.351 0.663 0 C-N-CA 123.246 -1.564 . . . . 0.0 112.048 0.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 20.0 t -61.85 129.91 43.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.082 0.468 . . . . 0.0 110.526 -178.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.0 mm-40 -102.83 11.02 38.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.958 -177.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.512 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 87.0 m -76.72 2.97 12.77 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -56.65 103.38 0.26 Allowed Glycine 0 CA--C 1.518 0.223 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.385 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.5 t 64.33 24.0 13.17 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.481 0.657 . . . . 0.0 110.68 -179.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.401 ' HG2' ' O ' ' A' ' 24' ' ' LYS . 40.1 ttmt -144.9 14.55 1.52 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.514 -179.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.485 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 46.4 t -70.11 141.26 52.76 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.07 -175.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -138.65 11.75 2.71 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.172 178.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 64.3 m -63.9 139.86 58.81 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.381 -178.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.416 ' C ' ' H ' ' A' ' 30' ' ' GLY . . . -81.67 -171.85 46.21 Favored Glycine 0 N--CA 1.44 -1.08 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.89 178.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.93 17.28 0.34 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.223 0.535 . . . . 0.0 112.214 -178.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.416 ' H ' ' C ' ' A' ' 28' ' ' GLY . . . -116.04 37.0 3.58 Favored Glycine 0 N--CA 1.439 -1.106 0 N-CA-C 111.508 -0.637 . . . . 0.0 111.508 178.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.7 t -123.12 156.77 34.33 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 t -131.06 7.23 4.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.331 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 16.5 t -76.81 116.02 17.11 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.07 -3.91 25.77 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.295 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -81.68 -13.48 57.82 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.643 -179.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.485 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 6.3 p -134.38 -31.35 1.09 Allowed 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -177.265 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -91.51 115.3 27.92 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.441 -0.503 . . . . 0.0 109.781 -177.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.57 164.93 12.06 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.381 -176.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 39.2 t -160.21 159.03 31.06 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.773 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.4 m-80 -123.81 -6.91 7.92 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 95.0 m -73.12 157.78 36.59 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.835 178.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 23.8 p -126.47 -177.36 3.96 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.679 -0.692 . . . . 0.0 111.728 -174.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.1 m -70.88 -1.47 11.88 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.002 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -59.04 -26.48 64.63 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.08 176.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 125.18 42.65 0.32 Allowed Glycine 0 CA--C 1.501 -0.843 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.232 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 48.3 t 69.1 138.96 0.04 OUTLIER 'General case' 0 C--N 1.341 0.207 0 C-N-CA 123.051 0.541 . . . . 0.0 110.395 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.4 mtpt -123.19 1.76 9.15 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.375 -177.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.522 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 2.8 p -111.65 -40.92 4.19 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.023 0.44 . . . . 0.0 110.015 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 119.96 14.63 5.52 Favored Glycine 0 CA--C 1.525 0.681 0 C-N-CA 120.811 -0.709 . . . . 0.0 113.228 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.692 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.3 mmtt -102.18 5.14 40.08 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 117.198 0.499 . . . . 0.0 110.778 178.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.45 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 17.7 tt0 70.93 16.82 6.45 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.387 0.675 . . . . 0.0 110.793 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.477 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 25.9 p -93.59 143.55 26.2 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 120.975 0.417 . . . . 0.0 110.514 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.3 p -124.2 31.78 5.7 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.283 0.563 . . . . 0.0 110.749 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 140.86 171.88 12.74 Favored Glycine 0 N--CA 1.441 -0.972 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 -177.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.55 -29.61 85.54 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.893 2.395 . . . . 0.0 112.628 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -62.57 -37.5 86.43 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.854 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 12.1 m -113.04 3.66 16.27 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -176.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.477 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 48.5 t -74.82 135.22 41.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.787 0.327 . . . . 0.0 110.629 -179.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 17.1 ttpp -136.22 33.48 2.82 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.671 -177.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.692 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 2.7 m -96.32 -179.05 4.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.015 0.436 . . . . 0.0 110.05 176.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -99.55 -143.41 14.51 Favored Glycine 0 N--CA 1.432 -1.57 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 174.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.9 p -91.62 -28.77 17.29 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 116.923 0.361 . . . . 0.0 111.205 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.8 m -87.71 67.5 9.22 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -176.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 7.1 t -142.76 155.06 44.79 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.207 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.0 m -70.1 -24.35 63.19 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -175.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.478 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 17.5 p -86.03 7.84 22.95 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.939 0.4 . . . . 0.0 111.191 -178.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.478 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 47.3 mmtm . . . . . 0 C--O 1.262 1.741 0 CA-C-O 117.56 -1.209 . . . . 0.0 111.144 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.293 0 N-CA-C 112.289 -0.324 . . . . 0.0 112.289 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.6 m -128.57 149.32 50.67 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -85.66 -31.35 21.63 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.28 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.48 ' HB2' ' HB ' ' A' ' 32' ' ' THR . 66.3 mttm -89.19 152.02 21.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.94 0.4 . . . . 0.0 111.411 -179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -105.63 109.87 3.31 Favored Glycine 0 N--CA 1.442 -0.96 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 177.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.731 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 21.2 ptmt -102.09 169.51 8.7 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 120.507 0.194 . . . . 0.0 110.668 -178.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 132.07 -47.26 1.02 Allowed Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.313 -0.946 . . . . 0.0 113.754 177.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.0 -42.62 12.32 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.057 0.456 . . . . 0.0 111.71 -176.28 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 31.4 mmtp -83.41 -17.48 42.05 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 121.066 0.46 . . . . 0.0 110.165 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.731 ' SG ' ' HB2' ' A' ' 6' ' ' LYS . 66.3 m -73.43 150.95 41.32 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.041 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 46.9 p -87.11 167.28 14.32 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.744 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.9 m -63.93 -27.26 69.02 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 177.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.68 -43.08 76.89 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.458 178.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.481 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 44.0 t -69.83 -34.9 74.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.921 0.391 . . . . 0.0 110.301 178.163 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -70.31 -14.37 62.56 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.199 179.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.5 m -81.72 151.1 27.66 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -129.64 123.22 21.1 Favored Pre-proline 0 C--N 1.313 -1.012 0 CA-C-O 120.726 0.298 . . . . 0.0 111.508 -177.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.2 167.56 68.95 Favored 'Cis proline' 0 C--O 1.242 0.687 0 C-N-CA 123.314 -1.536 . . . . 0.0 111.805 -1.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.481 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 49.7 t -52.77 147.08 9.39 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.06 0.457 . . . . 0.0 111.947 -177.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -124.33 15.8 9.01 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.942 -178.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.429 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 67.5 m -69.0 -77.34 0.08 Allowed 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.751 0.31 . . . . 0.0 111.625 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 63.7 -106.9 1.52 Allowed Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.501 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.3 m -97.92 -1.18 43.44 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 120.976 0.417 . . . . 0.0 110.847 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -106.37 27.22 8.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.621 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 47.6 t -73.98 142.77 45.82 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.233 0.539 . . . . 0.0 112.224 -177.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -148.79 25.0 0.95 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.164 -0.926 . . . . 0.0 109.964 178.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.609 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 67.7 m -72.27 -175.33 1.52 Allowed 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.109 0.48 . . . . 0.0 111.909 -178.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -117.61 -172.75 16.06 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.757 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -70.86 -12.28 61.45 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 122.858 0.463 . . . . 0.0 111.576 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -96.34 20.06 51.92 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.628 -178.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.0 t -93.49 140.7 29.29 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.075 0.464 . . . . 0.0 110.327 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.48 ' HB ' ' HB2' ' A' ' 4' ' ' LYS . 11.0 t -122.3 17.9 10.64 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.129 -178.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.4 ' SG ' ' HB2' ' A' ' 35' ' ' ALA . 45.0 t -87.67 117.61 26.61 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.78 -11.72 60.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.341 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.4 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . . . -66.15 -45.37 81.23 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.019 179.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.429 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 6.1 p -106.34 -17.96 14.13 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.412 ' HD3' ' O ' ' A' ' 55' ' ' PRO . 21.4 ttmm -63.49 107.02 1.03 Allowed 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 178.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.2 t -127.08 152.62 47.04 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 120.819 0.342 . . . . 0.0 110.997 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.446 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 19.8 t -154.26 144.9 22.38 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.591 178.07 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -98.18 -26.29 14.61 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -178.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 74.7 m -67.96 144.17 55.31 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 177.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 26.8 p -123.09 -172.2 2.45 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.847 -176.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.0 m -70.4 -8.14 48.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.169 0.509 . . . . 0.0 110.575 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -67.09 -28.7 68.39 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.654 175.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.75 157.67 7.27 Favored Glycine 0 N--CA 1.439 -1.165 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.989 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.4 ' SG ' ' N ' ' A' ' 51' ' ' GLU . 42.9 t -74.26 139.13 44.09 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.341 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -127.15 -3.82 6.28 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -178.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.417 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 12.3 p -97.6 -29.67 13.3 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.49 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.44 9.01 18.24 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 120.4 -0.905 . . . . 0.0 113.584 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.723 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 47.0 mmtm -98.55 -1.08 41.93 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 117.352 0.576 . . . . 0.0 111.264 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.4 ' N ' ' SG ' ' A' ' 46' ' ' CYS . 48.5 mt-10 66.43 22.67 10.68 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.153 0.581 . . . . 0.0 111.1 -177.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 27.2 p -95.2 142.16 27.96 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.95 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.1 p -121.91 33.93 5.34 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-O 121.282 0.563 . . . . 0.0 110.593 -179.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 144.07 170.61 13.63 Favored Glycine 0 N--CA 1.435 -1.395 0 C-N-CA 120.762 -0.733 . . . . 0.0 111.33 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.446 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 28.6 Cg_endo -62.93 -15.69 49.18 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.834 2.356 . . . . 0.0 112.728 -178.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -66.78 -45.32 78.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.862 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.7 m -113.01 16.7 19.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.057 0.456 . . . . 0.0 110.769 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.513 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 38.9 t -77.82 122.44 25.44 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -124.43 18.03 8.94 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.478 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.723 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 8.3 m -68.58 147.19 52.3 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.218 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -82.29 43.15 2.98 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 120.818 -0.706 . . . . 0.0 113.231 -178.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.6 m 69.09 -48.89 0.59 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.957 0.903 . . . . 0.0 113.033 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.1 t -76.01 76.39 2.88 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.081 0.467 . . . . 0.0 110.18 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.9 t -140.01 170.53 15.69 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.056 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.2 t -76.3 -30.52 57.78 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.322 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.51 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 7.8 p -84.26 17.62 2.48 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 120.96 0.409 . . . . 0.0 111.323 -178.195 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.513 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 48.6 mmtm . . . . . 0 C--O 1.256 1.409 0 CA-C-O 117.735 -1.126 . . . . 0.0 110.921 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.443 0 N-CA-C 112.317 -0.313 . . . . 0.0 112.317 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.0 m -95.34 -2.86 48.35 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.852 0.358 . . . . 0.0 111.19 -178.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -85.36 76.98 2.13 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.949 -0.644 . . . . 0.0 111.852 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -94.27 -28.96 15.31 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.987 0.423 . . . . 0.0 110.374 -179.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.96 165.27 18.71 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.105 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.65 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 21.6 ptmt -66.82 143.75 56.7 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.883 0.373 . . . . 0.0 111.147 -179.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 159.97 -76.81 0.19 Allowed Glycine 0 N--CA 1.442 -0.944 0 C-N-CA 120.251 -0.976 . . . . 0.0 112.923 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -58.76 -30.9 67.88 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -176.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.445 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 71.2 mmtt -102.98 -0.95 30.16 Favored 'General case' 0 C--N 1.31 -1.121 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.621 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.65 ' SG ' ' HB2' ' A' ' 6' ' ' LYS . 94.2 m -97.23 159.24 15.03 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 121.298 0.57 . . . . 0.0 111.539 -178.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.463 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 41.9 p -93.55 -178.67 4.79 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.498 -176.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.0 m -80.44 -20.84 42.92 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.308 0.575 . . . . 0.0 109.676 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.2 -35.83 48.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.859 179.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.456 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 43.9 t -71.67 -13.67 61.81 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.712 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.463 ' HG2' ' O ' ' A' ' 11' ' ' THR . 12.5 mmt180 -72.24 -20.59 61.52 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.812 179.388 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.2 m -91.72 164.78 13.6 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -175.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.442 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 14.1 pt-20 -140.84 118.04 7.83 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.506 177.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.442 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 13.1 Cg_exo -66.69 171.45 39.7 Favored 'Cis proline' 0 C--N 1.352 0.732 0 C-N-CA 123.1 -1.625 . . . . 0.0 112.033 0.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.456 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 13.7 t -66.28 150.07 49.38 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.854 -175.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -113.89 7.06 16.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.489 -178.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.4 m -68.12 -75.61 0.1 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.699 0.285 . . . . 0.0 111.22 179.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 65.91 -109.23 2.77 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.586 -0.816 . . . . 0.0 111.418 -177.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.5 t -95.19 -17.96 21.3 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.456 0.646 . . . . 0.0 109.28 178.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -92.71 55.93 2.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.94 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 48.1 t -103.06 143.86 32.04 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.701 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.422 ' H ' HG22 ' A' ' 11' ' ' THR . 28.8 mm-40 -139.41 17.45 2.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.084 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.445 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 76.3 m -70.61 148.21 48.37 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.144 0.497 . . . . 0.0 111.928 -177.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -98.98 -160.63 29.55 Favored Glycine 0 N--CA 1.441 -1.019 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.552 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -73.28 -4.89 36.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.851 0.358 . . . . 0.0 111.781 -178.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -93.37 22.89 32.6 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.99 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.0 t -115.69 149.48 38.33 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.901 0.382 . . . . 0.0 110.919 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.2 t -133.62 12.58 4.08 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.138 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 37.8 t -72.51 119.96 17.45 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.222 0.534 . . . . 0.0 110.436 -178.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.11 -0.54 22.31 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.607 -178.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.78 -29.26 23.97 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.503 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.6 p -119.88 -26.12 5.69 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -83.29 107.05 15.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.987 0.422 . . . . 0.0 110.361 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.0 t -114.82 175.73 5.36 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.237 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 45.0 t -156.64 154.26 29.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.287 -178.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -114.6 -12.91 12.18 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 81.6 m -77.38 127.66 32.93 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 174.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 70.6 p -93.36 173.67 7.59 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.711 -172.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.505 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.7 m -66.94 -2.6 5.47 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.099 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -80.69 -36.45 32.3 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.987 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 168.09 151.58 7.14 Favored Glycine 0 N--CA 1.442 -0.945 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.669 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.7 t -78.59 138.87 38.57 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 122.48 0.312 . . . . 0.0 110.421 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -129.06 2.16 5.26 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 4.3 p -93.94 -37.68 11.57 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.006 -0.678 . . . . 0.0 109.737 177.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 124.32 -4.35 8.86 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.831 -0.699 . . . . 0.0 113.294 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.801 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 43.0 mmtm -87.62 -1.54 58.02 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 117.384 0.592 . . . . 0.0 111.527 -178.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 63.96 36.93 9.72 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.992 0.901 . . . . 0.0 109.865 -178.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 28.6 p -108.84 141.26 41.13 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.443 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.505 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 36.1 p -131.13 79.98 1.92 Allowed 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 177.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 105.72 159.9 22.83 Favored Glycine 0 N--CA 1.437 -1.263 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.468 -177.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -52.21 -31.15 44.64 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 123.437 2.758 . . . . 0.0 113.806 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -63.95 -44.44 92.82 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.988 0.423 . . . . 0.0 111.602 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.47 ' HB2' ' H ' ' A' ' 53' ' ' THR . 19.5 m -89.62 -12.66 39.06 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.691 -178.251 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 49.0 t -68.05 131.56 45.67 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.948 -177.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -118.13 14.96 14.09 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.592 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.801 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.8 m -103.34 164.41 11.66 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.278 -176.019 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -96.85 -166.3 33.11 Favored Glycine 0 N--CA 1.439 -1.121 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 177.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.6 m -85.1 25.24 0.99 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 117.106 0.453 . . . . 0.0 111.312 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.5 m -131.48 20.08 4.75 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 120.739 0.304 . . . . 0.0 111.638 -178.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . 0.423 ' SG ' ' N ' ' A' ' 65' ' ' SER . 46.0 t -99.68 171.26 8.01 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.79 0.329 . . . . 0.0 110.953 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.423 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 51.0 m -60.89 -34.51 74.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.556 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.441 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 31.9 p -82.89 21.84 0.99 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 120.969 0.414 . . . . 0.0 111.104 -179.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.441 ' HD3' ' O ' ' A' ' 66' ' ' CYS . 54.8 mmtt . . . . . 0 C--O 1.261 1.672 0 CA-C-O 117.494 -1.241 . . . . 0.0 110.061 178.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.432 0 N-CA-C 112.211 -0.355 . . . . 0.0 112.211 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.7 m -63.01 142.67 58.29 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 178.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -61.4 121.47 26.29 Favored Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 120.657 -0.782 . . . . 0.0 111.323 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.558 ' HZ2' ' HB3' ' A' ' 4' ' ' LYS . 5.9 ttpm? 63.14 46.45 4.62 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.356 0.598 . . . . 0.0 110.522 -179.008 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -71.2 -38.8 63.06 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 177.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.629 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 48.7 mtmt -139.68 105.98 5.27 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 175.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -81.75 -161.77 28.63 Favored Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 115.925 -0.58 . . . . 0.0 114.269 -174.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.2 mp0 -80.39 -12.42 59.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.093 0.473 . . . . 0.0 110.575 -178.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -83.01 0.81 43.03 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.465 -177.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.6 m -72.85 160.53 32.0 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.402 0.62 . . . . 0.0 111.494 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.403 HG23 ' HB2' ' A' ' 26' ' ' GLN . 77.6 p -97.47 170.13 9.26 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.906 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.8 m -64.77 -26.22 68.26 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.11 0.481 . . . . 0.0 109.971 177.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.82 -48.21 72.47 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.597 177.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.629 ' SG ' ' HD2' ' A' ' 6' ' ' LYS . 42.1 t -73.56 -24.66 60.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.044 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -79.57 -1.81 39.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.011 0.434 . . . . 0.0 111.424 179.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.3 m -105.35 150.0 25.59 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 176.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.406 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 10.7 pt-20 -119.09 129.8 25.19 Favored Pre-proline 0 C--N 1.322 -0.594 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.926 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.406 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 4.9 Cg_exo -72.45 175.04 45.57 Favored 'Cis proline' 0 C--O 1.236 0.395 0 C-N-CA 123.231 -1.571 . . . . 0.0 111.482 -0.195 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.9 t -55.39 135.33 50.35 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.009 0.433 . . . . 0.0 111.06 -178.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -110.55 20.11 18.03 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.694 -177.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 81.8 m -87.7 27.45 1.13 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.859 0.362 . . . . 0.0 110.695 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.98 -42.08 99.64 Favored Glycine 0 CA--C 1.52 0.389 0 CA-C-N 116.1 -0.5 . . . . 0.0 113.224 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.3 p -128.96 15.76 6.29 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.969 0.414 . . . . 0.0 111.125 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -162.16 101.28 1.1 Allowed 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.91 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 53.7 t -120.75 121.16 37.62 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-O 120.926 0.394 . . . . 0.0 109.952 177.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.403 ' HB2' HG23 ' A' ' 11' ' ' THR . 82.9 mt-30 -129.63 19.22 5.68 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.104 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.543 ' O ' ' HB2' ' A' ' 62' ' ' SER . 70.8 m -64.93 134.11 53.26 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.97 -91.42 0.37 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.822 -177.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -139.25 159.53 41.94 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 84.11 26.07 42.1 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 110.761 -0.936 . . . . 0.0 110.761 -177.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.8 t -124.08 132.85 53.71 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.207 -0.497 . . . . 0.0 110.263 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.2 t -165.55 71.87 0.16 Allowed 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.492 0.663 . . . . 0.0 111.171 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 10.4 p -101.23 8.82 42.37 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 121.241 0.543 . . . . 0.0 110.318 178.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 69.4 -16.87 0.24 Allowed 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 114.797 -1.092 . . . . 0.0 113.43 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.78 -54.07 7.1 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -178.006 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 26.9 p -92.74 -25.2 18.3 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.885 0.374 . . . . 0.0 110.925 -179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -49.09 113.17 0.74 Allowed 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.424 -178.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.5 t -124.68 165.12 18.48 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.448 -178.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.7 t -162.58 139.47 7.84 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -98.8 -10.05 23.55 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.725 0.297 . . . . 0.0 111.478 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 70.8 m -74.33 139.41 44.14 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 177.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 76.8 p -112.07 -174.09 2.39 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.578 -176.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.1 m -70.5 3.73 2.84 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.127 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -58.63 -36.71 74.51 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.148 0.499 . . . . 0.0 109.71 176.007 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 132.04 40.61 0.21 Allowed Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.257 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 43.2 t 71.47 148.01 0.08 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.98 0.512 . . . . 0.0 111.37 -178.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -126.59 -16.36 5.32 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.887 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.492 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 14.4 p -95.45 -36.06 11.47 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.464 -0.494 . . . . 0.0 111.503 -177.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.31 -3.86 20.18 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.215 -0.993 . . . . 0.0 112.908 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.468 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 76.0 mmtt -82.67 -4.5 57.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.911 0.386 . . . . 0.0 110.042 178.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 67.08 67.91 0.41 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.298 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.4 p -139.34 154.76 47.94 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.265 178.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.3 p -139.59 81.47 1.83 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.819 0.342 . . . . 0.0 111.18 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 98.58 160.46 29.97 Favored Glycine 0 C--N 1.315 -0.637 0 C-N-CA 120.548 -0.834 . . . . 0.0 112.03 178.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -56.98 -36.79 99.41 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.047 2.498 . . . . 0.0 112.655 -178.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -75.45 -11.5 60.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.198 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.6 m -129.05 25.93 5.52 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.121 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.461 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 47.1 t -103.34 150.91 23.33 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.423 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -121.15 -9.22 9.18 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-O 121.886 0.85 . . . . 0.0 108.726 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.9 m -86.32 144.17 27.51 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 114.645 -1.161 . . . . 0.0 111.511 -174.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -80.97 176.86 54.57 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.543 ' HB2' ' O ' ' A' ' 27' ' ' CYS . 18.2 m -66.4 -7.14 17.3 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 117.016 0.408 . . . . 0.0 111.778 -178.262 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.3 m -100.56 35.98 2.01 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.333 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 22.7 t -112.53 174.27 5.97 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 120.761 0.315 . . . . 0.0 111.081 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.0 m -71.43 -25.19 62.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.69 -178.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.492 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 32.1 p -87.02 16.91 4.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.822 0.344 . . . . 0.0 111.043 -179.186 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.461 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 53.8 mmtt . . . . . 0 C--O 1.257 1.452 0 CA-C-O 117.525 -1.226 . . . . 0.0 110.763 -179.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.243 0 N-CA-C 112.042 -0.423 . . . . 0.0 112.042 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.4 m -105.03 102.35 11.85 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 120.991 0.424 . . . . 0.0 110.624 179.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 83.16 -12.28 50.95 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.023 -0.608 . . . . 0.0 113.035 178.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -92.02 117.66 30.04 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 122.662 -0.316 . . . . 0.0 111.224 -179.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -108.7 -135.23 7.39 Favored Glycine 0 N--CA 1.442 -0.96 0 N-CA-C 110.734 -0.947 . . . . 0.0 110.734 177.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 92.0 mttt 62.34 90.7 0.07 Allowed 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 122.861 0.464 . . . . 0.0 111.442 178.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -91.55 60.32 2.89 Favored Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 121.197 -0.525 . . . . 0.0 112.623 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 69.52 -65.83 0.29 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.767 0.827 . . . . 0.0 111.904 178.086 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -109.66 77.69 1.08 Allowed 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.52 0.676 . . . . 0.0 110.642 -177.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.3 m -117.6 156.32 28.33 Favored 'General case' 0 C--N 1.273 -2.751 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.198 177.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.618 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 82.2 p -83.46 175.1 10.06 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.054 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.2 m -76.91 -16.39 59.4 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 176.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.58 -42.91 40.87 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.558 178.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 50.0 t -69.37 -27.72 65.57 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.186 0.517 . . . . 0.0 110.223 178.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.618 ' HG3' ' O ' ' A' ' 11' ' ' THR . 37.6 mtt180 -85.46 1.86 47.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.392 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.7 t -94.33 161.68 14.14 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -122.28 115.94 29.9 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-O 120.537 0.208 . . . . 0.0 110.646 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -79.14 -178.09 22.74 Favored 'Cis proline' 0 C--N 1.351 0.664 0 C-N-CA 124.068 -1.222 . . . . 0.0 111.717 -0.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.7 t -58.81 123.43 16.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.017 0.436 . . . . 0.0 110.001 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -101.07 18.76 18.93 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.655 -176.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 72.7 m -83.33 9.4 11.0 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -178.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.83 -36.95 93.96 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.507 -0.854 . . . . 0.0 111.224 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.7 m -97.85 -32.84 11.49 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 120.592 0.234 . . . . 0.0 111.324 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.441 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 9.5 ptpp? -139.04 103.75 4.86 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.14 0.495 . . . . 0.0 111.673 -178.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 44.5 t -112.39 114.88 27.83 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-O 121.2 0.524 . . . . 0.0 109.801 176.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -127.39 22.97 6.44 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.461 -177.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 98.2 m -61.31 157.62 16.14 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.666 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.33 -101.92 1.29 Allowed Glycine 0 N--CA 1.437 -1.269 0 C-N-CA 120.587 -0.816 . . . . 0.0 115.115 -174.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.578 ' HG3' ' H ' ' A' ' 30' ' ' GLY . 5.4 pt-20 -105.71 -84.34 0.5 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -172.212 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.578 ' H ' ' HG3' ' A' ' 29' ' ' GLU . . . -83.99 66.76 3.84 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 121.003 -0.617 . . . . 0.0 113.909 -175.127 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.1 t -74.43 139.49 44.02 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 176.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.7 t -112.39 14.75 20.4 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 121.298 0.57 . . . . 0.0 110.93 -176.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 43.7 t -96.16 148.83 22.3 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.697 178.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.9 5.94 26.84 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.869 0.366 . . . . 0.0 110.815 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -84.86 -44.91 12.79 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.035 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 6.0 p -101.47 -5.02 25.79 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.867 -178.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -81.85 115.63 21.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.868 0.366 . . . . 0.0 110.32 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 t -126.46 171.67 10.84 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.836 -179.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 48.0 t -155.95 148.5 23.85 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -179.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -109.65 -12.47 14.65 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -178.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 73.9 m -79.17 133.99 36.71 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.8 p -100.34 176.31 5.41 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-O 120.838 0.351 . . . . 0.0 111.514 -175.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.56 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 50.2 m -74.33 6.56 3.52 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.259 0.552 . . . . 0.0 110.899 178.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -85.84 -30.02 23.28 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.519 176.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 161.2 151.5 6.27 Favored Glycine 0 N--CA 1.437 -1.285 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.74 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.3 t -72.38 143.38 48.6 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -121.63 -25.72 5.05 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 8.1 p -77.97 -34.68 50.85 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.923 -177.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.76 -0.49 27.43 Favored Glycine 0 CA--C 1.523 0.565 0 C-N-CA 120.535 -0.84 . . . . 0.0 113.023 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -90.2 0.08 57.36 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.917 0.358 . . . . 0.0 110.729 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 64.38 62.72 0.8 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.966 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.9 p -134.43 154.97 51.11 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.412 176.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.56 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 19.3 p -137.7 51.13 1.92 Allowed 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.396 0.617 . . . . 0.0 110.78 -178.441 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 128.12 164.9 11.7 Favored Glycine 0 N--CA 1.439 -1.114 0 C-N-CA 120.838 -0.696 . . . . 0.0 111.363 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -57.77 -20.85 45.17 Favored 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 122.968 2.445 . . . . 0.0 113.632 -178.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -74.42 -41.85 60.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.902 0.382 . . . . 0.0 111.168 -179.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.7 p -98.29 1.08 46.79 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.173 0.511 . . . . 0.0 111.104 -178.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 43.4 t -86.03 129.9 34.7 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.943 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -117.96 7.18 12.25 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.799 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 5.6 m -75.14 154.7 37.62 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.813 -178.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -84.07 -156.05 22.88 Favored Glycine 0 N--CA 1.441 -1.0 0 C-N-CA 120.81 -0.709 . . . . 0.0 111.838 178.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 p -86.89 -8.81 56.92 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 120.745 0.307 . . . . 0.0 111.704 -178.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.7 m -115.37 60.34 0.7 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.133 0.492 . . . . 0.0 111.533 -177.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . 0.403 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 39.6 t -126.19 167.65 15.14 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.815 177.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 31.8 t -61.76 -32.77 73.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.388 -178.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 27.3 p -88.56 22.27 2.64 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 120.799 0.333 . . . . 0.0 111.404 -178.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.403 ' HG2' ' HB3' ' A' ' 64' ' ' CYS . 52.4 mmtt . . . . . 0 C--O 1.257 1.493 0 CA-C-O 117.458 -1.258 . . . . 0.0 110.778 178.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.472 0 N-CA-C 112.089 -0.404 . . . . 0.0 112.089 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.7 m -116.1 25.35 10.74 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.393 0.615 . . . . 0.0 109.693 179.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 135.54 155.72 7.37 Favored Glycine 0 N--CA 1.44 -1.086 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.21 -178.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -107.93 99.76 9.18 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-O 121.004 0.43 . . . . 0.0 110.944 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.408 ' O ' ' HB2' ' A' ' 6' ' ' LYS . . . -90.91 -14.89 57.29 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 111.406 -0.678 . . . . 0.0 111.406 179.006 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.421 ' NZ ' ' SG ' ' A' ' 14' ' ' CYS . 31.6 mtmt 74.04 -71.57 0.13 Allowed 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.586 0.754 . . . . 0.0 112.287 178.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -153.71 168.08 32.18 Favored Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.375 -0.917 . . . . 0.0 112.527 -179.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -78.44 -21.07 49.69 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.099 0.476 . . . . 0.0 110.173 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 5.9 tmtt? -74.24 -17.49 60.87 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.734 177.133 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.471 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 62.8 m -65.39 147.31 53.65 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.676 178.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.6 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 68.4 p -88.86 171.07 10.19 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.851 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.0 m -67.21 -26.87 66.82 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.393 0.616 . . . . 0.0 109.604 176.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.408 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . . . -69.82 -40.2 76.05 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.352 -179.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.421 ' SG ' ' NZ ' ' A' ' 6' ' ' LYS . 50.4 t -74.36 -20.63 60.02 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.361 0.601 . . . . 0.0 110.518 179.501 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.6 ' HG3' ' O ' ' A' ' 11' ' ' THR . 62.4 mtt180 -84.29 0.92 47.21 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.206 0.526 . . . . 0.0 109.948 178.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.2 m -102.78 159.06 15.81 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.493 178.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -128.8 124.38 22.51 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-O 120.7 0.286 . . . . 0.0 111.317 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.22 -178.65 21.11 Favored 'Cis proline' 0 C--N 1.351 0.679 0 C-N-CA 123.283 -1.549 . . . . 0.0 111.618 -1.04 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.9 t -61.72 135.31 57.56 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 120.887 0.375 . . . . 0.0 110.697 -178.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.3 mm-40 -112.08 16.96 19.99 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.802 -177.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.428 ' HB3' ' HB2' ' A' ' 25' ' ' CYS . 93.2 m -86.51 26.08 1.13 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -177.542 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.46 -42.99 99.23 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 120.527 -0.844 . . . . 0.0 111.602 178.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.5 p -139.39 20.04 2.57 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.308 0.575 . . . . 0.0 110.321 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 57.3 mttm -131.67 31.13 4.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.815 -177.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.428 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 18.1 t -91.82 145.63 24.41 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -174.354 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -156.81 16.72 0.3 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.192 178.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.473 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 99.6 m -64.99 164.15 13.28 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -176.322 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -146.3 -145.0 4.16 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 114.965 -1.016 . . . . 0.0 111.346 -179.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -68.02 154.14 42.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.12 0.46 . . . . 0.0 110.324 177.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.55 -33.8 5.6 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -174.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 24.0 t -74.24 147.78 42.13 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 t -145.12 27.19 1.29 Allowed 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.5 0.667 . . . . 0.0 109.762 -178.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 47.6 t -94.86 119.47 33.48 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.26 -176.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.24 -7.72 48.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.709 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.18 -27.46 60.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.663 -0.244 . . . . 0.0 111.456 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 10.1 p -134.64 11.47 3.72 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 112.33 0.492 . . . . 0.0 112.33 -177.392 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.0 mmtp -91.09 138.71 31.39 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.83 133.32 37.7 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.97 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 27.3 t -150.88 145.51 25.7 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.198 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -101.63 -19.75 15.31 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 121.018 -0.273 . . . . 0.0 111.732 179.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 74.0 m -74.39 133.3 42.48 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.8 p -109.89 -173.77 2.33 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.048 -175.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.4 m -69.66 -14.69 62.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.438 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.68 -40.06 95.9 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.916 177.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 164.07 155.2 8.17 Favored Glycine 0 N--CA 1.43 -1.759 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.42 179.477 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 47.0 t -77.49 130.43 36.98 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 178.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.446 ' HB3' ' HZ1' ' A' ' 47' ' ' LYS . 9.1 mtpm? -105.68 -26.52 11.78 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 8.3 p -78.89 -40.99 30.8 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.744 -177.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.91 12.82 10.79 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.045 178.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.465 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 74.8 mmtt -95.67 3.75 53.66 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.989 0.394 . . . . 0.0 110.549 178.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.403 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 34.0 tt0 66.12 29.64 9.78 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.929 178.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.5 p -102.19 150.99 22.73 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.564 178.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.8 p -141.11 66.05 1.38 Allowed 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.425 0.631 . . . . 0.0 110.255 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 121.24 154.52 9.27 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.563 179.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -53.65 -31.66 61.21 Favored 'Trans proline' 0 N--CA 1.48 0.728 0 C-N-CA 124.146 3.231 . . . . 0.0 115.039 -176.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -69.13 -41.89 76.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.866 0.365 . . . . 0.0 111.191 -178.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.6 m -96.69 0.02 49.03 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.804 -177.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.462 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 14.9 t -92.24 126.15 37.2 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.082 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -119.41 14.23 12.82 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.557 177.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 20.7 m -69.61 150.23 47.28 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.36 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -69.59 164.88 50.68 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.389 -179.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.8 p -72.93 -3.3 25.0 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.202 0.525 . . . . 0.0 111.606 -178.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.2 t -111.94 13.01 20.81 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.294 0.568 . . . . 0.0 109.78 178.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 65' ' ' SER . 47.1 t -73.85 169.72 16.81 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.828 -177.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.401 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 8.6 m -63.89 -34.49 78.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.789 -178.092 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 21.6 p -87.43 25.11 1.48 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.713 0.292 . . . . 0.0 111.324 -178.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.462 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 61.1 mmtt . . . . . 0 C--O 1.271 2.195 0 CA-C-O 118.087 -0.959 . . . . 0.0 110.866 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.19 0 CA-C-O 120.894 0.163 . . . . 0.0 112.811 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.6 p -78.34 119.83 22.23 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.907 0.384 . . . . 0.0 111.107 -179.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 122.13 4.47 9.28 Favored Glycine 0 N--CA 1.442 -0.933 0 C-N-CA 120.216 -0.992 . . . . 0.0 112.678 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -79.03 104.18 9.48 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 177.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 126.42 132.85 3.76 Favored Glycine 0 N--CA 1.436 -1.359 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.034 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.84 -23.03 20.68 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 120.801 0.334 . . . . 0.0 110.242 178.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.892 ' HA2' ' SG ' ' A' ' 10' ' ' CYS . . . -94.75 85.45 0.99 Allowed Glycine 0 N--CA 1.441 -0.983 0 C-N-CA 120.943 -0.646 . . . . 0.0 114.032 -175.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -86.29 -46.83 9.95 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 176.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -138.49 24.65 2.67 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.748 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.892 ' SG ' ' HA2' ' A' ' 7' ' ' GLY . 35.7 m -73.75 166.07 23.97 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.466 -176.36 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.541 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 72.5 p -90.61 173.32 8.11 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.231 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.1 m -71.81 -20.44 61.84 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 120.956 0.408 . . . . 0.0 109.997 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.89 -38.67 37.01 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.829 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.7 t -67.07 -20.72 65.87 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.225 0.536 . . . . 0.0 110.04 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.541 ' HG2' ' O ' ' A' ' 11' ' ' THR . 27.9 mmt180 -67.36 -25.94 66.22 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.048 177.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.2 m -85.75 147.08 26.5 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.035 -179.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.541 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 10.2 pt-20 -132.15 126.91 20.75 Favored Pre-proline 0 C--N 1.32 -0.699 0 CA-C-O 120.678 0.275 . . . . 0.0 111.052 -179.619 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.541 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 30.6 Cg_endo -63.25 160.53 60.41 Favored 'Cis proline' 0 C--O 1.241 0.662 0 C-N-CA 123.27 -1.554 . . . . 0.0 112.302 -0.694 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 32.3 t -52.96 149.15 6.78 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.888 0.743 . . . . 0.0 112.167 -176.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.403 ' HA ' ' OE1' ' A' ' 20' ' ' GLN . 16.3 mm-40 -122.7 14.18 10.09 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -176.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 63.8 m -61.31 -67.97 0.36 Allowed 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.027 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 60.04 -96.34 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 121.084 -0.579 . . . . 0.0 112.31 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.3 t -91.35 -29.24 17.22 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.747 0.308 . . . . 0.0 110.698 179.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -103.18 73.86 1.25 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -177.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 42.4 t -103.02 136.42 42.88 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 174.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -142.93 22.49 1.93 Allowed 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.505 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 91.3 m -69.48 143.52 53.48 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.605 -178.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.98 -171.27 47.16 Favored Glycine 0 N--CA 1.433 -1.557 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 176.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -63.75 -21.79 66.58 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.092 0.473 . . . . 0.0 110.633 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.68 63.27 4.48 Favored Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.301 178.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 50.4 t -133.02 128.64 36.77 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 178.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.8 t -106.35 9.27 31.91 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.082 0.468 . . . . 0.0 110.61 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 36.9 t -91.64 129.17 37.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.129 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -96.91 7.06 47.46 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.961 0.41 . . . . 0.0 111.132 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -82.46 -37.62 25.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.135 0.493 . . . . 0.0 111.006 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 9.9 p -103.04 -41.43 6.11 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.989 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.5 ttpt -69.38 103.16 1.93 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.161 0.505 . . . . 0.0 110.535 -179.045 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.8 t -106.15 169.01 8.75 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.375 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.9 t -149.91 145.0 26.26 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -178.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -99.43 -24.16 14.88 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -179.34 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.2 m -66.41 140.21 58.04 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 75.0 p -113.66 177.64 4.56 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.88 0.371 . . . . 0.0 111.507 -175.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.506 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 17.6 m -70.32 -9.66 56.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.869 179.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -69.44 -40.71 77.03 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 176.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 170.28 149.27 6.3 Favored Glycine 0 N--CA 1.44 -1.073 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.885 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.1 t -69.95 146.64 51.01 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 178.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -115.34 -38.71 3.74 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.66 -177.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.514 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 11.7 p -75.37 -35.47 61.1 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.359 -176.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.8 -0.15 30.41 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.601 -0.809 . . . . 0.0 113.014 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.433 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.1 mmtt -82.8 0.23 44.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.863 0.363 . . . . 0.0 110.393 179.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 67.34 50.32 0.97 Allowed 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.705 178.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 17.7 p -124.74 152.85 43.27 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.238 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.506 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 23.7 p -134.03 38.34 3.18 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-O 121.199 0.523 . . . . 0.0 110.966 -178.655 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 142.78 161.95 9.04 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -177.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -50.04 -42.92 44.31 Favored 'Trans proline' 0 N--CA 1.481 0.739 0 C-N-CA 123.411 2.741 . . . . 0.0 113.918 -177.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -65.4 -38.29 89.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.911 0.386 . . . . 0.0 111.5 -178.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.6 t -92.64 8.95 36.85 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.96 0.409 . . . . 0.0 110.126 -179.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 50.3 t -100.4 136.19 40.66 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.764 -178.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -126.43 16.71 7.66 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.653 0.74 . . . . 0.0 109.376 178.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.433 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 11.8 m -83.26 149.54 26.72 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.072 -178.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -83.12 -155.69 19.64 Favored Glycine 0 N--CA 1.443 -0.882 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 176.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 28.6 m -78.64 -33.5 47.19 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 120.849 0.357 . . . . 0.0 111.139 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.1 m -83.75 67.85 9.67 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.991 -177.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 11.2 t -142.45 161.99 36.62 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-O 120.933 0.397 . . . . 0.0 111.028 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.9 m -68.17 -33.25 74.11 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.998 -177.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.514 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 16.0 p -84.18 11.42 8.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.696 0.284 . . . . 0.0 111.443 -177.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm . . . . . 0 C--O 1.259 1.587 0 CA-C-O 117.246 -1.359 . . . . 0.0 111.341 -179.296 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.413 0 N-CA-C 112.303 -0.319 . . . . 0.0 112.303 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.3 t 62.79 83.83 0.15 Allowed 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 121.234 0.54 . . . . 0.0 110.751 -178.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -79.03 79.31 1.61 Allowed Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.985 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -96.25 136.2 37.05 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.806 0.336 . . . . 0.0 110.584 -179.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 126.11 -130.63 7.18 Favored Glycine 0 N--CA 1.438 -1.221 0 C-N-CA 120.701 -0.762 . . . . 0.0 111.673 -179.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.6 tptm -151.48 153.65 35.03 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -105.05 164.21 14.31 Favored Glycine 0 N--CA 1.442 -0.911 0 C-N-CA 120.355 -0.926 . . . . 0.0 112.389 -178.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -85.0 -9.78 57.69 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.196 0.522 . . . . 0.0 110.351 178.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -81.8 -7.69 59.62 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.347 177.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 86.7 m -70.68 165.88 21.98 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.427 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.492 HG21 ' H ' ' A' ' 26' ' ' GLN . 55.2 p -100.96 174.32 6.07 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.372 -179.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.1 m -74.87 -20.2 59.84 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 176.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.475 ' HB3' ' C ' ' A' ' 20' ' ' GLN . . . -74.72 -33.04 62.31 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.374 178.262 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.512 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 42.7 t -74.38 -12.38 60.5 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.596 0.712 . . . . 0.0 109.325 177.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.0 mmt180 -86.15 -1.0 57.02 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.953 176.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.3 m -96.54 154.4 17.3 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 120.847 0.356 . . . . 0.0 111.1 -178.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -136.26 112.46 10.21 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.755 178.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -66.82 165.28 66.54 Favored 'Cis proline' 0 C--N 1.356 0.927 0 C-N-CA 123.607 -1.414 . . . . 0.0 112.417 -0.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.512 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 5.1 t -57.81 151.84 16.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.494 -176.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.475 ' C ' ' HB3' ' A' ' 13' ' ' ALA . 27.8 mm-40 -129.52 17.51 5.88 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -174.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.0 m -66.74 -76.6 0.08 Allowed 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 57.47 -114.36 5.46 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 121.036 -0.602 . . . . 0.0 112.66 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.4 p -76.53 -17.99 58.95 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.84 0.352 . . . . 0.0 111.351 -178.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -101.13 20.87 14.84 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.348 -177.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.0 t -72.93 119.24 16.89 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 121.442 0.639 . . . . 0.0 111.122 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.492 ' H ' HG21 ' A' ' 11' ' ' THR . 76.4 mt-30 -121.42 6.75 10.1 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.833 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 93.8 m -55.87 117.52 3.76 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.368 -178.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -87.76 -170.52 46.27 Favored Glycine 0 N--CA 1.44 -1.088 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.009 -179.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -63.84 115.01 4.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.411 0.624 . . . . 0.0 110.349 179.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 143.16 -14.1 2.33 Favored Glycine 0 N--CA 1.442 -0.937 0 N-CA-C 110.934 -0.866 . . . . 0.0 110.934 -177.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.3 t -75.27 151.39 38.37 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 177.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.6 t -136.72 15.7 3.12 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 121.537 0.685 . . . . 0.0 109.921 -178.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.5 t -93.28 122.97 36.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.269 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -84.67 5.98 25.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -177.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.99 -34.62 32.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.141 0.496 . . . . 0.0 110.781 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 2.6 p -108.72 -33.2 7.06 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.197 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -63.2 110.5 1.88 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.656 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.3 t -111.29 170.0 8.41 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.518 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 41.7 t -157.06 149.23 22.92 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -116.5 -7.67 11.63 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 72.4 m -81.64 132.15 35.29 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 32.7 p -112.98 177.84 4.49 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-O 120.622 0.248 . . . . 0.0 111.596 -174.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.4 p -60.09 -16.99 36.53 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.386 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -57.59 -37.77 73.77 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 176.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 154.85 152.66 6.21 Favored Glycine 0 N--CA 1.43 -1.766 0 N-CA-C 110.534 -1.027 . . . . 0.0 110.534 -179.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 43.3 t -67.87 144.89 55.08 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -117.35 -21.48 8.68 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.543 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 12.2 p -89.76 -32.42 16.97 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.13 -177.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.8 -5.31 14.17 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.469 -0.872 . . . . 0.0 113.252 178.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.678 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 67.2 mmtt -79.99 -5.23 55.34 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.932 0.366 . . . . 0.0 111.05 -179.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 68.6 23.89 7.08 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.775 -178.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 25.5 p -93.18 151.29 19.92 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.266 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.3 p -139.46 81.85 1.85 Allowed 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.078 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.23 153.48 15.28 Favored Glycine 0 C--O 1.223 -0.539 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.03 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -53.43 -40.75 77.33 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 123.324 2.683 . . . . 0.0 113.755 -177.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -73.24 -23.13 60.31 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.017 0.437 . . . . 0.0 111.501 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.1 t -105.0 12.11 32.66 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.222 0.534 . . . . 0.0 109.974 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.424 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 37.1 t -101.63 150.72 22.81 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.713 -177.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -110.43 -27.54 8.97 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.166 0.508 . . . . 0.0 109.818 176.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.678 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.0 OUTLIER -63.4 126.7 28.34 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.746 -178.504 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -86.95 -60.61 1.66 Allowed Glycine 0 N--CA 1.442 -0.943 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.917 -179.299 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.7 t -157.12 171.35 20.6 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.8 m 64.85 23.77 12.69 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.446 0.698 . . . . 0.0 111.969 178.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . 0.402 ' SG ' ' N ' ' A' ' 65' ' ' SER . 46.3 t -106.58 169.76 8.34 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 120.884 -0.327 . . . . 0.0 110.798 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.402 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 36.2 m -71.36 -22.14 61.94 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.075 -178.226 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.543 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 18.4 p -93.68 18.29 10.41 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.867 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.424 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 63.2 mmtt . . . . . 0 C--O 1.261 1.708 0 CA-C-O 117.478 -1.249 . . . . 0.0 110.051 179.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.468 ' N ' ' HB2' ' A' ' 4' ' ' LYS . . . . . . . . 0 N--CA 1.487 2.04 0 N-CA-C 112.423 -0.271 . . . . 0.0 112.423 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.6 t -83.23 91.73 7.33 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 120.757 0.313 . . . . 0.0 110.428 -179.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 59.37 36.47 89.18 Favored Glycine 0 C--N 1.337 0.594 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.215 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.468 ' HB2' ' N ' ' A' ' 1' ' ' GLY . 45.0 mmtm -108.82 116.09 31.33 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -176.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -91.32 -3.91 69.0 Favored Glycine 0 N--CA 1.449 -0.46 0 N-CA-C 109.604 -1.399 . . . . 0.0 109.604 174.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.485 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 9.0 ptpp? -138.17 178.71 6.92 Favored 'General case' 0 N--CA 1.442 -0.864 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.054 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -154.27 -169.96 19.64 Favored Glycine 0 N--CA 1.44 -1.054 0 C-N-CA 119.722 -1.227 . . . . 0.0 112.553 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -74.86 -11.06 60.05 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.22 0.533 . . . . 0.0 110.343 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.564 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 88.4 mttt -86.3 0.39 53.98 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.327 178.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.557 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 89.8 m -77.65 153.81 32.78 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 176.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.443 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 46.9 p -91.72 168.06 11.74 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.799 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.0 m -67.91 -20.8 65.13 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.189 0.518 . . . . 0.0 109.768 177.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.49 -38.55 59.46 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.735 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.473 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 52.9 t -70.82 -22.46 62.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.371 0.605 . . . . 0.0 110.016 178.525 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.443 ' HG3' ' O ' ' A' ' 11' ' ' THR . 40.2 mtp180 -89.74 20.29 4.17 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.983 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.5 m -113.47 171.56 7.49 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.564 178.034 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -129.83 112.89 17.54 Favored Pre-proline 0 CA--C 1.54 0.56 0 CA-C-O 120.675 0.274 . . . . 0.0 110.958 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -79.27 -172.8 11.72 Favored 'Cis proline' 0 C--N 1.348 0.535 0 C-N-CA 123.89 -1.296 . . . . 0.0 111.598 -0.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.7 t -61.15 137.36 58.24 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.763 0.316 . . . . 0.0 110.158 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -121.35 26.78 8.69 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.429 -175.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.473 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 77.6 m -88.34 17.71 5.02 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.746 0.308 . . . . 0.0 111.622 -178.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.38 107.1 1.33 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 121.296 -0.478 . . . . 0.0 113.145 -178.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.6 m 64.36 18.54 11.37 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.083 0.553 . . . . 0.0 111.768 178.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -146.01 29.51 1.09 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.822 0.82 . . . . 0.0 108.811 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 34.1 t -84.98 149.5 25.56 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.362 -175.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.1 mm-40 -146.41 14.84 1.27 Allowed 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.339 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.564 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 60.0 m -66.44 136.37 55.62 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 121.247 0.546 . . . . 0.0 112.153 -178.367 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -106.21 -151.44 19.13 Favored Glycine 0 N--CA 1.44 -1.083 0 CA-C-N 115.195 -0.911 . . . . 0.0 112.1 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.438 ' HG2' ' HD2' ' A' ' 9' ' ' LYS . 13.6 pt-20 -65.05 155.12 35.77 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.952 0.406 . . . . 0.0 110.314 178.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.76 -35.46 4.83 Favored Glycine 0 N--CA 1.444 -0.811 0 N-CA-C 110.779 -0.929 . . . . 0.0 110.779 -177.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.8 t -80.96 128.93 34.24 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 121.059 0.457 . . . . 0.0 110.301 178.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.426 ' HA ' ' NZ ' ' A' ' 37' ' ' LYS . 6.4 t -123.56 18.45 9.62 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 121.407 0.622 . . . . 0.0 110.101 177.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 52.7 t -63.85 123.95 20.26 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.568 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.19 -10.46 59.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.991 -177.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.2 -41.47 61.36 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -178.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.6 p -111.37 -13.48 13.9 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -177.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.426 ' NZ ' ' HA ' ' A' ' 32' ' ' THR . 39.5 ttmt -77.89 108.43 11.13 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.576 177.301 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.9 t -124.91 162.45 24.39 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.78 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.5 t -143.11 156.71 44.86 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 120.678 0.275 . . . . 0.0 110.677 -178.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -107.59 -21.04 13.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.79 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 77.0 m -78.91 136.73 37.36 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 175.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.5 p -119.46 -177.12 3.29 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 -175.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.7 p -62.4 -12.48 21.84 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.76 -178.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -67.18 -29.46 69.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.206 0.527 . . . . 0.0 109.892 176.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 148.74 157.6 7.64 Favored Glycine 0 N--CA 1.44 -1.087 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.861 179.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 53.3 t -72.73 134.91 45.22 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -121.33 -3.17 9.46 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.599 -177.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 1.2 p -99.02 -37.74 9.24 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.146 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.82 19.12 5.38 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.696 -0.764 . . . . 0.0 113.037 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -113.61 8.25 17.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 117.035 0.418 . . . . 0.0 111.124 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 64.61 17.42 10.89 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.689 178.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 17.3 p -89.89 153.35 20.7 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.283 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.9 p -139.17 40.3 2.1 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.95 0.405 . . . . 0.0 110.724 -179.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.42 163.88 10.02 Favored Glycine 0 N--CA 1.439 -1.155 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.409 -178.497 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.3 -28.94 86.36 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.108 2.539 . . . . 0.0 113.918 -176.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -74.3 -36.78 63.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.858 0.361 . . . . 0.0 111.019 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.2 p -93.96 -10.6 33.16 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.091 0.472 . . . . 0.0 111.03 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 45.6 t -69.63 133.48 47.63 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.664 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -112.71 -7.2 13.83 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.843 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.538 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 9.0 m -64.33 124.79 22.64 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.315 -177.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.25 50.07 3.57 Favored Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.486 -179.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 57.6 m 66.34 -177.31 0.19 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.102 0.561 . . . . 0.0 111.127 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.3 m 66.19 6.85 4.43 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.36 0.6 . . . . 0.0 111.048 -178.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.7 t -100.09 167.5 10.43 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.064 -179.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.2 p -65.97 -30.18 70.69 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -176.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 22.0 p -94.36 -4.49 48.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.77 0.319 . . . . 0.0 111.454 -177.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.538 ' HE3' ' O ' ' A' ' 60' ' ' CYS . 1.8 mmmp? . . . . . 0 C--O 1.27 2.162 0 CA-C-O 118.016 -0.992 . . . . 0.0 111.342 -178.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.508 0 N-CA-C 112.324 -0.31 . . . . 0.0 112.324 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.5 m -159.6 109.38 1.88 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 142.69 -57.39 0.56 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.161 -1.019 . . . . 0.0 112.767 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.42 -51.62 64.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.943 0.401 . . . . 0.0 111.519 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 179.18 49.09 0.08 OUTLIER Glycine 0 CA--C 1.491 -1.417 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 -179.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.455 ' NZ ' ' SG ' ' A' ' 14' ' ' CYS . 40.3 tptt -138.69 114.9 10.29 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 121.029 -0.268 . . . . 0.0 110.808 -174.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 149.38 -58.92 0.45 Allowed Glycine 0 N--CA 1.441 -1.004 0 C-N-CA 119.846 -1.169 . . . . 0.0 114.156 177.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -87.31 -33.43 19.22 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -174.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 12.1 mptt -84.97 -13.97 49.0 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.314 178.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.1 m -83.49 168.73 16.2 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 121.841 0.829 . . . . 0.0 112.034 -177.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.458 HG21 ' H ' ' A' ' 26' ' ' GLN . 59.9 p -100.19 168.68 9.65 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-N 114.381 -1.282 . . . . 0.0 109.309 178.033 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.0 m -67.62 -17.55 64.65 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.349 0.595 . . . . 0.0 109.764 177.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.474 ' HB3' ' C ' ' A' ' 20' ' ' GLN . . . -79.57 -39.48 31.66 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.718 -178.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.455 ' SG ' ' NZ ' ' A' ' 6' ' ' LYS . 50.2 t -69.99 -25.48 63.63 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.183 0.516 . . . . 0.0 110.475 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 -83.43 8.64 13.22 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.828 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.8 t -115.46 148.53 39.32 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 177.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.523 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 16.3 pt-20 -124.82 130.12 24.35 Favored Pre-proline 0 C--N 1.323 -0.551 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.984 179.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.523 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 15.2 Cg_exo -66.97 166.94 59.94 Favored 'Cis proline' 0 C--N 1.35 0.627 0 C-N-CA 123.095 -1.627 . . . . 0.0 111.92 -0.029 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.2 t -56.35 123.18 13.77 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.186 -178.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.474 ' C ' ' HB3' ' A' ' 13' ' ' ALA . 84.2 mm-40 -100.86 19.69 16.76 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.953 -175.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 56.3 m -85.35 8.15 19.82 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.68 -23.93 69.29 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.289 -0.957 . . . . 0.0 110.821 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.2 p -99.05 -56.33 2.46 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.218 -0.491 . . . . 0.0 110.228 178.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -121.99 113.85 20.14 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.966 -178.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 17.3 t -130.97 129.65 42.39 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-O 121.001 0.429 . . . . 0.0 110.235 176.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.458 ' H ' HG21 ' A' ' 11' ' ' THR . 8.4 tt0 -143.11 14.69 1.87 Allowed 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.308 -178.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 72.6 m -59.61 131.44 50.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.657 -177.04 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.25 -156.15 32.48 Favored Glycine 0 N--CA 1.441 -0.985 0 CA-C-N 115.077 -0.965 . . . . 0.0 113.952 -176.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -67.42 148.27 51.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.249 -0.476 . . . . 0.0 111.016 -179.012 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.9 -26.47 24.34 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.426 -178.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.42 ' SG ' ' NZ ' ' A' ' 6' ' ' LYS . 48.6 t -77.36 116.76 18.22 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-O 121.089 0.471 . . . . 0.0 109.845 179.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.8 t -115.35 17.6 16.44 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.017 -179.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 47.1 t -62.08 110.07 1.48 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.467 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.51 -13.4 13.66 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -176.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.19 -53.19 15.31 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.445 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.9 p -102.75 -9.45 19.99 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -72.14 103.89 3.45 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.453 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 12.7 t -120.24 166.98 12.75 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.194 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.454 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 40.6 t -159.55 143.54 14.8 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.155 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -102.22 -15.7 16.55 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -179.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 76.5 m -77.93 136.37 38.0 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 175.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.1 p -115.08 -178.76 3.45 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -175.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.9 p -61.05 -15.15 29.13 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.101 -179.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -66.74 -33.67 76.15 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.209 0.528 . . . . 0.0 109.959 177.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 154.33 160.14 9.64 Favored Glycine 0 N--CA 1.435 -1.393 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.123 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.3 t -76.71 151.09 36.22 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -135.45 7.77 3.34 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 179.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.8 p -116.31 -19.61 10.1 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.855 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.25 14.91 29.36 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.683 -0.77 . . . . 0.0 113.494 178.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.619 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 42.1 mmtm -103.65 4.44 35.52 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 117.046 0.423 . . . . 0.0 111.25 179.212 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 62.26 21.49 12.52 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.244 178.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.4 p -95.35 146.7 24.19 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.376 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 47.4 p -133.05 38.91 3.33 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.244 0.545 . . . . 0.0 110.171 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.95 162.5 9.44 Favored Glycine 0 N--CA 1.436 -1.332 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -177.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.454 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 13.8 Cg_endo -56.66 -28.58 75.96 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.937 2.425 . . . . 0.0 112.713 -178.122 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -68.23 -35.61 78.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.724 -178.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.3 p -105.27 8.44 33.87 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.228 0.537 . . . . 0.0 110.841 -179.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 42.6 t -92.32 123.36 35.59 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.131 -176.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -90.42 -22.63 21.34 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.996 177.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.619 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.9 m -62.37 146.63 50.77 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.217 -177.598 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -105.49 -86.66 1.93 Allowed Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 110.954 -0.859 . . . . 0.0 110.954 177.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.1 m -130.16 171.75 12.52 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 178.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 37.8 m 64.61 33.81 10.4 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 177.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 35.3 t -119.73 160.38 22.66 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.68 0.276 . . . . 0.0 110.266 177.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.3 m -65.8 -23.03 66.61 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -178.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.508 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 8.9 p -95.01 13.42 25.12 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.293 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.508 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 47.2 mmtm . . . . . 0 C--O 1.259 1.56 0 CA-C-O 117.112 -1.423 . . . . 0.0 110.912 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 112.382 -0.287 . . . . 0.0 112.382 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.4 p -155.46 19.43 0.41 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.057 0.456 . . . . 0.0 110.999 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -117.73 93.57 0.58 Allowed Glycine 0 N--CA 1.442 -0.916 0 C-N-CA 120.568 -0.825 . . . . 0.0 113.034 -177.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -117.35 57.41 0.8 Allowed 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 176.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -81.31 75.53 2.29 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-N 115.669 -0.696 . . . . 0.0 113.098 -177.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -139.16 131.56 28.5 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.577 ' HA2' ' SG ' ' A' ' 10' ' ' CYS . . . 90.29 19.83 44.29 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.34 -0.933 . . . . 0.0 112.455 179.299 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -87.86 -27.79 22.0 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.036 0.446 . . . . 0.0 110.398 179.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -140.65 30.27 1.89 Allowed 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.023 -178.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.577 ' SG ' ' HA2' ' A' ' 7' ' ' GLY . 85.9 m -89.15 177.12 6.71 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-O 121.348 0.594 . . . . 0.0 111.663 -177.17 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.522 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 40.7 p -108.68 171.77 7.23 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.072 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.1 m -70.79 -26.9 63.53 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.47 -38.55 81.14 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.387 178.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 52.7 t -72.11 -34.6 68.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.244 178.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' A' ' 11' ' ' THR . 70.3 mtp180 -65.87 -29.04 69.42 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.275 178.42 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 49.1 m -67.77 152.25 45.89 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.142 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -126.26 120.04 23.57 Favored Pre-proline 0 C--N 1.318 -0.77 0 CA-C-O 120.763 0.316 . . . . 0.0 111.048 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -73.77 174.6 50.13 Favored 'Cis proline' 0 C--O 1.237 0.442 0 C-N-CA 123.426 -1.489 . . . . 0.0 112.141 0.27 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.0 t -55.5 136.22 50.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.092 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -111.98 17.6 19.54 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.289 0.566 . . . . 0.0 110.703 -178.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.402 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 93.3 m -81.85 29.54 0.39 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.333 -179.041 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.52 -45.72 95.29 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 176.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.2 m -131.58 4.29 4.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.048 0.451 . . . . 0.0 110.098 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -118.61 31.14 6.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.24 -177.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.531 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 16.7 t -82.97 127.28 33.39 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.13 -0.628 . . . . 0.0 111.18 -178.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.46 ' HB2' ' CG2' ' A' ' 11' ' ' THR . 84.4 mt-30 -142.77 18.83 1.99 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.181 -0.918 . . . . 0.0 108.904 -178.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 86.5 m -67.33 145.66 54.88 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.415 -176.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -96.62 -154.59 30.26 Favored Glycine 0 N--CA 1.438 -1.187 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.312 177.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -78.38 14.46 1.22 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.053 0.454 . . . . 0.0 111.263 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -110.21 34.62 5.31 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 121.102 -0.571 . . . . 0.0 111.865 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.5 t -130.92 148.68 52.71 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.045 0.45 . . . . 0.0 110.346 179.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.9 t -136.53 16.8 3.13 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.35 178.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.6 t -80.63 124.47 29.02 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.362 -178.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -81.18 9.11 7.34 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.439 -178.467 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -93.14 -13.08 28.91 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.976 0.417 . . . . 0.0 110.806 179.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.531 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 7.5 p -139.15 -27.78 0.8 Allowed 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 116.125 -0.488 . . . . 0.0 112.144 -178.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.413 ' HE3' ' O ' ' A' ' 60' ' ' CYS . 88.0 tttt -79.44 126.81 31.32 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 178.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.0 t -132.33 175.26 9.42 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.854 -177.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.428 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 40.6 t -158.92 148.26 18.85 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.346 -179.005 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -109.46 -12.35 14.72 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 179.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.7 m -81.07 133.63 35.51 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 177.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 75.4 p -113.73 176.6 4.96 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.412 -176.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.44 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 22.7 t -62.66 -18.71 62.85 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.905 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -64.86 -20.6 66.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.482 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.84 146.7 4.38 Favored Glycine 0 N--CA 1.439 -1.145 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.399 178.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 38.1 t -75.32 142.33 43.25 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -120.41 -6.92 9.78 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.458 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 11.2 p -99.71 -38.09 8.84 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.833 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.49 -0.98 16.11 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.67 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.632 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 73.4 mmtt -84.96 0.52 51.0 Favored 'General case' 0 C--O 1.239 0.551 0 O-C-N 122.625 -0.338 . . . . 0.0 110.852 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 63.92 35.39 10.9 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.268 178.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 24.1 p -107.85 155.48 20.21 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.901 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.44 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 50.1 p -140.75 50.18 1.67 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 120.971 0.415 . . . . 0.0 110.676 179.105 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 133.87 154.05 7.21 Favored Glycine 0 C--O 1.225 -0.429 0 C-N-CA 120.449 -0.881 . . . . 0.0 112.368 -179.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.428 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 76.0 Cg_exo -50.25 -41.46 50.27 Favored 'Trans proline' 0 C--N 1.36 1.139 0 C-N-CA 123.687 2.925 . . . . 0.0 114.022 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -64.37 -34.86 79.13 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.779 0.323 . . . . 0.0 111.616 -177.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 41.7 m -107.06 21.94 16.77 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.314 0.578 . . . . 0.0 110.079 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.468 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 49.4 t -98.45 123.88 42.84 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.671 -178.098 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -91.55 -17.67 25.28 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.865 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.632 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.7 m -71.66 154.05 41.65 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.797 -178.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.483 ' O ' ' HE3' ' A' ' 67' ' ' LYS . . . -92.76 -106.84 1.71 Allowed Glycine 0 N--CA 1.443 -0.871 0 C-N-CA 120.682 -0.77 . . . . 0.0 111.962 178.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.5 p -124.62 -26.0 3.91 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 120.894 0.378 . . . . 0.0 111.198 -179.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.3 m -89.4 50.05 1.86 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.36 -177.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 34.8 t -125.19 168.06 13.97 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 120.963 0.411 . . . . 0.0 111.345 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -70.25 -28.5 65.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.792 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.458 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 18.2 p -84.77 16.96 2.99 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.977 0.418 . . . . 0.0 111.122 -179.095 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.483 ' HE3' ' O ' ' A' ' 61' ' ' GLY . 58.0 mmtt . . . . . 0 C--O 1.26 1.624 0 CA-C-O 117.585 -1.198 . . . . 0.0 110.691 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.221 0 N-CA-C 112.294 -0.322 . . . . 0.0 112.294 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.0 t -130.25 -170.74 2.38 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 118.26 -42.12 1.88 Allowed Glycine 0 N--CA 1.444 -0.831 0 C-N-CA 121.0 -0.619 . . . . 0.0 111.656 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -103.44 103.01 12.94 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.918 0.39 . . . . 0.0 110.177 178.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 159.78 179.85 34.86 Favored Glycine 0 N--CA 1.44 -1.091 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.982 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.451 ' NZ ' ' SG ' ' A' ' 14' ' ' CYS . 61.9 mttm 70.99 142.64 0.05 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.622 0.769 . . . . 0.0 112.149 -179.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -116.94 -146.13 8.32 Favored Glycine 0 N--CA 1.436 -1.323 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.874 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -95.34 3.14 54.73 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -79.92 -24.11 41.31 Favored 'General case' 0 CA--C 1.514 -0.435 0 C-N-CA 120.171 -0.612 . . . . 0.0 109.368 176.202 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.534 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 87.7 m -65.94 136.72 56.47 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.18 176.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.625 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 68.7 p -72.76 171.46 12.56 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.07 -178.051 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.8 m -70.18 -11.78 61.14 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.327 0.584 . . . . 0.0 109.904 177.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.76 -39.21 15.11 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.338 -179.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.549 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 54.0 t -73.26 -24.11 60.41 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.005 0.431 . . . . 0.0 111.316 -179.101 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.625 ' HG3' ' O ' ' A' ' 11' ' ' THR . 86.9 mtt180 -73.59 -10.53 59.8 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.093 0.473 . . . . 0.0 110.188 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 30.8 t -88.84 159.99 17.45 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.132 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -131.82 116.96 16.05 Favored Pre-proline 0 C--N 1.317 -0.838 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.985 177.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -73.51 176.01 43.42 Favored 'Cis proline' 0 C--O 1.242 0.704 0 C-N-CA 123.536 -1.444 . . . . 0.0 112.583 1.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.2 t -59.72 141.07 55.9 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.807 -179.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -115.75 11.82 15.76 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.372 -178.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.549 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 58.1 m -81.89 20.46 0.97 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.733 0.301 . . . . 0.0 111.667 -179.057 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.5 108.29 2.13 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.075 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.1 m 63.03 15.09 8.14 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.18 0.592 . . . . 0.0 111.421 -178.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -152.31 81.4 1.25 Allowed 'General case' 0 N--CA 1.438 -1.027 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.436 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 49.5 t -130.38 150.27 51.68 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.172 -176.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -148.12 23.19 1.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.256 178.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 35.2 m -65.59 171.43 4.13 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.227 0.537 . . . . 0.0 112.361 -178.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.21 -165.7 40.08 Favored Glycine 0 N--CA 1.438 -1.173 0 CA-C-N 115.639 -0.71 . . . . 0.0 113.01 -177.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -84.23 -24.2 30.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 120.919 0.39 . . . . 0.0 110.975 -178.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -91.51 48.51 2.86 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.796 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 21.5 t -120.64 126.71 50.93 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.8 t -109.02 7.97 26.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.262 -178.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.2 t -69.17 115.1 8.06 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.299 179.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.86 -5.36 29.9 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -176.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.16 -40.9 51.45 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.805 0.336 . . . . 0.0 111.044 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.431 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 7.8 p -111.38 -18.45 12.89 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.934 -178.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -80.48 113.49 18.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.786 0.327 . . . . 0.0 110.347 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.457 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 12.6 t -120.72 167.11 12.82 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.741 -178.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.465 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 41.7 t -156.4 145.12 20.12 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 178.385 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -102.43 -13.52 17.23 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.498 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 70.0 m -88.9 135.63 33.43 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 175.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 81.4 p -127.94 -166.65 1.65 Allowed 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.571 -177.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.3 m -60.61 -15.04 24.04 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 120.91 0.386 . . . . 0.0 110.723 178.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -67.75 -30.22 69.63 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.634 178.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 147.55 157.97 7.67 Favored Glycine 0 N--CA 1.439 -1.152 0 C-N-CA 120.991 -0.623 . . . . 0.0 112.209 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.5 t -87.76 135.12 33.51 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.422 ' NZ ' ' HB3' ' A' ' 47' ' ' LYS . 8.0 mtpm? -126.75 5.46 6.69 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -179.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.449 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 13.7 p -99.63 -32.05 11.27 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 119.984 -0.686 . . . . 0.0 110.138 178.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.69 5.97 25.35 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.888 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.697 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 74.4 mmtt -93.32 0.43 56.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 117.03 0.415 . . . . 0.0 111.334 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 64.19 30.65 13.59 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.568 0.699 . . . . 0.0 110.624 178.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.0 p -104.17 151.34 23.45 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.243 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 26.7 p -140.25 79.7 1.72 Allowed 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.084 0.469 . . . . 0.0 110.025 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.9 152.38 13.9 Favored Glycine 0 N--CA 1.442 -0.918 0 C-N-CA 121.13 -0.557 . . . . 0.0 111.858 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.465 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 11.4 Cg_endo -54.31 -34.62 80.85 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 123.435 2.757 . . . . 0.0 113.32 -177.701 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -64.05 -36.35 83.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.968 0.413 . . . . 0.0 111.378 -178.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.3 m -106.86 22.96 15.13 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.691 -177.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 26.6 t -113.54 139.45 48.97 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.127 -178.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -124.72 12.79 8.58 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.851 0.357 . . . . 0.0 110.872 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.697 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 8.1 m -76.85 148.75 36.34 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.77 -179.021 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.671 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -81.79 -170.0 43.66 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 177.52 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.6 m -86.62 10.37 15.77 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 117.121 0.46 . . . . 0.0 111.616 -177.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.4 t -116.92 31.61 6.65 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.182 0.515 . . . . 0.0 109.866 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . 0.4 ' SG ' ' N ' ' A' ' 65' ' ' SER . 42.4 t -109.11 167.86 9.79 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.227 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.4 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 31.2 t -68.49 -29.27 67.84 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.451 -178.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.49 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 14.1 p -90.5 23.73 2.89 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.199 0.523 . . . . 0.0 110.411 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.671 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 47.3 mmtm . . . . . 0 C--O 1.273 2.29 0 CA-C-O 117.713 -1.137 . . . . 0.0 110.768 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.426 0 N-CA-C 112.413 -0.275 . . . . 0.0 112.413 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.2 m -76.01 113.96 14.12 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.795 0.331 . . . . 0.0 110.391 179.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 95.92 159.93 32.68 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.936 -0.65 . . . . 0.0 111.753 -178.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.404 ' H ' ' HD3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -105.91 15.83 26.04 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.053 0.454 . . . . 0.0 110.849 179.987 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -78.44 161.85 48.85 Favored Glycine 0 CA--C 1.495 -1.188 0 C-N-CA 120.699 -0.763 . . . . 0.0 111.994 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? 63.97 75.24 0.39 Allowed 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 121.551 0.691 . . . . 0.0 109.927 179.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -96.09 -140.96 11.44 Favored Glycine 0 N--CA 1.437 -1.29 0 CA-C-N 115.134 -0.939 . . . . 0.0 112.287 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -96.65 8.76 43.45 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 120.607 0.241 . . . . 0.0 111.56 -177.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.519 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 25.9 mtmm -111.45 18.86 18.76 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.223 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 10.7 m -82.09 162.2 22.61 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 174.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 80.6 p -100.54 -177.62 3.55 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 120.841 0.353 . . . . 0.0 110.616 -178.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.4 m -80.61 -30.26 36.81 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 175.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.66 -30.59 68.31 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.333 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.533 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 52.0 t -71.58 -22.76 61.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.169 0.509 . . . . 0.0 110.578 178.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -87.03 -2.65 58.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.914 0.388 . . . . 0.0 110.684 179.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.4 m -80.14 168.94 18.49 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.799 -179.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -136.63 108.84 9.31 Favored Pre-proline 0 C--N 1.32 -0.713 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.736 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -74.64 178.77 32.78 Favored 'Cis proline' 0 C--O 1.24 0.62 0 C-N-CA 123.535 -1.444 . . . . 0.0 111.919 -0.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.533 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 16.7 t -58.72 138.91 56.82 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -179.469 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 87.9 mm-40 -114.37 24.33 12.01 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -174.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.55 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 63.9 m -96.67 29.39 3.0 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.831 0.348 . . . . 0.0 110.555 178.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.06 -53.23 47.48 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.875 -0.602 . . . . 0.0 113.068 -179.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -111.51 -6.9 14.36 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.784 0.326 . . . . 0.0 111.339 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -139.07 91.72 2.54 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.863 0.363 . . . . 0.0 110.435 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 44.0 t -118.43 128.23 54.41 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.91 -179.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -127.0 15.92 7.34 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.612 178.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.519 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 93.5 m -70.01 132.41 45.87 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 121.208 0.528 . . . . 0.0 110.513 179.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.75 -166.95 42.29 Favored Glycine 0 N--CA 1.437 -1.275 0 CA-C-N 115.226 -0.897 . . . . 0.0 113.654 -176.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -53.74 -26.44 23.34 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.039 0.936 . . . . 0.0 112.167 -179.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -90.08 47.65 3.15 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 120.642 -0.79 . . . . 0.0 113.447 -177.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 49.8 t -120.44 139.35 52.98 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 117.117 0.459 . . . . 0.0 109.899 177.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.6 t -123.15 18.68 9.96 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 121.417 0.627 . . . . 0.0 109.857 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 42.9 t -93.54 113.54 25.68 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.586 -178.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.39 -4.32 29.38 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.673 -179.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.68 -41.04 39.51 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.334 -179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 19.8 p -106.95 -15.3 14.74 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.914 0.388 . . . . 0.0 111.979 -178.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -85.64 102.05 13.24 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.564 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.4 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 11.0 t -108.18 178.52 4.48 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.297 179.543 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 48.1 t -156.72 149.13 23.34 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -106.78 -17.05 14.32 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 73.9 m -76.62 137.27 39.37 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 176.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 65.6 p -93.39 170.13 9.85 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.852 -173.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.482 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 20.2 m -69.38 -4.17 17.28 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.3 -179.253 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -84.02 -31.78 25.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.814 179.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 172.3 156.76 12.82 Favored Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.378 -179.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 53.8 t -74.84 142.18 44.19 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.704 0.287 . . . . 0.0 110.519 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.481 ' HZ2' ' HB3' ' A' ' 47' ' ' LYS . 7.1 mtpm? -117.42 -18.6 9.79 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.735 -178.443 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.407 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 7.2 p -93.3 -33.23 14.0 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.857 -178.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.15 4.76 23.78 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.507 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.0 mmmp? -92.16 10.64 28.53 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 122.577 -0.366 . . . . 0.0 111.229 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 63.12 24.19 14.31 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.917 176.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 8.2 p -102.6 143.99 31.57 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.599 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.482 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 68.5 p -132.34 52.47 2.07 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-O 121.195 0.521 . . . . 0.0 110.198 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.87 161.18 9.79 Favored Glycine 0 N--CA 1.445 -0.704 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.52 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.33 -41.12 68.45 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.518 2.812 . . . . 0.0 114.129 -177.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -74.44 -22.96 58.87 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.012 0.434 . . . . 0.0 111.134 -178.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.4 m -96.44 -0.46 49.14 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.873 179.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 44.1 t -98.26 147.65 24.42 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.082 -176.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -138.16 11.59 2.82 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.935 0.874 . . . . 0.0 108.832 176.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.2 m -81.71 142.49 32.63 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.618 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.422 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -67.53 167.31 41.02 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.453 -0.88 . . . . 0.0 111.332 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 30.7 m -69.18 5.68 1.17 Allowed 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -178.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 33.5 t -108.7 5.7 25.04 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.652 0.263 . . . . 0.0 111.192 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 49.7 t -77.37 169.07 18.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.88 0.371 . . . . 0.0 111.105 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.8 m -64.62 -28.74 69.83 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.697 -178.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.431 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 18.7 p -89.82 25.7 2.0 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.007 0.432 . . . . 0.0 110.763 -179.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.431 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 47.9 mmtm . . . . . 0 C--O 1.263 1.773 0 CA-C-O 117.43 -1.272 . . . . 0.0 111.402 -178.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 98.5 mttt . . . . . 0 N--CA 1.446 -0.659 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 68.4 m -69.47 156.48 38.8 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.008 0.432 . . . . 0.0 110.344 177.331 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 65.2 p -92.71 169.24 10.64 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.071 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.8 m -73.99 -11.27 60.29 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.85 -42.96 18.88 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.25 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.43 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 44.8 t -69.84 -23.42 63.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.325 0.583 . . . . 0.0 110.582 178.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -85.78 5.37 32.75 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.991 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.8 t -110.04 156.88 19.94 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.93 -0.766 . . . . 0.0 108.93 177.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.437 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 6.7 pt-20 -126.17 126.67 24.74 Favored Pre-proline 0 C--N 1.322 -0.604 0 C-N-CA 121.084 -0.246 . . . . 0.0 110.361 177.343 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.437 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 11.7 Cg_exo -68.8 170.93 51.78 Favored 'Cis proline' 0 C--N 1.346 0.425 0 C-N-CA 123.236 -1.568 . . . . 0.0 111.98 0.321 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.404 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 5.3 t -60.09 116.74 4.4 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.645 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -86.23 8.69 20.15 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.433 -176.066 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.456 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 79.7 m -78.5 6.46 8.54 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.663 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.08 -20.62 65.04 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.962 -0.637 . . . . 0.0 111.61 177.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.5 m -143.37 23.55 1.81 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.055 0.455 . . . . 0.0 110.325 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 87.0 tttt -170.89 81.71 0.08 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.161 -178.643 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.3 t -121.42 138.63 54.19 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.837 0.351 . . . . 0.0 111.15 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -153.48 20.98 0.55 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.659 -0.701 . . . . 0.0 109.967 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.417 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 70.9 m -68.53 146.85 52.74 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -175.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.88 -146.42 16.75 Favored Glycine 0 N--CA 1.442 -0.949 0 CA-C-N 114.939 -1.028 . . . . 0.0 113.227 -178.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.498 ' CD ' ' H ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -75.74 -38.63 58.3 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 122.42 0.288 . . . . 0.0 111.65 -177.433 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.83 60.19 2.99 Favored Glycine 0 C--O 1.223 -0.561 0 C-N-CA 121.267 -0.492 . . . . 0.0 112.931 -178.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 35.7 t -153.81 111.3 3.48 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.887 0.375 . . . . 0.0 110.194 179.168 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 t -103.92 17.48 24.0 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.81 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.7 t -74.93 107.09 6.78 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.738 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.9 -10.34 56.62 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.664 -178.133 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.22 -36.36 83.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.91 0.386 . . . . 0.0 110.592 178.334 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.405 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 6.7 p -116.69 -15.2 10.79 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.792 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp -92.43 132.56 36.68 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.116 0.484 . . . . 0.0 111.561 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.0 t -136.25 153.61 51.15 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 177.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.9 t -147.43 154.36 40.73 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.59 0.233 . . . . 0.0 110.476 -178.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -112.73 -14.8 13.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.619 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 83.9 m -67.77 138.82 56.49 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 176.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.6 p -97.65 171.15 8.52 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.426 -171.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.404 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 16.5 m -71.49 -17.06 62.37 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -176.258 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -76.6 -21.67 55.26 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.931 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . 0.401 ' O ' ' HE2' ' A' ' 47' ' ' LYS . . . 166.66 156.33 9.54 Favored Glycine 0 N--CA 1.434 -1.465 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.237 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 44.1 t -69.47 145.35 52.81 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.401 ' HE2' ' O ' ' A' ' 45' ' ' GLY . 71.8 mmtt -111.83 -35.92 5.58 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.691 0.282 . . . . 0.0 111.531 -177.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.432 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 2.8 p -76.99 -39.67 49.56 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.97 -177.524 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.87 4.4 19.05 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.657 -0.782 . . . . 0.0 113.468 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.436 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 11.3 mmpt? -90.39 3.32 54.14 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 117.231 0.516 . . . . 0.0 110.373 178.454 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 63.95 61.45 0.95 Allowed 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.842 -179.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 9.5 p -136.92 145.26 44.07 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.238 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.404 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 40.5 p -132.04 70.15 1.47 Allowed 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.519 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 102.91 164.95 25.94 Favored Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.522 -0.846 . . . . 0.0 112.014 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -61.28 -11.68 20.3 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 C-N-CA 123.555 2.836 . . . . 0.0 113.221 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -69.97 -24.02 63.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.998 0.428 . . . . 0.0 111.321 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.6 m -144.79 29.77 1.21 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.058 0.456 . . . . 0.0 110.57 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 37.5 t -85.87 109.14 18.51 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.032 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 51.5 mttp -73.04 -25.15 60.83 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.659 0.742 . . . . 0.0 109.206 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.9 m -64.52 124.32 21.54 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 114.645 -1.161 . . . . 0.0 111.844 -176.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -97.38 56.38 1.22 Allowed Glycine 0 N--CA 1.443 -0.884 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 41.2 m 68.07 176.32 0.26 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.108 0.563 . . . . 0.0 111.116 -178.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.1 t 65.11 19.48 11.8 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 122.682 0.393 . . . . 0.0 111.658 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' CYS . . . . . 0.437 ' SG ' ' N ' ' A' ' 65' ' ' SER . 50.0 t -108.25 173.35 6.36 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.854 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.437 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 9.5 m -61.33 -37.73 84.33 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 122.878 0.471 . . . . 0.0 111.863 -178.219 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.503 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 31.9 p -84.51 17.41 2.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.995 0.426 . . . . 0.0 111.153 -178.476 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.503 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 43.0 mmtm . . . . . 0 C--O 1.263 1.763 0 CA-C-O 117.704 -1.141 . . . . 0.0 110.809 -179.088 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp . . . . . 0 CA--C 1.513 -0.453 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.0 m -76.35 153.66 35.63 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-O 121.422 0.629 . . . . 0.0 111.831 -179.101 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.543 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 43.4 p -90.89 174.28 7.53 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.281 -177.354 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 m -69.85 -27.87 65.2 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.418 ' HB1' ' C ' ' A' ' 20' ' ' GLN . . . -68.6 -41.11 80.03 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.278 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 44.4 t -70.82 -26.49 63.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.038 0.447 . . . . 0.0 110.255 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.543 ' HG3' ' O ' ' A' ' 11' ' ' THR . 22.2 mtm180 -82.01 -7.94 59.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.191 0.519 . . . . 0.0 110.126 178.202 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 49.0 m -91.87 156.22 17.65 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.371 178.352 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.447 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 7.5 pt-20 -132.04 125.75 20.26 Favored Pre-proline 0 C--N 1.311 -1.074 0 CA-C-O 120.689 0.28 . . . . 0.0 111.219 -178.472 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.447 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 55.3 Cg_endo -69.3 168.66 64.95 Favored 'Cis proline' 0 C--N 1.349 0.574 0 C-N-CA 123.159 -1.6 . . . . 0.0 112.001 -0.511 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.2 t -53.61 128.59 29.8 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.418 ' C ' ' HB1' ' A' ' 13' ' ' ALA . 31.0 mm-40 -108.14 19.74 19.56 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.189 -0.46 . . . . 0.0 112.031 -175.015 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 58.7 m -82.5 9.7 8.74 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -177.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.57 123.19 13.22 Favored Glycine 0 N--CA 1.442 -0.908 0 C-N-CA 120.63 -0.795 . . . . 0.0 111.376 177.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.1 m 72.74 1.83 4.14 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.439 0.696 . . . . 0.0 111.91 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -162.95 80.45 0.48 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 121.182 0.515 . . . . 0.0 110.471 177.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 47.4 t -112.62 137.22 51.18 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.365 177.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -136.95 17.95 3.02 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.973 -177.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 96.4 m -67.31 152.89 44.91 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.385 179.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.2 -144.55 5.64 Favored Glycine 0 N--CA 1.44 -1.035 0 C-N-CA 120.566 -0.826 . . . . 0.0 112.708 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.12 -18.44 23.54 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-O 121.007 0.432 . . . . 0.0 111.194 -179.729 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -94.57 74.18 1.02 Allowed Glycine 0 N--CA 1.44 -1.088 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.04 178.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.423 ' O ' ' HD2' ' A' ' 37' ' ' LYS . 45.0 t -146.04 119.48 9.04 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.045 0.45 . . . . 0.0 109.917 177.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.8 t -102.66 14.74 31.2 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.057 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.3 t -76.56 118.88 19.66 Favored 'General case' 0 N--CA 1.461 0.122 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.97 -14.91 62.93 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -177.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.8 -52.43 30.21 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -178.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 6.1 p -99.0 -17.57 18.22 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -177.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.423 ' HD2' ' O ' ' A' ' 31' ' ' CYS . 87.9 tttt -87.49 116.06 25.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.073 0.463 . . . . 0.0 111.095 179.237 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.8 t -125.95 -176.68 3.7 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.42 178.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.2 t -160.24 139.29 10.69 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.236 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 -89.53 -18.51 26.51 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.558 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 71.9 m -70.67 153.86 42.41 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.358 0.599 . . . . 0.0 111.464 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.7 p -127.5 -169.56 2.07 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.749 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 47.5 m -76.47 7.95 3.96 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.215 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.65 -34.14 77.19 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 175.184 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 123.06 52.42 0.21 Allowed Glycine 0 N--CA 1.438 -1.228 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.775 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 47.8 t 70.45 151.68 0.1 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.377 0.608 . . . . 0.0 111.27 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.2 tmtp? -123.25 -50.45 1.9 Allowed 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.767 -177.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 28.6 p -73.91 -35.34 64.62 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.911 -178.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.41 18.69 6.52 Favored Glycine 0 CA--C 1.522 0.481 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.914 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -101.49 9.46 41.34 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 122.648 -0.324 . . . . 0.0 111.58 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 66.84 34.99 5.14 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.409 0.684 . . . . 0.0 111.457 177.286 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 3.5 p -111.74 148.3 33.79 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.312 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.5 p -136.04 37.72 2.78 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-O 121.243 0.544 . . . . 0.0 111.509 -177.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.01 157.44 7.23 Favored Glycine 0 C--O 1.219 -0.807 0 C-N-CA 120.516 -0.849 . . . . 0.0 111.998 -178.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -45.31 -55.81 3.21 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.985 3.123 . . . . 0.0 114.971 -178.023 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -67.18 -35.37 79.51 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.906 0.384 . . . . 0.0 111.094 -177.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.2 m -89.45 9.92 24.63 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.01 -178.716 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 43.7 t -89.8 134.02 34.4 Favored 'General case' 0 N--CA 1.435 -1.202 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.136 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 47.8 mttt -101.19 -4.97 26.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.32 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.3 m -87.63 152.69 21.97 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.815 -174.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -81.84 -165.34 35.29 Favored Glycine 0 N--CA 1.44 -1.069 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.7 p -82.02 -17.01 48.26 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 117.1 0.45 . . . . 0.0 110.782 -178.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.1 t -99.47 69.05 1.63 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 121.269 0.557 . . . . 0.0 110.307 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 14.4 t -138.99 166.78 23.6 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.984 178.371 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -69.11 -26.33 64.86 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.321 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.731 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 11.8 p -84.09 6.53 21.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.008 0.432 . . . . 0.0 110.353 179.205 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.731 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 30.1 mmtp . . . . . 0 C--O 1.263 1.779 0 CA-C-O 117.601 -1.19 . . . . 0.0 110.355 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.554 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 5.6 mptt . . . . . 0 N--CA 1.445 -0.683 0 CA-C-O 120.473 0.178 . . . . 0.0 111.164 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.507 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 37.8 m -62.8 143.42 57.55 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-O 121.174 0.511 . . . . 0.0 111.38 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.438 HG22 ' HB2' ' A' ' 26' ' ' GLN . 40.8 p -90.12 168.67 11.79 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.341 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.7 m -72.35 -14.84 61.83 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.384 0.611 . . . . 0.0 109.499 175.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.14 -35.43 42.06 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.492 177.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.3 t -76.2 -16.47 59.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.682 177.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -86.17 4.72 37.32 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.228 176.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.2 t -114.08 153.54 29.28 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.714 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.492 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -130.82 127.01 22.07 Favored Pre-proline 0 C--N 1.315 -0.893 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.264 -178.701 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.492 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 36.6 Cg_endo -66.24 164.51 65.51 Favored 'Cis proline' 0 C--O 1.242 0.69 0 C-N-CA 123.341 -1.524 . . . . 0.0 111.996 -1.435 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.462 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 33.9 t -53.73 128.08 28.22 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.091 -178.396 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -98.6 22.77 9.45 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.573 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.566 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 89.9 m -96.67 22.33 8.25 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.59 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.26 -40.95 77.7 Favored Glycine 0 CA--C 1.52 0.363 0 C-N-CA 121.282 -0.485 . . . . 0.0 113.162 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.9 t -144.36 2.07 1.1 Allowed 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.956 0.408 . . . . 0.0 110.803 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -114.82 21.24 14.54 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.061 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 49.8 t -65.41 144.74 56.87 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.34 0.59 . . . . 0.0 112.042 -176.522 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.438 ' HB2' HG22 ' A' ' 11' ' ' THR . 34.2 mt-30 -147.34 16.17 1.16 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.378 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 79.9 m -68.82 171.3 8.1 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.435 0.636 . . . . 0.0 112.364 -177.509 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -115.78 -151.51 9.83 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.874 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -83.82 -18.18 38.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.022 0.411 . . . . 0.0 110.614 179.503 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.23 42.34 2.74 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 121.091 -0.576 . . . . 0.0 111.926 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.4 t -127.58 126.55 42.31 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-O 121.085 0.469 . . . . 0.0 109.969 -179.141 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 t -102.57 4.4 38.4 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.501 0.667 . . . . 0.0 110.029 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 35.1 t -82.24 116.0 21.57 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.601 -178.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.86 -0.77 49.73 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.309 -179.117 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.26 -42.26 69.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.996 0.427 . . . . 0.0 110.697 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.566 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 5.7 p -101.33 -39.93 7.36 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.126 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -73.15 99.99 2.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.105 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.1 t -114.5 -179.13 3.54 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.276 179.262 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.441 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 34.1 t -163.34 136.2 5.45 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 122.835 0.454 . . . . 0.0 109.803 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -92.58 -15.99 26.23 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.485 ' SG ' ' HB2' ' A' ' 47' ' ' LYS . 88.8 m -69.15 147.4 51.43 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.205 0.526 . . . . 0.0 111.215 178.344 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 16.5 p -123.32 179.43 4.72 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.474 -175.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.4 m -66.27 -5.25 9.8 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.897 -179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -58.79 -35.23 72.47 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 120.87 0.367 . . . . 0.0 110.213 177.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 136.99 50.62 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.24 -0.981 . . . . 0.0 113.152 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 44.4 t 66.4 166.69 0.21 Allowed 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 120.944 0.402 . . . . 0.0 111.165 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.485 ' HB2' ' SG ' ' A' ' 41' ' ' CYS . 98.1 mttt -139.92 -46.62 0.44 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.849 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.548 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 20.8 p -73.7 -34.61 64.92 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.458 -177.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.73 21.95 4.86 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.502 -0.856 . . . . 0.0 113.136 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.548 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 75.1 mmtt -107.19 6.5 28.77 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.921 0.361 . . . . 0.0 110.463 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 62.5 26.42 15.72 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.979 0.912 . . . . 0.0 111.368 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 11.6 p -95.91 151.77 19.11 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.441 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.9 p -138.19 80.95 1.83 Allowed 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.196 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 88.79 160.26 36.11 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.545 -0.835 . . . . 0.0 111.703 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.441 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 18.1 Cg_endo -59.3 -21.4 60.28 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.87 2.38 . . . . 0.0 112.788 -178.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.21 -30.11 71.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.87 178.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.3 t -139.54 63.96 1.48 Allowed 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 121.505 0.669 . . . . 0.0 109.314 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.408 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 48.8 t -133.3 132.09 40.96 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.257 -179.469 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -110.72 -3.25 15.89 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.168 0.509 . . . . 0.0 110.004 178.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.4 m -74.29 137.91 43.22 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.389 -176.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.24 169.77 53.77 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.306 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.3 m -64.94 -12.94 55.29 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -177.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.1 m -101.58 17.65 22.28 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.629 0.252 . . . . 0.0 111.627 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' CYS . . . . . 0.415 ' SG ' ' N ' ' A' ' 65' ' ' SER . 37.5 t -83.49 172.43 12.42 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 111.357 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.415 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 14.7 m -72.72 -20.37 61.22 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.232 -177.57 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.491 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 23.4 p -89.93 11.45 20.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.876 0.37 . . . . 0.0 111.002 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.408 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 57.9 mmtt . . . . . 0 C--O 1.269 2.117 0 CA-C-O 117.744 -1.122 . . . . 0.0 110.515 -179.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.609 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 29.8 mmtp . . . . . 0 CA--C 1.51 -0.57 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.3 m -87.07 157.36 19.43 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.368 0.604 . . . . 0.0 111.692 -177.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.59 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 61.7 p -95.31 175.47 6.58 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.694 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.6 m -70.53 -17.43 62.94 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.007 0.432 . . . . 0.0 110.858 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.17 -40.07 53.38 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.024 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 53.1 t -74.72 -23.22 58.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.171 0.51 . . . . 0.0 110.229 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.59 ' HG3' ' O ' ' A' ' 11' ' ' THR . 86.5 mtt180 -77.41 0.23 23.31 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.76 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 t -102.21 158.58 16.07 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -128.87 123.03 21.74 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-O 120.679 0.276 . . . . 0.0 110.707 178.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -71.33 178.61 28.46 Favored 'Cis proline' 0 C--O 1.235 0.375 0 C-N-CA 123.412 -1.495 . . . . 0.0 111.868 -0.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.8 t -61.66 134.66 57.06 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.639 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -115.17 20.62 14.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.742 -176.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.505 ' HB3' ' HB2' ' A' ' 25' ' ' CYS . 81.3 m -81.13 59.76 4.01 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -178.178 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.69 -57.67 4.44 Favored Glycine 0 C--N 1.302 -1.335 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 176.34 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.5 m -125.66 5.74 7.49 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.125 0.488 . . . . 0.0 110.378 178.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -113.8 34.33 4.67 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.341 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.505 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 13.8 t -92.95 115.93 28.58 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 120.059 -0.657 . . . . 0.0 111.328 -179.513 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.526 ' HB2' ' CG2' ' A' ' 11' ' ' THR . 27.4 mm-40 -131.23 14.87 5.11 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.203 -0.908 . . . . 0.0 108.905 177.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.609 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 73.9 m -61.61 140.33 58.16 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.976 -177.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.528 ' H ' ' HB3' ' A' ' 9' ' ' LYS . . . -113.98 -164.23 15.2 Favored Glycine 0 C--N 1.312 -0.789 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.105 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.493 ' CD ' ' H ' ' A' ' 29' ' ' GLU . 1.0 OUTLIER -65.72 134.56 53.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.998 0.428 . . . . 0.0 110.209 179.033 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 117.46 -10.52 14.51 Favored Glycine 0 N--CA 1.438 -1.207 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -175.291 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 47.5 t -80.0 123.94 28.27 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.9 t -106.78 12.14 29.39 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.337 0.589 . . . . 0.0 110.914 -176.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.8 t -82.44 141.12 33.0 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.098 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -100.17 0.86 41.33 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.061 0.458 . . . . 0.0 110.765 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.48 -51.52 9.86 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.507 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 5.1 p -100.04 -19.4 16.55 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -175.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -75.95 131.55 39.67 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.484 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.559 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 10.8 t -133.26 -176.92 4.3 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.44 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 37.4 t -162.12 153.85 18.69 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 122.793 0.437 . . . . 0.0 109.913 -179.293 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -112.1 -12.5 13.67 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.4 m -78.25 130.03 35.77 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.2 p -103.91 175.8 5.36 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.479 -174.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.4 t -65.39 -7.2 12.68 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.038 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -71.55 -27.44 63.17 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.394 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 153.31 155.09 7.0 Favored Glycine 0 N--CA 1.437 -1.243 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.675 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.6 t -74.77 137.72 42.17 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -118.75 -3.58 10.79 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.369 -0.532 . . . . 0.0 112.332 -177.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.633 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 8.0 p -102.53 -35.72 8.64 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.035 -0.666 . . . . 0.0 110.495 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.98 13.83 7.55 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.182 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.642 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 32.5 mmtp -101.1 -1.67 33.45 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 117.077 0.438 . . . . 0.0 110.61 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 67.47 27.93 7.84 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.993 -179.044 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 25.0 p -99.3 150.94 21.61 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.707 178.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.2 p -142.71 62.03 1.41 Allowed 'General case' 0 C--N 1.312 -1.051 0 CA-C-O 121.146 0.498 . . . . 0.0 110.364 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 124.44 156.05 9.32 Favored Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.362 -0.695 . . . . 0.0 111.362 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.21 -38.66 81.69 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 123.054 2.503 . . . . 0.0 113.435 -177.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.38 -38.54 87.38 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.955 0.407 . . . . 0.0 111.494 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.9 t -98.37 2.75 48.27 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.598 -178.037 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 54.0 t -92.48 133.53 35.83 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.138 0.495 . . . . 0.0 111.709 -177.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -116.87 11.02 14.3 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.091 179.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.642 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 18.8 m -83.28 157.61 22.56 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.922 -178.654 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.481 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -88.4 -166.16 42.01 Favored Glycine 0 N--CA 1.437 -1.3 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 175.419 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.6 m -79.82 -15.38 57.53 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 117.467 0.634 . . . . 0.0 111.774 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.8 m -99.96 73.68 1.76 Allowed 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.887 0.375 . . . . 0.0 110.99 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.2 t -144.71 165.96 26.57 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.929 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 10.0 m -63.38 -28.97 70.35 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.712 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 16.3 p -92.83 19.29 7.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.076 0.465 . . . . 0.0 110.564 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.559 ' HE3' ' O ' ' A' ' 38' ' ' THR . 48.7 mmtm . . . . . 0 C--O 1.262 1.748 0 CA-C-O 117.681 -1.152 . . . . 0.0 111.041 -179.031 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 97.9 mttt . . . . . 0 CA--C 1.509 -0.617 0 CA-C-O 121.355 0.597 . . . . 0.0 110.02 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.626 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 38.0 m -74.13 149.44 41.03 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.254 177.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.594 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 61.6 p -77.2 164.26 25.78 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.018 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.0 m -63.15 -24.9 68.1 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.2 -46.47 70.55 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.355 177.707 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.615 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 47.9 t -70.22 -29.83 66.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.101 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.594 ' HG3' ' O ' ' A' ' 11' ' ' THR . 85.6 mtt180 -70.72 -8.9 55.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.042 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.8 m -90.93 166.41 13.06 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.842 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -132.25 120.47 17.09 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-O 120.47 0.176 . . . . 0.0 110.985 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -73.53 -177.31 19.01 Favored 'Cis proline' 0 C--N 1.351 0.669 0 C-N-CA 123.589 -1.421 . . . . 0.0 112.038 0.086 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.8 t -60.76 139.68 57.83 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.128 -178.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 81.3 mm-40 -111.55 12.11 21.3 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.223 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.615 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 78.9 m -82.89 26.89 0.57 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.86 0.362 . . . . 0.0 110.749 178.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.03 -47.29 88.62 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.854 -178.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.3 m -128.64 25.28 5.71 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 120.791 0.329 . . . . 0.0 110.649 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -164.89 95.87 0.71 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.746 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 49.1 t -122.84 145.85 48.07 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.574 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.405 ' HB3' HG22 ' A' ' 11' ' ' THR . 13.7 tt0 -149.75 14.84 0.85 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.851 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.626 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 95.1 m -61.7 142.85 56.96 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -177.488 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.54 -157.79 29.14 Favored Glycine 0 N--CA 1.438 -1.224 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.718 177.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -5.12 50.68 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 117.242 0.521 . . . . 0.0 110.971 178.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -95.26 54.01 1.81 Allowed Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.264 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.5 t -128.99 146.05 51.08 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.2 t -123.89 14.7 9.27 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.178 0.513 . . . . 0.0 110.08 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 8.6 t -92.0 136.76 32.91 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.502 -177.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -96.3 -3.65 43.56 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.129 0.49 . . . . 0.0 110.616 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.1 -31.39 58.67 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.309 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.431 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 7.6 p -114.88 -16.02 11.76 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -177.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.411 ' HE2' ' O ' ' A' ' 55' ' ' PRO . 85.2 tttt -84.77 109.51 18.11 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.949 -0.3 . . . . 0.0 110.755 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 t -121.38 176.2 5.77 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.881 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.466 ' HB3' ' N ' ' A' ' 55' ' ' PRO . 42.6 t -162.85 148.32 12.04 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 122.554 0.342 . . . . 0.0 110.342 -178.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -107.29 -14.88 14.78 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 83.5 m -77.78 144.36 37.2 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 177.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 49.5 p -127.78 -179.78 5.13 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.548 0.213 . . . . 0.0 111.435 -175.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 40.3 m -62.83 -16.08 56.91 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -177.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -66.09 -34.42 78.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.167 0.508 . . . . 0.0 110.11 177.424 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.93 151.29 6.18 Favored Glycine 0 N--CA 1.435 -1.407 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.741 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 39.6 t -73.99 139.08 44.55 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -108.74 -15.21 14.45 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -177.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.632 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 15.2 p -102.17 -33.21 9.74 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 120.186 -0.605 . . . . 0.0 110.867 -179.236 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.36 10.46 17.44 Favored Glycine 0 CA--C 1.523 0.564 0 C-N-CA 120.762 -0.732 . . . . 0.0 113.53 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.728 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 31.7 mmtp -90.81 1.64 56.76 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 117.12 0.46 . . . . 0.0 111.519 -179.042 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 50' ' ' LYS . 37.5 mm-40 70.17 21.41 5.96 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.58 0.55 . . . . 0.0 111.163 -179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.0 p -96.86 146.74 24.65 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.137 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.1 p -135.09 35.74 3.04 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-O 120.929 0.395 . . . . 0.0 110.874 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 158.83 157.28 8.42 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.429 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.466 ' N ' ' HB3' ' A' ' 39' ' ' CYS . 10.8 Cg_endo -52.22 -51.26 11.54 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 124.078 3.185 . . . . 0.0 115.104 -177.008 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -71.22 -35.04 71.35 Favored 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.938 -176.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.2 m -84.9 -0.91 55.74 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.754 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.488 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 44.2 t -74.68 146.15 42.57 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.909 -179.123 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -108.98 -4.88 16.34 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.64 -179.178 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.728 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 11.0 m -81.44 151.35 27.92 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.474 -177.003 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -109.34 62.24 0.29 Allowed Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.956 -0.565 . . . . 0.0 112.306 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.488 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 49.2 m 69.79 -37.95 0.39 Allowed 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 177.038 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.3 p -84.37 67.69 9.95 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -177.51 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 35.8 t -146.13 169.97 17.65 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.723 176.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.1 t -75.09 -21.53 58.88 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.384 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.49 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 9.3 p -82.15 22.49 0.8 Allowed 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.246 0.546 . . . . 0.0 110.574 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.488 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 66.8 mmtt . . . . . 0 C--O 1.271 2.208 0 CA-C-O 117.338 -1.315 . . . . 0.0 110.109 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.481 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 27.8 mtpp . . . . . 0 N--CA 1.444 -0.753 0 CA-C-O 120.662 0.268 . . . . 0.0 111.359 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.9 m -77.73 163.95 25.69 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 121.031 0.443 . . . . 0.0 110.119 175.623 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 65.6 p -104.23 162.78 12.9 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.838 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.2 m -70.19 -13.75 62.32 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.285 0.564 . . . . 0.0 110.313 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.09 -34.38 32.67 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.899 176.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.439 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 43.1 t -75.53 -29.0 59.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.573 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.4 mtt180 -77.67 8.94 3.82 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.261 0.553 . . . . 0.0 111.018 177.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 39.2 t -108.08 150.14 27.55 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.441 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.415 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 11.2 pt-20 -127.85 124.37 23.24 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-O 120.601 0.239 . . . . 0.0 110.526 178.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.415 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 7.9 Cg_exo -70.15 169.83 63.1 Favored 'Cis proline' 0 C--O 1.239 0.565 0 C-N-CA 123.069 -1.638 . . . . 0.0 112.007 0.302 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 13.4 t -56.89 138.18 54.13 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.31 -177.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -112.37 16.25 20.0 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.167 -178.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 56.6 m -89.32 14.25 11.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.293 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.59 -49.1 76.52 Favored Glycine 0 CA--C 1.521 0.432 0 C-N-CA 121.293 -0.48 . . . . 0.0 113.103 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.7 m -113.0 13.13 19.42 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.898 0.38 . . . . 0.0 111.265 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 57.3 tttm -164.93 101.5 0.77 Allowed 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.391 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.428 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 45.1 t -132.18 149.7 52.33 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.196 -179.292 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -153.38 22.25 0.55 Allowed 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.901 178.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 91.0 m -68.44 144.97 54.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.095 0.474 . . . . 0.0 111.271 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.47 ' HA3' ' HE3' ' A' ' 9' ' ' LYS . . . -81.19 -156.78 15.81 Favored Glycine 0 N--CA 1.441 -0.972 0 CA-C-N 115.48 -0.782 . . . . 0.0 112.816 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.519 ' CD ' ' H ' ' A' ' 29' ' ' GLU . 0.2 OUTLIER -78.55 -31.49 47.46 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.793 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -78.87 60.69 4.13 Favored Glycine 0 N--CA 1.444 -0.803 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.209 178.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 48.4 t -129.11 142.33 50.92 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 177.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.8 t -120.43 12.61 11.67 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.13 0.49 . . . . 0.0 110.753 -178.131 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.437 ' SG ' ' HB3' ' A' ' 35' ' ' ALA . 48.9 t -90.27 115.88 27.82 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.042 0.448 . . . . 0.0 110.172 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.96 4.73 16.0 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.454 -178.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.437 ' HB3' ' SG ' ' A' ' 33' ' ' CYS . . . -80.77 -42.83 21.13 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.812 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 8.9 p -106.34 -36.13 6.93 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.375 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -80.61 116.42 20.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.207 0.527 . . . . 0.0 110.424 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.417 ' HA ' ' HG3' ' A' ' 55' ' ' PRO . 12.0 t -123.31 -176.2 3.38 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.471 -179.027 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 41.8 t -154.24 140.35 18.41 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -90.33 -17.26 27.66 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.299 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 99.6 m -73.81 154.53 39.48 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.126 0.489 . . . . 0.0 111.305 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.2 p -115.44 -173.63 2.37 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.477 -175.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.0 m -71.56 -6.01 37.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.599 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -60.03 -37.91 81.16 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.054 0.454 . . . . 0.0 110.817 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 129.03 56.4 0.1 Allowed Glycine 0 N--CA 1.443 -0.852 0 C-N-CA 119.997 -1.096 . . . . 0.0 112.784 178.616 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.435 ' SG ' ' N ' ' A' ' 51' ' ' GLU . 44.8 t 72.34 142.04 0.06 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.444 0.64 . . . . 0.0 112.353 178.565 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 35.9 mmtp -122.88 -40.58 2.41 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.801 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.45 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 13.5 p -72.64 -38.13 67.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.771 0.32 . . . . 0.0 110.89 -178.076 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 122.97 0.29 9.78 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.134 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -92.87 14.63 16.89 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 117.078 0.439 . . . . 0.0 111.893 -179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.435 ' N ' ' SG ' ' A' ' 46' ' ' CYS . 34.6 mt-10 60.24 36.46 20.8 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.538 -0.755 . . . . 0.0 112.627 175.018 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 3.5 p -111.13 151.55 28.01 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 120.879 0.371 . . . . 0.0 111.182 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.6 p -137.76 77.79 1.65 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.928 0.394 . . . . 0.0 110.893 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 99.37 155.48 28.6 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.246 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.417 ' HG3' ' HA ' ' A' ' 38' ' ' THR . 83.3 Cg_exo -43.34 -51.72 5.62 Favored 'Trans proline' 0 N--CA 1.478 0.612 0 C-N-CA 124.1 3.2 . . . . 0.0 114.712 -177.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -62.33 -35.8 80.21 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.012 0.434 . . . . 0.0 111.555 -177.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.3 m -99.27 19.85 14.67 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.188 -178.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 53.4 t -103.62 129.61 50.93 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-O 121.143 0.496 . . . . 0.0 110.997 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -109.8 4.31 21.61 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.471 0.653 . . . . 0.0 109.79 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.464 ' HB2' ' HZ3' ' A' ' 67' ' ' LYS . 5.0 m -82.14 156.72 24.34 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.373 -178.014 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.416 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -83.64 -178.7 51.99 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.01 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.1 p -79.63 -6.97 58.21 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.3 m -100.79 10.52 41.04 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.783 0.325 . . . . 0.0 110.937 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 30.8 t -84.64 164.86 18.39 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.944 0.402 . . . . 0.0 111.69 -177.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.6 m -64.16 -34.31 77.78 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.321 0.649 . . . . 0.0 112.185 -177.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.473 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 19.7 p -82.26 20.13 1.1 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.946 0.403 . . . . 0.0 111.033 -179.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.473 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 48.1 mmtm . . . . . 0 C--O 1.263 1.773 0 CA-C-O 117.863 -1.065 . . . . 0.0 110.47 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 14.0 mptt . . . . . 0 N--CA 1.45 -0.454 0 CA-C-O 120.654 0.264 . . . . 0.0 111.326 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.693 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 73.8 m -65.28 137.11 57.34 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.162 0.506 . . . . 0.0 111.138 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.665 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 44.5 p -78.0 175.13 10.37 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.017 -177.008 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.6 m -70.21 -25.44 63.41 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 175.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.558 ' HB1' ' HB2' ' A' ' 20' ' ' GLN . . . -69.95 -40.55 75.4 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.033 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.529 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 40.5 t -69.35 -25.13 64.04 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.339 0.59 . . . . 0.0 110.773 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.665 ' HG3' ' O ' ' A' ' 11' ' ' THR . 60.0 mtt180 -81.21 -2.66 49.59 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.016 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.1 m -104.68 156.34 18.07 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.506 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 8.8 pt-20 -128.12 129.92 23.63 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-O 120.779 0.323 . . . . 0.0 111.179 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.506 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 44.4 Cg_endo -67.61 169.3 52.94 Favored 'Cis proline' 0 C--N 1.351 0.706 0 C-N-CA 123.143 -1.607 . . . . 0.0 111.15 -0.686 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.529 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 26.3 t -59.07 133.84 56.46 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-O 121.159 0.504 . . . . 0.0 110.636 -177.659 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.558 ' HB2' ' HB1' ' A' ' 13' ' ' ALA . 27.4 mm-40 -97.01 12.1 33.73 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.858 -177.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.606 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 91.6 m -96.23 23.66 6.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.314 176.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -46.77 -52.44 11.45 Favored Glycine 0 C--N 1.338 0.667 0 O-C-N 123.438 0.461 . . . . 0.0 113.595 -177.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.1 p -120.97 -20.48 6.86 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 120.857 0.36 . . . . 0.0 110.989 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -114.88 81.35 1.55 Allowed 'General case' 0 CA--C 1.507 -0.696 0 CA-C-O 121.122 0.487 . . . . 0.0 110.585 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.598 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 53.6 t -95.57 143.95 26.44 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.31 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.406 ' HB2' HG21 ' A' ' 11' ' ' THR . 55.0 mt-30 -140.68 19.46 2.34 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.245 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.693 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 85.5 m -77.8 179.17 6.84 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.875 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -129.93 -135.2 3.83 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.318 -179.3 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.477 ' HA ' ' HA3' ' A' ' 61' ' ' GLY . 0.5 OUTLIER -89.7 -10.44 45.73 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.122 0.487 . . . . 0.0 110.639 179.461 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -94.09 36.94 3.55 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.774 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.423 ' HA ' ' SG ' ' A' ' 10' ' ' CYS . 43.0 t -112.8 135.65 53.3 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.8 t -118.89 12.59 12.92 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-O 121.012 0.434 . . . . 0.0 110.111 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.2 t -81.43 166.26 20.53 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.064 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.06 -7.74 11.29 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 120.936 0.398 . . . . 0.0 110.935 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.24 -54.79 5.41 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.411 -178.2 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.606 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 3.5 p -82.9 -15.99 49.25 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.797 -178.219 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.505 ' HE2' ' O ' ' A' ' 55' ' ' PRO . 87.8 tttt -75.0 100.5 4.18 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.073 0.464 . . . . 0.0 110.865 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 t -108.32 -178.77 3.69 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.047 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.1 t -161.48 150.35 15.98 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -108.3 -18.71 13.69 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.1 m -75.36 133.88 41.12 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.0 p -103.53 176.34 5.18 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 120.886 0.374 . . . . 0.0 111.685 -175.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.505 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.6 m -70.04 0.8 5.4 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.847 -178.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -86.96 -22.88 25.32 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.218 0.532 . . . . 0.0 110.095 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 158.59 153.59 6.84 Favored Glycine 0 N--CA 1.436 -1.354 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.006 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 54.1 t -74.05 136.95 43.09 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -107.74 -27.31 10.36 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -177.316 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.439 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 9.4 p -86.35 -31.82 21.33 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.966 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.19 2.58 33.62 Favored Glycine 0 CA--C 1.522 0.473 0 C-N-CA 120.563 -0.827 . . . . 0.0 113.599 177.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.428 ' O ' ' HE2' ' A' ' 59' ' ' LYS . 45.4 mmtm -88.64 0.25 56.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.061 0.458 . . . . 0.0 110.28 178.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 64.51 65.2 0.65 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.053 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.6 p -136.34 144.19 44.5 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.028 176.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.505 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 22.6 p -131.79 63.71 1.61 Allowed 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.205 0.526 . . . . 0.0 111.097 -179.497 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.52 159.63 10.39 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 120.831 -0.699 . . . . 0.0 111.705 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.505 ' O ' ' HE2' ' A' ' 37' ' ' LYS . 10.9 Cg_endo -54.01 -40.04 82.81 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 123.212 2.608 . . . . 0.0 113.332 -177.532 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -67.72 -37.7 82.59 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.898 0.38 . . . . 0.0 110.99 -178.694 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.2 t -91.49 3.31 55.28 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.948 -178.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 53.1 t -84.77 143.18 29.29 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.109 0.481 . . . . 0.0 110.979 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 50' ' ' LYS . 63.3 pttt -122.77 14.05 10.02 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.338 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 12.2 m -96.04 162.26 13.63 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.577 -178.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.481 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -96.1 -178.38 36.03 Favored Glycine 0 N--CA 1.427 -1.916 0 N-CA-C 109.946 -1.261 . . . . 0.0 109.946 175.164 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 14.1 m -75.86 25.05 0.12 Allowed 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 117.21 0.505 . . . . 0.0 111.421 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.41 ' H ' ' C ' ' A' ' 61' ' ' GLY . 17.4 m -125.76 19.22 7.91 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.521 -178.393 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.0 t -102.76 171.4 7.43 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 178.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.3 m -72.13 -22.0 61.39 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.764 0.316 . . . . 0.0 111.397 -178.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.472 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 15.1 p -91.12 26.96 2.0 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.178 0.513 . . . . 0.0 110.279 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.481 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 43.5 mmtm . . . . . 0 C--O 1.263 1.799 0 CA-C-O 117.888 -1.053 . . . . 0.0 111.17 -179.451 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.561 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 31.2 mmtp . . . . . 0 CA--C 1.507 -0.707 0 CA-C-O 121.0 0.428 . . . . 0.0 110.172 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.479 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 64.2 m -78.46 157.01 29.06 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.151 178.554 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.4 p -96.1 168.4 10.63 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.777 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.6 m -71.24 -16.89 62.51 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.443 0.64 . . . . 0.0 109.537 175.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.67 -38.36 47.82 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.259 178.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.524 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 50.5 t -71.85 -28.42 63.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.715 179.247 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 48.2 mtp180 -82.39 9.19 9.55 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.032 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.5 m -108.06 157.57 18.14 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -127.83 121.95 22.22 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.651 0.263 . . . . 0.0 110.996 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.35 175.31 44.19 Favored 'Cis proline' 0 C--N 1.351 0.663 0 C-N-CA 123.246 -1.564 . . . . 0.0 112.048 0.082 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 20.0 t -61.85 129.91 43.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.082 0.468 . . . . 0.0 110.526 -178.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.0 mm-40 -102.83 11.02 38.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.958 -177.253 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.524 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 87.0 m -76.72 2.97 12.77 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.523 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -56.65 103.38 0.26 Allowed Glycine 0 CA--C 1.518 0.223 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.385 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.5 t 64.33 24.0 13.17 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.481 0.657 . . . . 0.0 110.68 -179.431 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -144.9 14.55 1.52 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.514 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.501 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 46.4 t -70.11 141.26 52.76 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.07 -175.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -138.65 11.75 2.71 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.172 178.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 64.3 m -63.9 139.86 58.81 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.381 -178.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -81.67 -171.85 46.21 Favored Glycine 0 N--CA 1.44 -1.08 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.89 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.93 17.28 0.34 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.223 0.535 . . . . 0.0 112.214 -178.891 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -116.04 37.0 3.58 Favored Glycine 0 N--CA 1.439 -1.106 0 N-CA-C 111.508 -0.637 . . . . 0.0 111.508 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.7 t -123.12 156.77 34.33 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 t -131.06 7.23 4.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.331 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 16.5 t -76.81 116.02 17.11 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.07 -3.91 25.77 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.295 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -81.68 -13.48 57.82 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.643 -179.25 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.516 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 6.3 p -134.38 -31.35 1.09 Allowed 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -177.265 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -91.51 115.3 27.92 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.441 -0.503 . . . . 0.0 109.781 -177.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.57 164.93 12.06 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.381 -176.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 39.2 t -160.21 159.03 31.06 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.773 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.4 m-80 -123.81 -6.91 7.92 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 95.0 m -73.12 157.78 36.59 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.835 178.123 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 23.8 p -126.47 -177.36 3.96 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.679 -0.692 . . . . 0.0 111.728 -174.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.1 m -70.88 -1.47 11.88 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.002 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -59.04 -26.48 64.63 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.08 176.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 125.18 42.65 0.32 Allowed Glycine 0 CA--C 1.501 -0.843 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.232 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 48.3 t 69.1 138.96 0.04 OUTLIER 'General case' 0 C--N 1.341 0.207 0 C-N-CA 123.051 0.541 . . . . 0.0 110.395 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.4 mtpt -123.19 1.76 9.15 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.375 -177.266 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.538 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 2.8 p -111.65 -40.92 4.19 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.023 0.44 . . . . 0.0 110.015 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 119.96 14.63 5.52 Favored Glycine 0 CA--C 1.525 0.681 0 C-N-CA 120.811 -0.709 . . . . 0.0 113.228 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.697 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.3 mmtt -102.18 5.14 40.08 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 117.198 0.499 . . . . 0.0 110.778 178.063 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.445 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 17.7 tt0 70.93 16.82 6.45 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.387 0.675 . . . . 0.0 110.793 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.492 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 25.9 p -93.59 143.55 26.2 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 120.975 0.417 . . . . 0.0 110.514 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.3 p -124.2 31.78 5.7 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.283 0.563 . . . . 0.0 110.749 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 140.86 171.88 12.74 Favored Glycine 0 N--CA 1.441 -0.972 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 -177.193 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.55 -29.61 85.54 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.893 2.395 . . . . 0.0 112.628 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -62.57 -37.5 86.43 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.854 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 12.1 m -113.04 3.66 16.27 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -176.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.492 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 48.5 t -74.82 135.22 41.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.787 0.327 . . . . 0.0 110.629 -179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 17.1 ttpp -136.22 33.48 2.82 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.671 -177.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.697 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 2.7 m -96.32 -179.05 4.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.015 0.436 . . . . 0.0 110.05 176.657 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -99.55 -143.41 14.51 Favored Glycine 0 N--CA 1.432 -1.57 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 174.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.9 p -91.62 -28.77 17.29 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 116.923 0.361 . . . . 0.0 111.205 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.8 m -87.71 67.5 9.22 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -176.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 7.1 t -142.76 155.06 44.79 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.207 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.0 m -70.1 -24.35 63.19 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -175.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.462 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 17.5 p -86.03 7.84 22.95 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.939 0.4 . . . . 0.0 111.191 -178.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.462 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 47.3 mmtm . . . . . 0 C--O 1.262 1.741 0 CA-C-O 117.56 -1.209 . . . . 0.0 111.144 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 31.4 mmtp . . . . . 0 N--CA 1.441 -0.901 0 CA-C-O 121.066 0.46 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.621 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 66.3 m -73.43 150.95 41.32 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.041 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 46.9 p -87.11 167.28 14.32 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.744 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.9 m -63.93 -27.26 69.02 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 177.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.68 -43.08 76.89 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.458 178.222 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.494 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 44.0 t -69.83 -34.9 74.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.921 0.391 . . . . 0.0 110.301 178.163 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -70.31 -14.37 62.56 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.199 179.298 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.5 m -81.72 151.1 27.66 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.404 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 7.9 pt-20 -129.64 123.22 21.1 Favored Pre-proline 0 C--N 1.313 -1.012 0 CA-C-O 120.726 0.298 . . . . 0.0 111.508 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.404 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 55.4 Cg_endo -69.2 167.56 68.95 Favored 'Cis proline' 0 C--O 1.242 0.687 0 C-N-CA 123.314 -1.536 . . . . 0.0 111.805 -1.097 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.494 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 49.7 t -52.77 147.08 9.39 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.06 0.457 . . . . 0.0 111.947 -177.508 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -124.33 15.8 9.01 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.942 -178.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 67.5 m -69.0 -77.34 0.08 Allowed 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.751 0.31 . . . . 0.0 111.625 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 63.7 -106.9 1.52 Allowed Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.501 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.3 m -97.92 -1.18 43.44 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 120.976 0.417 . . . . 0.0 110.847 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -106.37 27.22 8.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.621 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 47.6 t -73.98 142.77 45.82 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.233 0.539 . . . . 0.0 112.224 -177.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -148.79 25.0 0.95 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.164 -0.926 . . . . 0.0 109.964 178.643 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.621 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 67.7 m -72.27 -175.33 1.52 Allowed 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.109 0.48 . . . . 0.0 111.909 -178.579 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -117.61 -172.75 16.06 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.757 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -70.86 -12.28 61.45 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 122.858 0.463 . . . . 0.0 111.576 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -96.34 20.06 51.92 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.628 -178.678 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.0 t -93.49 140.7 29.29 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.075 0.464 . . . . 0.0 110.327 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.0 t -122.3 17.9 10.64 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.129 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.457 ' SG ' ' HB3' ' A' ' 35' ' ' ALA . 45.0 t -87.67 117.61 26.61 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.78 -11.72 60.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.341 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.457 ' HB3' ' SG ' ' A' ' 33' ' ' CYS . . . -66.15 -45.37 81.23 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.019 179.514 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.463 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 6.1 p -106.34 -17.96 14.13 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.419 ' HD3' ' O ' ' A' ' 55' ' ' PRO . 21.4 ttmm -63.49 107.02 1.03 Allowed 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 178.415 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.2 t -127.08 152.62 47.04 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 120.819 0.342 . . . . 0.0 110.997 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.438 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 19.8 t -154.26 144.9 22.38 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.591 178.07 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -98.18 -26.29 14.61 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -178.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 74.7 m -67.96 144.17 55.31 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 177.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 26.8 p -123.09 -172.2 2.45 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.847 -176.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.0 m -70.4 -8.14 48.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.169 0.509 . . . . 0.0 110.575 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -67.09 -28.7 68.39 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.654 175.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.75 157.67 7.27 Favored Glycine 0 N--CA 1.439 -1.165 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.989 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.4 ' SG ' ' N ' ' A' ' 51' ' ' GLU . 42.9 t -74.26 139.13 44.09 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.341 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -127.15 -3.82 6.28 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -178.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.432 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 12.3 p -97.6 -29.67 13.3 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.49 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.44 9.01 18.24 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 120.4 -0.905 . . . . 0.0 113.584 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.732 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 47.0 mmtm -98.55 -1.08 41.93 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 117.352 0.576 . . . . 0.0 111.264 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.4 ' N ' ' SG ' ' A' ' 46' ' ' CYS . 48.5 mt-10 66.43 22.67 10.68 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.153 0.581 . . . . 0.0 111.1 -177.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 27.2 p -95.2 142.16 27.96 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.95 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.1 p -121.91 33.93 5.34 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-O 121.282 0.563 . . . . 0.0 110.593 -179.404 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 144.07 170.61 13.63 Favored Glycine 0 N--CA 1.435 -1.395 0 C-N-CA 120.762 -0.733 . . . . 0.0 111.33 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.438 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 28.6 Cg_endo -62.93 -15.69 49.18 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.834 2.356 . . . . 0.0 112.728 -178.213 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -66.78 -45.32 78.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.862 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.7 m -113.01 16.7 19.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.057 0.456 . . . . 0.0 110.769 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.438 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 38.9 t -77.82 122.44 25.44 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -124.43 18.03 8.94 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.478 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.732 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 8.3 m -68.58 147.19 52.3 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.218 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -82.29 43.15 2.98 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 120.818 -0.706 . . . . 0.0 113.231 -178.263 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.6 m 69.09 -48.89 0.59 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.957 0.903 . . . . 0.0 113.033 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.1 t -76.01 76.39 2.88 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.081 0.467 . . . . 0.0 110.18 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.9 t -140.01 170.53 15.69 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.056 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.2 t -76.3 -30.52 57.78 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.322 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.51 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 7.8 p -84.26 17.62 2.48 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 120.96 0.409 . . . . 0.0 111.323 -178.195 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.51 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 48.6 mmtm . . . . . 0 C--O 1.256 1.409 0 CA-C-O 117.735 -1.126 . . . . 0.0 110.921 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.452 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 71.2 mmtt . . . . . 0 CA--C 1.505 -0.783 0 CA-C-O 120.613 0.244 . . . . 0.0 111.621 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.2 m -97.23 159.24 15.03 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 121.298 0.57 . . . . 0.0 111.539 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.487 HG21 ' H ' ' A' ' 26' ' ' GLN . 41.9 p -93.55 -178.67 4.79 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.498 -176.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.0 m -80.44 -20.84 42.92 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.308 0.575 . . . . 0.0 109.676 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.2 -35.83 48.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.859 179.064 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.463 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 43.9 t -71.67 -13.67 61.81 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.712 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.473 ' HG2' ' O ' ' A' ' 11' ' ' THR . 12.5 mmt180 -72.24 -20.59 61.52 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.812 179.388 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.437 ' HB2' ' HG2' ' A' ' 20' ' ' GLN . 37.2 m -91.72 164.78 13.6 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -175.398 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.431 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 14.1 pt-20 -140.84 118.04 7.83 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.506 177.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.431 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 13.1 Cg_exo -66.69 171.45 39.7 Favored 'Cis proline' 0 C--N 1.352 0.732 0 C-N-CA 123.1 -1.625 . . . . 0.0 112.033 0.415 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.463 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 13.7 t -66.28 150.07 49.38 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.854 -175.529 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.437 ' HG2' ' HB2' ' A' ' 16' ' ' SER . 29.1 mm-40 -113.89 7.06 16.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.489 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.425 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 78.4 m -68.12 -75.61 0.1 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.699 0.285 . . . . 0.0 111.22 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 65.91 -109.23 2.77 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.586 -0.816 . . . . 0.0 111.418 -177.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.5 t -95.19 -17.96 21.3 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.456 0.646 . . . . 0.0 109.28 178.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -92.71 55.93 2.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.94 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 48.1 t -103.06 143.86 32.04 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.701 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.487 ' H ' HG21 ' A' ' 11' ' ' THR . 28.8 mm-40 -139.41 17.45 2.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.084 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 76.3 m -70.61 148.21 48.37 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.144 0.497 . . . . 0.0 111.928 -177.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -98.98 -160.63 29.55 Favored Glycine 0 N--CA 1.441 -1.019 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.552 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -73.28 -4.89 36.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.851 0.358 . . . . 0.0 111.781 -178.343 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -93.37 22.89 32.6 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.99 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.0 t -115.69 149.48 38.33 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.901 0.382 . . . . 0.0 110.919 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.2 t -133.62 12.58 4.08 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.138 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 37.8 t -72.51 119.96 17.45 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.222 0.534 . . . . 0.0 110.436 -178.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.11 -0.54 22.31 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.607 -178.374 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.78 -29.26 23.97 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.503 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.425 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 7.6 p -119.88 -26.12 5.69 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -83.29 107.05 15.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.987 0.422 . . . . 0.0 110.361 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.0 t -114.82 175.73 5.36 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.237 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 45.0 t -156.64 154.26 29.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.287 -178.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -114.6 -12.91 12.18 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 81.6 m -77.38 127.66 32.93 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 174.128 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 70.6 p -93.36 173.67 7.59 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.711 -172.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.537 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.7 m -66.94 -2.6 5.47 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.099 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -80.69 -36.45 32.3 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.987 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 168.09 151.58 7.14 Favored Glycine 0 N--CA 1.442 -0.945 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.669 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.7 t -78.59 138.87 38.57 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 122.48 0.312 . . . . 0.0 110.421 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -129.06 2.16 5.26 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 4.3 p -93.94 -37.68 11.57 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.006 -0.678 . . . . 0.0 109.737 177.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 124.32 -4.35 8.86 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.831 -0.699 . . . . 0.0 113.294 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.811 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 43.0 mmtm -87.62 -1.54 58.02 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 117.384 0.592 . . . . 0.0 111.527 -178.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 63.96 36.93 9.72 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.992 0.901 . . . . 0.0 109.865 -178.011 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 28.6 p -108.84 141.26 41.13 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.443 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.537 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 36.1 p -131.13 79.98 1.92 Allowed 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 177.458 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 105.72 159.9 22.83 Favored Glycine 0 N--CA 1.437 -1.263 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.468 -177.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -52.21 -31.15 44.64 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 123.437 2.758 . . . . 0.0 113.806 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -63.95 -44.44 92.82 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.988 0.423 . . . . 0.0 111.602 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.534 ' HB2' ' H ' ' A' ' 53' ' ' THR . 19.5 m -89.62 -12.66 39.06 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.691 -178.251 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 49.0 t -68.05 131.56 45.67 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.948 -177.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -118.13 14.96 14.09 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.592 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.811 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.8 m -103.34 164.41 11.66 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.278 -176.019 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -96.85 -166.3 33.11 Favored Glycine 0 N--CA 1.439 -1.121 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 177.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.6 m -85.1 25.24 0.99 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 117.106 0.453 . . . . 0.0 111.312 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.5 m -131.48 20.08 4.75 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 120.739 0.304 . . . . 0.0 111.638 -178.332 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' CYS . . . . . 0.423 ' SG ' ' N ' ' A' ' 65' ' ' SER . 46.0 t -99.68 171.26 8.01 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.79 0.329 . . . . 0.0 110.953 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.423 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 51.0 m -60.89 -34.51 74.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.556 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.448 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 31.9 p -82.89 21.84 0.99 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 120.969 0.414 . . . . 0.0 111.104 -179.321 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.448 ' HD3' ' O ' ' A' ' 66' ' ' CYS . 54.8 mmtt . . . . . 0 C--O 1.261 1.672 0 CA-C-O 117.494 -1.241 . . . . 0.0 110.061 178.164 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp . . . . . 0 C--O 1.237 0.438 0 CA-C-O 120.868 0.366 . . . . 0.0 111.465 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.6 m -72.85 160.53 32.0 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.402 0.62 . . . . 0.0 111.494 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.501 HG21 ' HB2' ' A' ' 26' ' ' GLN . 77.6 p -97.47 170.13 9.26 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.906 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.8 m -64.77 -26.22 68.26 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.11 0.481 . . . . 0.0 109.971 177.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.82 -48.21 72.47 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.597 177.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.1 t -73.56 -24.66 60.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.044 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -79.57 -1.81 39.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.011 0.434 . . . . 0.0 111.424 179.187 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.3 m -105.35 150.0 25.59 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 176.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.406 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 10.7 pt-20 -119.09 129.8 25.19 Favored Pre-proline 0 C--N 1.322 -0.594 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.926 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.406 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 4.9 Cg_exo -72.45 175.04 45.57 Favored 'Cis proline' 0 C--O 1.236 0.395 0 C-N-CA 123.231 -1.571 . . . . 0.0 111.482 -0.195 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.9 t -55.39 135.33 50.35 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.009 0.433 . . . . 0.0 111.06 -178.655 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -110.55 20.11 18.03 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.694 -177.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.441 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 81.8 m -87.7 27.45 1.13 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.859 0.362 . . . . 0.0 110.695 178.577 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.98 -42.08 99.64 Favored Glycine 0 CA--C 1.52 0.389 0 CA-C-N 116.1 -0.5 . . . . 0.0 113.224 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.3 p -128.96 15.76 6.29 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.969 0.414 . . . . 0.0 111.125 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -162.16 101.28 1.1 Allowed 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.91 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 53.7 t -120.75 121.16 37.62 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-O 120.926 0.394 . . . . 0.0 109.952 177.473 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.501 ' HB2' HG21 ' A' ' 11' ' ' THR . 82.9 mt-30 -129.63 19.22 5.68 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.104 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.542 ' O ' ' HB2' ' A' ' 62' ' ' SER . 70.8 m -64.93 134.11 53.26 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.334 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.97 -91.42 0.37 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.822 -177.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -139.25 159.53 41.94 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 84.11 26.07 42.1 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 110.761 -0.936 . . . . 0.0 110.761 -177.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.8 t -124.08 132.85 53.71 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.207 -0.497 . . . . 0.0 110.263 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.2 t -165.55 71.87 0.16 Allowed 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.492 0.663 . . . . 0.0 111.171 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.42 ' SG ' ' HB3' ' A' ' 35' ' ' ALA . 10.4 p -101.23 8.82 42.37 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 121.241 0.543 . . . . 0.0 110.318 178.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 69.4 -16.87 0.24 Allowed 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 114.797 -1.092 . . . . 0.0 113.43 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.42 ' HB3' ' SG ' ' A' ' 33' ' ' CYS . . . -76.78 -54.07 7.1 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -178.006 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.441 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 26.9 p -92.74 -25.2 18.3 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.885 0.374 . . . . 0.0 110.925 -179.499 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -49.09 113.17 0.74 Allowed 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.424 -178.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.5 t -124.68 165.12 18.48 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.448 -178.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.7 t -162.58 139.47 7.84 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -98.8 -10.05 23.55 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.725 0.297 . . . . 0.0 111.478 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 70.8 m -74.33 139.41 44.14 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 177.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 76.8 p -112.07 -174.09 2.39 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.578 -176.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.1 m -70.5 3.73 2.84 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.127 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -58.63 -36.71 74.51 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.148 0.499 . . . . 0.0 109.71 176.007 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 132.04 40.61 0.21 Allowed Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.257 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 43.2 t 71.47 148.01 0.08 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.98 0.512 . . . . 0.0 111.37 -178.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -126.59 -16.36 5.32 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.887 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.5 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 14.4 p -95.45 -36.06 11.47 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.464 -0.494 . . . . 0.0 111.503 -177.455 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.31 -3.86 20.18 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.215 -0.993 . . . . 0.0 112.908 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.482 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 76.0 mmtt -82.67 -4.5 57.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.911 0.386 . . . . 0.0 110.042 178.624 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 67.08 67.91 0.41 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.298 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.4 p -139.34 154.76 47.94 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.265 178.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.3 p -139.59 81.47 1.83 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.819 0.342 . . . . 0.0 111.18 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 98.58 160.46 29.97 Favored Glycine 0 C--N 1.315 -0.637 0 C-N-CA 120.548 -0.834 . . . . 0.0 112.03 178.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -56.98 -36.79 99.41 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.047 2.498 . . . . 0.0 112.655 -178.445 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -75.45 -11.5 60.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.198 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.6 m -129.05 25.93 5.52 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.121 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.461 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 47.1 t -103.34 150.91 23.33 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.423 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -121.15 -9.22 9.18 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-O 121.886 0.85 . . . . 0.0 108.726 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.9 m -86.32 144.17 27.51 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 114.645 -1.161 . . . . 0.0 111.511 -174.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -80.97 176.86 54.57 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.542 ' HB2' ' O ' ' A' ' 27' ' ' CYS . 18.2 m -66.4 -7.14 17.3 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 117.016 0.408 . . . . 0.0 111.778 -178.262 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.3 m -100.56 35.98 2.01 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.333 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 22.7 t -112.53 174.27 5.97 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 120.761 0.315 . . . . 0.0 111.081 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.0 m -71.43 -25.19 62.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.69 -178.389 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.5 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 32.1 p -87.02 16.91 4.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.822 0.344 . . . . 0.0 111.043 -179.186 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.461 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 53.8 mmtt . . . . . 0 C--O 1.257 1.452 0 CA-C-O 117.525 -1.226 . . . . 0.0 110.763 -179.214 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.4 mttp . . . . . 0 CA--C 1.498 -1.054 0 CA-C-O 121.52 0.676 . . . . 0.0 110.642 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.3 m -117.6 156.32 28.33 Favored 'General case' 0 C--N 1.273 -2.751 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.198 177.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.607 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 82.2 p -83.46 175.1 10.06 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.054 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.2 m -76.91 -16.39 59.4 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 176.104 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.58 -42.91 40.87 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.558 178.195 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 50.0 t -69.37 -27.72 65.57 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.186 0.517 . . . . 0.0 110.223 178.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.607 ' HG3' ' O ' ' A' ' 11' ' ' THR . 37.6 mtt180 -85.46 1.86 47.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.392 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.7 t -94.33 161.68 14.14 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.416 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 8.0 pt-20 -122.28 115.94 29.9 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-O 120.537 0.208 . . . . 0.0 110.646 179.13 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 3.8 Cg_exo -79.14 -178.09 22.74 Favored 'Cis proline' 0 C--N 1.351 0.664 0 C-N-CA 124.068 -1.222 . . . . 0.0 111.717 -0.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.7 t -58.81 123.43 16.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.017 0.436 . . . . 0.0 110.001 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -101.07 18.76 18.93 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.655 -176.169 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.422 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 72.7 m -83.33 9.4 11.0 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -178.619 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.83 -36.95 93.96 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.507 -0.854 . . . . 0.0 111.224 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.7 m -97.85 -32.84 11.49 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 120.592 0.234 . . . . 0.0 111.324 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 9.5 ptpp? -139.04 103.75 4.86 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.14 0.495 . . . . 0.0 111.673 -178.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 44.5 t -112.39 114.88 27.83 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-O 121.2 0.524 . . . . 0.0 109.801 176.459 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.417 ' H ' HG21 ' A' ' 11' ' ' THR . 97.5 mt-30 -127.39 22.97 6.44 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.461 -177.634 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 98.2 m -61.31 157.62 16.14 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.666 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.33 -101.92 1.29 Allowed Glycine 0 N--CA 1.437 -1.269 0 C-N-CA 120.587 -0.816 . . . . 0.0 115.115 -174.543 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.576 ' HG3' ' H ' ' A' ' 30' ' ' GLY . 5.4 pt-20 -105.71 -84.34 0.5 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -172.212 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.576 ' H ' ' HG3' ' A' ' 29' ' ' GLU . . . -83.99 66.76 3.84 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 121.003 -0.617 . . . . 0.0 113.909 -175.127 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.1 t -74.43 139.49 44.02 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 176.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.7 t -112.39 14.75 20.4 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 121.298 0.57 . . . . 0.0 110.93 -176.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 43.7 t -96.16 148.83 22.3 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.697 178.302 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.9 5.94 26.84 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.869 0.366 . . . . 0.0 110.815 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -84.86 -44.91 12.79 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.035 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.422 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 6.0 p -101.47 -5.02 25.79 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.867 -178.247 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -81.85 115.63 21.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.868 0.366 . . . . 0.0 110.32 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 t -126.46 171.67 10.84 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.836 -179.439 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.402 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 48.0 t -155.95 148.5 23.85 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -179.443 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -109.65 -12.47 14.65 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -178.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 73.9 m -79.17 133.99 36.71 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.018 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.8 p -100.34 176.31 5.41 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-O 120.838 0.351 . . . . 0.0 111.514 -175.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.585 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 50.2 m -74.33 6.56 3.52 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.259 0.552 . . . . 0.0 110.899 178.694 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -85.84 -30.02 23.28 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.519 176.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 161.2 151.5 6.27 Favored Glycine 0 N--CA 1.437 -1.285 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.74 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.3 t -72.38 143.38 48.6 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -121.63 -25.72 5.05 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.471 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 8.1 p -77.97 -34.68 50.85 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.923 -177.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.76 -0.49 27.43 Favored Glycine 0 CA--C 1.523 0.565 0 C-N-CA 120.535 -0.84 . . . . 0.0 113.023 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -90.2 0.08 57.36 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.917 0.358 . . . . 0.0 110.729 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 64.38 62.72 0.8 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.966 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.9 p -134.43 154.97 51.11 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.412 176.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.585 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 19.3 p -137.7 51.13 1.92 Allowed 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.396 0.617 . . . . 0.0 110.78 -178.441 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 128.12 164.9 11.7 Favored Glycine 0 N--CA 1.439 -1.114 0 C-N-CA 120.838 -0.696 . . . . 0.0 111.363 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.402 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 16.8 Cg_endo -57.77 -20.85 45.17 Favored 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 122.968 2.445 . . . . 0.0 113.632 -178.022 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -74.42 -41.85 60.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.902 0.382 . . . . 0.0 111.168 -179.515 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.7 p -98.29 1.08 46.79 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.173 0.511 . . . . 0.0 111.104 -178.657 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 43.4 t -86.03 129.9 34.7 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.943 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -117.96 7.18 12.25 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.799 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 5.6 m -75.14 154.7 37.62 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.813 -178.01 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -84.07 -156.05 22.88 Favored Glycine 0 N--CA 1.441 -1.0 0 C-N-CA 120.81 -0.709 . . . . 0.0 111.838 178.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 p -86.89 -8.81 56.92 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 120.745 0.307 . . . . 0.0 111.704 -178.321 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.7 m -115.37 60.34 0.7 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.133 0.492 . . . . 0.0 111.533 -177.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' CYS . . . . . 0.443 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 39.6 t -126.19 167.65 15.14 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.815 177.497 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 31.8 t -61.76 -32.77 73.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.388 -178.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.471 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 27.3 p -88.56 22.27 2.64 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 120.799 0.333 . . . . 0.0 111.404 -178.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.443 ' HG2' ' HB3' ' A' ' 64' ' ' CYS . 52.4 mmtt . . . . . 0 C--O 1.257 1.493 0 CA-C-O 117.458 -1.258 . . . . 0.0 110.778 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.486 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 5.9 tmtt? . . . . . 0 CA--C 1.511 -0.541 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.485 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 62.8 m -65.39 147.31 53.65 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.676 178.364 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.594 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 68.4 p -88.86 171.07 10.19 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.851 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.0 m -67.21 -26.87 66.82 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.393 0.616 . . . . 0.0 109.604 176.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.421 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . . . -69.82 -40.2 76.05 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.352 -179.605 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 50.4 t -74.36 -20.63 60.02 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.361 0.601 . . . . 0.0 110.518 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.594 ' HG3' ' O ' ' A' ' 11' ' ' THR . 62.4 mtt180 -84.29 0.92 47.21 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.206 0.526 . . . . 0.0 109.948 178.579 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.2 m -102.78 159.06 15.81 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.493 178.454 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -128.8 124.38 22.51 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-O 120.7 0.286 . . . . 0.0 111.317 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.22 -178.65 21.11 Favored 'Cis proline' 0 C--N 1.351 0.679 0 C-N-CA 123.283 -1.549 . . . . 0.0 111.618 -1.04 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.9 t -61.72 135.31 57.56 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 120.887 0.375 . . . . 0.0 110.697 -178.338 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.3 mm-40 -112.08 16.96 19.99 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.802 -177.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.439 ' HB3' ' HB2' ' A' ' 25' ' ' CYS . 93.2 m -86.51 26.08 1.13 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -177.542 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.46 -42.99 99.23 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 120.527 -0.844 . . . . 0.0 111.602 178.264 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.5 p -139.39 20.04 2.57 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.308 0.575 . . . . 0.0 110.321 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 57.3 mttm -131.67 31.13 4.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.815 -177.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.439 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 18.1 t -91.82 145.63 24.41 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -174.354 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -156.81 16.72 0.3 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.192 178.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.486 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 99.6 m -64.99 164.15 13.28 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -176.322 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -146.3 -145.0 4.16 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 114.965 -1.016 . . . . 0.0 111.346 -179.239 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -68.02 154.14 42.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.12 0.46 . . . . 0.0 110.324 177.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.55 -33.8 5.6 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -174.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 24.0 t -74.24 147.78 42.13 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 t -145.12 27.19 1.29 Allowed 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.5 0.667 . . . . 0.0 109.762 -178.788 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 47.6 t -94.86 119.47 33.48 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.26 -176.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.24 -7.72 48.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.709 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.18 -27.46 60.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.663 -0.244 . . . . 0.0 111.456 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 10.1 p -134.64 11.47 3.72 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 112.33 0.492 . . . . 0.0 112.33 -177.392 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.0 mmtp -91.09 138.71 31.39 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.83 133.32 37.7 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.97 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 27.3 t -150.88 145.51 25.7 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.198 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -101.63 -19.75 15.31 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 121.018 -0.273 . . . . 0.0 111.732 179.277 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 74.0 m -74.39 133.3 42.48 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.8 p -109.89 -173.77 2.33 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.048 -175.747 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.4 m -69.66 -14.69 62.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.438 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.68 -40.06 95.9 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.916 177.008 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 164.07 155.2 8.17 Favored Glycine 0 N--CA 1.43 -1.759 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.42 179.477 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 47.0 t -77.49 130.43 36.98 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 178.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -105.68 -26.52 11.78 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.552 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 8.3 p -78.89 -40.99 30.8 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.744 -177.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.91 12.82 10.79 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.045 178.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.476 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 74.8 mmtt -95.67 3.75 53.66 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.989 0.394 . . . . 0.0 110.549 178.321 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 34.0 tt0 66.12 29.64 9.78 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.929 178.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.5 p -102.19 150.99 22.73 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.564 178.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.8 p -141.11 66.05 1.38 Allowed 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.425 0.631 . . . . 0.0 110.255 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 121.24 154.52 9.27 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.563 179.376 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -53.65 -31.66 61.21 Favored 'Trans proline' 0 N--CA 1.48 0.728 0 C-N-CA 124.146 3.231 . . . . 0.0 115.039 -176.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -69.13 -41.89 76.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.866 0.365 . . . . 0.0 111.191 -178.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.6 m -96.69 0.02 49.03 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.804 -177.341 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.462 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 14.9 t -92.24 126.15 37.2 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.082 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -119.41 14.23 12.82 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.557 177.513 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 20.7 m -69.61 150.23 47.28 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.36 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -69.59 164.88 50.68 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.389 -179.313 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.8 p -72.93 -3.3 25.0 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.202 0.525 . . . . 0.0 111.606 -178.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.2 t -111.94 13.01 20.81 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.294 0.568 . . . . 0.0 109.78 178.575 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 65' ' ' SER . 47.1 t -73.85 169.72 16.81 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.828 -177.881 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.401 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 8.6 m -63.89 -34.49 78.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.789 -178.092 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.552 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 21.6 p -87.43 25.11 1.48 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.713 0.292 . . . . 0.0 111.324 -178.471 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.462 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 61.1 mmtt . . . . . 0 C--O 1.271 2.195 0 CA-C-O 118.087 -0.959 . . . . 0.0 110.866 179.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp . . . . . 0 CA--C 1.51 -0.573 0 CA-C-O 121.334 0.588 . . . . 0.0 109.748 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.507 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 35.7 m -73.75 166.07 23.97 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.466 -176.36 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.55 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 72.5 p -90.61 173.32 8.11 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.231 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.1 m -71.81 -20.44 61.84 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 120.956 0.408 . . . . 0.0 109.997 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.89 -38.67 37.01 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.829 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.7 t -67.07 -20.72 65.87 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.225 0.536 . . . . 0.0 110.04 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.55 ' HG2' ' O ' ' A' ' 11' ' ' THR . 27.9 mmt180 -67.36 -25.94 66.22 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.048 177.849 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.2 m -85.75 147.08 26.5 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.035 -179.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.542 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 10.2 pt-20 -132.15 126.91 20.75 Favored Pre-proline 0 C--N 1.32 -0.699 0 CA-C-O 120.678 0.275 . . . . 0.0 111.052 -179.619 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 30.6 Cg_endo -63.25 160.53 60.41 Favored 'Cis proline' 0 C--O 1.241 0.662 0 C-N-CA 123.27 -1.554 . . . . 0.0 112.302 -0.694 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 32.3 t -52.96 149.15 6.78 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.888 0.743 . . . . 0.0 112.167 -176.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -122.7 14.18 10.09 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -176.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 63.8 m -61.31 -67.97 0.36 Allowed 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.027 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 60.04 -96.34 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 121.084 -0.579 . . . . 0.0 112.31 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.3 t -91.35 -29.24 17.22 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.747 0.308 . . . . 0.0 110.698 179.193 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -103.18 73.86 1.25 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -177.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 42.4 t -103.02 136.42 42.88 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 174.378 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.432 ' HB2' HG22 ' A' ' 11' ' ' THR . 53.1 mt-30 -142.93 22.49 1.93 Allowed 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.507 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 91.3 m -69.48 143.52 53.48 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.605 -178.538 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.98 -171.27 47.16 Favored Glycine 0 N--CA 1.433 -1.557 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 176.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -63.75 -21.79 66.58 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.092 0.473 . . . . 0.0 110.633 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.68 63.27 4.48 Favored Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.301 178.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 50.4 t -133.02 128.64 36.77 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 178.498 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.8 t -106.35 9.27 31.91 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.082 0.468 . . . . 0.0 110.61 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 36.9 t -91.64 129.17 37.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.129 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -96.91 7.06 47.46 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.961 0.41 . . . . 0.0 111.132 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -82.46 -37.62 25.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.135 0.493 . . . . 0.0 111.006 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 9.9 p -103.04 -41.43 6.11 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.989 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.5 ttpt -69.38 103.16 1.93 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.161 0.505 . . . . 0.0 110.535 -179.045 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.8 t -106.15 169.01 8.75 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.375 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.9 t -149.91 145.0 26.26 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -178.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -99.43 -24.16 14.88 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -179.34 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.2 m -66.41 140.21 58.04 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.295 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 75.0 p -113.66 177.64 4.56 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.88 0.371 . . . . 0.0 111.507 -175.112 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.528 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 17.6 m -70.32 -9.66 56.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.869 179.326 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -69.44 -40.71 77.03 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 176.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 170.28 149.27 6.3 Favored Glycine 0 N--CA 1.44 -1.073 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.885 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.1 t -69.95 146.64 51.01 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 178.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -115.34 -38.71 3.74 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.66 -177.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.544 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 11.7 p -75.37 -35.47 61.1 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.359 -176.472 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.8 -0.15 30.41 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.601 -0.809 . . . . 0.0 113.014 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.435 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.1 mmtt -82.8 0.23 44.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.863 0.363 . . . . 0.0 110.393 179.518 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 67.34 50.32 0.97 Allowed 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.705 178.195 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 17.7 p -124.74 152.85 43.27 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.238 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.528 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 23.7 p -134.03 38.34 3.18 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-O 121.199 0.523 . . . . 0.0 110.966 -178.655 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 142.78 161.95 9.04 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -177.638 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -50.04 -42.92 44.31 Favored 'Trans proline' 0 N--CA 1.481 0.739 0 C-N-CA 123.411 2.741 . . . . 0.0 113.918 -177.349 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -65.4 -38.29 89.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.911 0.386 . . . . 0.0 111.5 -178.416 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.6 t -92.64 8.95 36.85 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.96 0.409 . . . . 0.0 110.126 -179.347 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 50.3 t -100.4 136.19 40.66 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.764 -178.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -126.43 16.71 7.66 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.653 0.74 . . . . 0.0 109.376 178.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.435 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 11.8 m -83.26 149.54 26.72 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.072 -178.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -83.12 -155.69 19.64 Favored Glycine 0 N--CA 1.443 -0.882 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 176.13 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 28.6 m -78.64 -33.5 47.19 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 120.849 0.357 . . . . 0.0 111.139 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.1 m -83.75 67.85 9.67 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.991 -177.423 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 11.2 t -142.45 161.99 36.62 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-O 120.933 0.397 . . . . 0.0 111.028 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.9 m -68.17 -33.25 74.11 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.998 -177.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.544 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 16.0 p -84.18 11.42 8.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.696 0.284 . . . . 0.0 111.443 -177.318 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm . . . . . 0 C--O 1.259 1.587 0 CA-C-O 117.246 -1.359 . . . . 0.0 111.341 -179.296 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt . . . . . 0 N--CA 1.449 -0.516 0 CA-C-O 120.886 0.374 . . . . 0.0 110.347 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.406 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 86.7 m -70.68 165.88 21.98 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.427 178.784 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.569 HG21 ' H ' ' A' ' 26' ' ' GLN . 55.2 p -100.96 174.32 6.07 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.372 -179.57 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.1 m -74.87 -20.2 59.84 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 176.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.49 ' HB1' ' C ' ' A' ' 20' ' ' GLN . . . -74.72 -33.04 62.31 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.374 178.262 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.519 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 42.7 t -74.38 -12.38 60.5 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.596 0.712 . . . . 0.0 109.325 177.514 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.0 mmt180 -86.15 -1.0 57.02 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.953 176.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.3 m -96.54 154.4 17.3 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 120.847 0.356 . . . . 0.0 111.1 -178.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -136.26 112.46 10.21 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.755 178.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -66.82 165.28 66.54 Favored 'Cis proline' 0 C--N 1.356 0.927 0 C-N-CA 123.607 -1.414 . . . . 0.0 112.417 -0.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.519 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 5.1 t -57.81 151.84 16.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.494 -176.543 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.49 ' C ' ' HB1' ' A' ' 13' ' ' ALA . 27.8 mm-40 -129.52 17.51 5.88 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -174.911 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.0 m -66.74 -76.6 0.08 Allowed 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 57.47 -114.36 5.46 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 121.036 -0.602 . . . . 0.0 112.66 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.4 p -76.53 -17.99 58.95 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.84 0.352 . . . . 0.0 111.351 -178.646 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -101.13 20.87 14.84 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.348 -177.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.0 t -72.93 119.24 16.89 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 121.442 0.639 . . . . 0.0 111.122 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.569 ' H ' HG21 ' A' ' 11' ' ' THR . 76.4 mt-30 -121.42 6.75 10.1 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.833 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.406 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 93.8 m -55.87 117.52 3.76 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.368 -178.185 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -87.76 -170.52 46.27 Favored Glycine 0 N--CA 1.44 -1.088 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.009 -179.39 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -63.84 115.01 4.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.411 0.624 . . . . 0.0 110.349 179.007 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 143.16 -14.1 2.33 Favored Glycine 0 N--CA 1.442 -0.937 0 N-CA-C 110.934 -0.866 . . . . 0.0 110.934 -177.001 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.3 t -75.27 151.39 38.37 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 177.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.6 t -136.72 15.7 3.12 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 121.537 0.685 . . . . 0.0 109.921 -178.647 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.5 t -93.28 122.97 36.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.269 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -84.67 5.98 25.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -177.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.99 -34.62 32.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.141 0.496 . . . . 0.0 110.781 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 2.6 p -108.72 -33.2 7.06 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.197 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -63.2 110.5 1.88 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.656 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.3 t -111.29 170.0 8.41 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.518 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 41.7 t -157.06 149.23 22.92 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -116.5 -7.67 11.63 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.544 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 72.4 m -81.64 132.15 35.29 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 32.7 p -112.98 177.84 4.49 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-O 120.622 0.248 . . . . 0.0 111.596 -174.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.4 p -60.09 -16.99 36.53 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.386 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -57.59 -37.77 73.77 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 176.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 154.85 152.66 6.21 Favored Glycine 0 N--CA 1.43 -1.766 0 N-CA-C 110.534 -1.027 . . . . 0.0 110.534 -179.256 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 43.3 t -67.87 144.89 55.08 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -117.35 -21.48 8.68 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.572 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 12.2 p -89.76 -32.42 16.97 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.13 -177.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.8 -5.31 14.17 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.469 -0.872 . . . . 0.0 113.252 178.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.681 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 67.2 mmtt -79.99 -5.23 55.34 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.932 0.366 . . . . 0.0 111.05 -179.663 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 68.6 23.89 7.08 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.775 -178.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 25.5 p -93.18 151.29 19.92 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.266 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.3 p -139.46 81.85 1.85 Allowed 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.078 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.23 153.48 15.28 Favored Glycine 0 C--O 1.223 -0.539 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.03 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -53.43 -40.75 77.33 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 123.324 2.683 . . . . 0.0 113.755 -177.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -73.24 -23.13 60.31 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.017 0.437 . . . . 0.0 111.501 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.1 t -105.0 12.11 32.66 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.222 0.534 . . . . 0.0 109.974 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.424 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 37.1 t -101.63 150.72 22.81 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.713 -177.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -110.43 -27.54 8.97 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.166 0.508 . . . . 0.0 109.818 176.271 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.681 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.0 OUTLIER -63.4 126.7 28.34 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.746 -178.504 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -86.95 -60.61 1.66 Allowed Glycine 0 N--CA 1.442 -0.943 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.917 -179.299 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.7 t -157.12 171.35 20.6 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.149 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.8 m 64.85 23.77 12.69 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.446 0.698 . . . . 0.0 111.969 178.68 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' CYS . . . . . 0.433 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 46.3 t -106.58 169.76 8.34 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 120.884 -0.327 . . . . 0.0 110.798 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.402 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 36.2 m -71.36 -22.14 61.94 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.075 -178.226 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.572 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 18.4 p -93.68 18.29 10.41 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.867 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.433 ' HG2' ' HB3' ' A' ' 64' ' ' CYS . 63.2 mmtt . . . . . 0 C--O 1.261 1.708 0 CA-C-O 117.478 -1.249 . . . . 0.0 110.051 179.281 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.573 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 88.4 mttt . . . . . 0 N--CA 1.444 -0.726 0 CA-C-O 120.674 0.273 . . . . 0.0 111.327 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.564 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 89.8 m -77.65 153.81 32.78 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 176.242 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.447 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 46.9 p -91.72 168.06 11.74 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.799 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.0 m -67.91 -20.8 65.13 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.189 0.518 . . . . 0.0 109.768 177.25 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.49 -38.55 59.46 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.735 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.483 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 52.9 t -70.82 -22.46 62.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.371 0.605 . . . . 0.0 110.016 178.525 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.447 ' HG3' ' O ' ' A' ' 11' ' ' THR . 40.2 mtp180 -89.74 20.29 4.17 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.983 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.5 m -113.47 171.56 7.49 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.564 178.034 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.423 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 13.4 pt-20 -129.83 112.89 17.54 Favored Pre-proline 0 CA--C 1.54 0.56 0 CA-C-O 120.675 0.274 . . . . 0.0 110.958 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.423 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 6.1 Cg_exo -79.27 -172.8 11.72 Favored 'Cis proline' 0 C--N 1.348 0.535 0 C-N-CA 123.89 -1.296 . . . . 0.0 111.598 -0.211 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.7 t -61.15 137.36 58.24 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.763 0.316 . . . . 0.0 110.158 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -121.35 26.78 8.69 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.429 -175.748 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.483 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 77.6 m -88.34 17.71 5.02 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.746 0.308 . . . . 0.0 111.622 -178.589 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.38 107.1 1.33 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 121.296 -0.478 . . . . 0.0 113.145 -178.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.6 m 64.36 18.54 11.37 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.083 0.553 . . . . 0.0 111.768 178.323 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -146.01 29.51 1.09 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.822 0.82 . . . . 0.0 108.811 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 34.1 t -84.98 149.5 25.56 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.362 -175.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.1 mm-40 -146.41 14.84 1.27 Allowed 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.339 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.573 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 60.0 m -66.44 136.37 55.62 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 121.247 0.546 . . . . 0.0 112.153 -178.367 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -106.21 -151.44 19.13 Favored Glycine 0 N--CA 1.44 -1.083 0 CA-C-N 115.195 -0.911 . . . . 0.0 112.1 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.481 ' HG2' ' HD2' ' A' ' 9' ' ' LYS . 13.6 pt-20 -65.05 155.12 35.77 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.952 0.406 . . . . 0.0 110.314 178.846 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.76 -35.46 4.83 Favored Glycine 0 N--CA 1.444 -0.811 0 N-CA-C 110.779 -0.929 . . . . 0.0 110.779 -177.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.8 t -80.96 128.93 34.24 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 121.059 0.457 . . . . 0.0 110.301 178.156 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.45 ' HA ' ' NZ ' ' A' ' 37' ' ' LYS . 6.4 t -123.56 18.45 9.62 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 121.407 0.622 . . . . 0.0 110.101 177.583 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 52.7 t -63.85 123.95 20.26 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.568 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.19 -10.46 59.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.991 -177.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.2 -41.47 61.36 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -178.177 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.6 p -111.37 -13.48 13.9 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -177.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.45 ' NZ ' ' HA ' ' A' ' 32' ' ' THR . 39.5 ttmt -77.89 108.43 11.13 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.576 177.301 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.9 t -124.91 162.45 24.39 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.78 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.5 t -143.11 156.71 44.86 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 120.678 0.275 . . . . 0.0 110.677 -178.484 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -107.59 -21.04 13.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.79 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 77.0 m -78.91 136.73 37.36 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 175.619 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.5 p -119.46 -177.12 3.29 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 -175.064 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.7 p -62.4 -12.48 21.84 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.76 -178.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -67.18 -29.46 69.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.206 0.527 . . . . 0.0 109.892 176.039 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 148.74 157.6 7.64 Favored Glycine 0 N--CA 1.44 -1.087 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.861 179.116 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 53.3 t -72.73 134.91 45.22 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -121.33 -3.17 9.46 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.599 -177.692 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 1.2 p -99.02 -37.74 9.24 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.146 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.82 19.12 5.38 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.696 -0.764 . . . . 0.0 113.037 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -113.61 8.25 17.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 117.035 0.418 . . . . 0.0 111.124 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 64.61 17.42 10.89 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.689 178.154 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 17.3 p -89.89 153.35 20.7 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.283 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.9 p -139.17 40.3 2.1 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.95 0.405 . . . . 0.0 110.724 -179.598 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.42 163.88 10.02 Favored Glycine 0 N--CA 1.439 -1.155 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.409 -178.497 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.3 -28.94 86.36 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.108 2.539 . . . . 0.0 113.918 -176.55 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -74.3 -36.78 63.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.858 0.361 . . . . 0.0 111.019 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.2 p -93.96 -10.6 33.16 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.091 0.472 . . . . 0.0 111.03 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 45.6 t -69.63 133.48 47.63 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.664 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 59' ' ' LYS . 37.5 ttmt -112.71 -7.2 13.83 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.843 -179.751 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.551 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 9.0 m -64.33 124.79 22.64 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.315 -177.288 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.25 50.07 3.57 Favored Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.486 -179.135 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 57.6 m 66.34 -177.31 0.19 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.102 0.561 . . . . 0.0 111.127 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.3 m 66.19 6.85 4.43 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.36 0.6 . . . . 0.0 111.048 -178.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.7 t -100.09 167.5 10.43 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.064 -179.402 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.2 p -65.97 -30.18 70.69 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -176.387 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 22.0 p -94.36 -4.49 48.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.77 0.319 . . . . 0.0 111.454 -177.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.551 ' HE3' ' O ' ' A' ' 60' ' ' CYS . 1.8 mmmp? . . . . . 0 C--O 1.27 2.162 0 CA-C-O 118.016 -0.992 . . . . 0.0 111.342 -178.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 12.1 mptt . . . . . 0 CA--C 1.504 -0.8 0 CA-C-O 121.104 0.478 . . . . 0.0 110.314 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.1 m -83.49 168.73 16.2 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 121.841 0.829 . . . . 0.0 112.034 -177.165 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.458 HG21 ' H ' ' A' ' 26' ' ' GLN . 59.9 p -100.19 168.68 9.65 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-N 114.381 -1.282 . . . . 0.0 109.309 178.033 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.0 m -67.62 -17.55 64.65 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.349 0.595 . . . . 0.0 109.764 177.037 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.489 ' HB1' ' C ' ' A' ' 20' ' ' GLN . . . -79.57 -39.48 31.66 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.718 -178.53 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 50.2 t -69.99 -25.48 63.63 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.183 0.516 . . . . 0.0 110.475 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 -83.43 8.64 13.22 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.828 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.8 t -115.46 148.53 39.32 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 177.558 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.524 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 16.3 pt-20 -124.82 130.12 24.35 Favored Pre-proline 0 C--N 1.323 -0.551 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.984 179.044 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.524 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 15.2 Cg_exo -66.97 166.94 59.94 Favored 'Cis proline' 0 C--N 1.35 0.627 0 C-N-CA 123.095 -1.627 . . . . 0.0 111.92 -0.029 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.2 t -56.35 123.18 13.77 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.186 -178.625 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.489 ' C ' ' HB1' ' A' ' 13' ' ' ALA . 84.2 mm-40 -100.86 19.69 16.76 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.953 -175.434 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.404 ' HB3' ' HB2' ' A' ' 25' ' ' CYS . 56.3 m -85.35 8.15 19.82 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.445 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.68 -23.93 69.29 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.289 -0.957 . . . . 0.0 110.821 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.2 p -99.05 -56.33 2.46 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.218 -0.491 . . . . 0.0 110.228 178.032 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -121.99 113.85 20.14 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.966 -178.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.404 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 17.3 t -130.97 129.65 42.39 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-O 121.001 0.429 . . . . 0.0 110.235 176.779 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.458 ' H ' HG21 ' A' ' 11' ' ' THR . 8.4 tt0 -143.11 14.69 1.87 Allowed 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.308 -178.556 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 72.6 m -59.61 131.44 50.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.657 -177.04 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.25 -156.15 32.48 Favored Glycine 0 N--CA 1.441 -0.985 0 CA-C-N 115.077 -0.965 . . . . 0.0 113.952 -176.199 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -67.42 148.27 51.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.249 -0.476 . . . . 0.0 111.016 -179.012 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.9 -26.47 24.34 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.426 -178.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 48.6 t -77.36 116.76 18.22 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-O 121.089 0.471 . . . . 0.0 109.845 179.19 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.8 t -115.35 17.6 16.44 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.017 -179.464 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 47.1 t -62.08 110.07 1.48 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.467 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.51 -13.4 13.66 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -176.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.19 -53.19 15.31 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.445 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.9 p -102.75 -9.45 19.99 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.691 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -72.14 103.89 3.45 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.444 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 12.7 t -120.24 166.98 12.75 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.194 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.459 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 40.6 t -159.55 143.54 14.8 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.155 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -102.22 -15.7 16.55 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -179.304 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 76.5 m -77.93 136.37 38.0 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 175.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.1 p -115.08 -178.76 3.45 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -175.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.4 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 5.9 p -61.05 -15.15 29.13 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.101 -179.602 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -66.74 -33.67 76.15 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.209 0.528 . . . . 0.0 109.959 177.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 154.33 160.14 9.64 Favored Glycine 0 N--CA 1.435 -1.393 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.123 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.3 t -76.71 151.09 36.22 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.054 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -135.45 7.77 3.34 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 179.294 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.8 p -116.31 -19.61 10.1 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.855 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.25 14.91 29.36 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.683 -0.77 . . . . 0.0 113.494 178.496 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.622 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 42.1 mmtm -103.65 4.44 35.52 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 117.046 0.423 . . . . 0.0 111.25 179.212 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 62.26 21.49 12.52 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.244 178.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.4 p -95.35 146.7 24.19 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.376 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.4 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 47.4 p -133.05 38.91 3.33 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.244 0.545 . . . . 0.0 110.171 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.95 162.5 9.44 Favored Glycine 0 N--CA 1.436 -1.332 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -177.797 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.459 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 13.8 Cg_endo -56.66 -28.58 75.96 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.937 2.425 . . . . 0.0 112.713 -178.122 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -68.23 -35.61 78.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.724 -178.765 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.3 p -105.27 8.44 33.87 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.228 0.537 . . . . 0.0 110.841 -179.111 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 42.6 t -92.32 123.36 35.59 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.131 -176.637 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -90.42 -22.63 21.34 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.996 177.266 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.622 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.9 m -62.37 146.63 50.77 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.217 -177.598 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -105.49 -86.66 1.93 Allowed Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 110.954 -0.859 . . . . 0.0 110.954 177.595 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.1 m -130.16 171.75 12.52 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 178.282 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 37.8 m 64.61 33.81 10.4 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 177.706 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 35.3 t -119.73 160.38 22.66 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.68 0.276 . . . . 0.0 110.266 177.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.3 m -65.8 -23.03 66.61 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -178.404 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.508 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 8.9 p -95.01 13.42 25.12 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.293 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.508 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 47.2 mmtm . . . . . 0 C--O 1.259 1.56 0 CA-C-O 117.112 -1.423 . . . . 0.0 110.912 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 67.8 mttm . . . . . 0 CA--C 1.505 -0.767 0 CA-C-O 120.995 0.426 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 85.9 m -89.15 177.12 6.71 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-O 121.348 0.594 . . . . 0.0 111.663 -177.17 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.519 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 40.7 p -108.68 171.77 7.23 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.072 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.1 m -70.79 -26.9 63.53 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.47 -38.55 81.14 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.387 178.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 52.7 t -72.11 -34.6 68.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.244 178.417 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 11' ' ' THR . 70.3 mtp180 -65.87 -29.04 69.42 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.275 178.42 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 49.1 m -67.77 152.25 45.89 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.142 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -126.26 120.04 23.57 Favored Pre-proline 0 C--N 1.318 -0.77 0 CA-C-O 120.763 0.316 . . . . 0.0 111.048 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -73.77 174.6 50.13 Favored 'Cis proline' 0 C--O 1.237 0.442 0 C-N-CA 123.426 -1.489 . . . . 0.0 112.141 0.27 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.0 t -55.5 136.22 50.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.092 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -111.98 17.6 19.54 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.289 0.566 . . . . 0.0 110.703 -178.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.459 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 93.3 m -81.85 29.54 0.39 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.333 -179.041 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.52 -45.72 95.29 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 176.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.2 m -131.58 4.29 4.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.048 0.451 . . . . 0.0 110.098 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -118.61 31.14 6.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.24 -177.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.557 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 16.7 t -82.97 127.28 33.39 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.13 -0.628 . . . . 0.0 111.18 -178.673 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.456 ' H ' HG21 ' A' ' 11' ' ' THR . 84.4 mt-30 -142.77 18.83 1.99 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.181 -0.918 . . . . 0.0 108.904 -178.68 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 86.5 m -67.33 145.66 54.88 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.415 -176.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -96.62 -154.59 30.26 Favored Glycine 0 N--CA 1.438 -1.187 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.312 177.162 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -78.38 14.46 1.22 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.053 0.454 . . . . 0.0 111.263 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -110.21 34.62 5.31 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 121.102 -0.571 . . . . 0.0 111.865 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.5 t -130.92 148.68 52.71 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.045 0.45 . . . . 0.0 110.346 179.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.9 t -136.53 16.8 3.13 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.35 178.311 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.6 t -80.63 124.47 29.02 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.362 -178.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -81.18 9.11 7.34 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.439 -178.467 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -93.14 -13.08 28.91 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.976 0.417 . . . . 0.0 110.806 179.033 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.557 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 7.5 p -139.15 -27.78 0.8 Allowed 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 116.125 -0.488 . . . . 0.0 112.144 -178.396 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.433 ' HE3' ' O ' ' A' ' 60' ' ' CYS . 88.0 tttt -79.44 126.81 31.32 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 178.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.0 t -132.33 175.26 9.42 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.854 -177.572 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.406 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 40.6 t -158.92 148.26 18.85 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.346 -179.005 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -109.46 -12.35 14.72 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 179.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.7 m -81.07 133.63 35.51 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 177.017 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 75.4 p -113.73 176.6 4.96 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.412 -176.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.453 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 22.7 t -62.66 -18.71 62.85 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.905 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -64.86 -20.6 66.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.482 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.84 146.7 4.38 Favored Glycine 0 N--CA 1.439 -1.145 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.399 178.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 38.1 t -75.32 142.33 43.25 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.634 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -120.41 -6.92 9.78 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 11.2 p -99.71 -38.09 8.84 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.833 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.49 -0.98 16.11 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.67 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.631 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 73.4 mmtt -84.96 0.52 51.0 Favored 'General case' 0 C--O 1.239 0.551 0 O-C-N 122.625 -0.338 . . . . 0.0 110.852 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 63.92 35.39 10.9 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.268 178.796 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 24.1 p -107.85 155.48 20.21 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.901 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.453 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 50.1 p -140.75 50.18 1.67 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 120.971 0.415 . . . . 0.0 110.676 179.105 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 133.87 154.05 7.21 Favored Glycine 0 C--O 1.225 -0.429 0 C-N-CA 120.449 -0.881 . . . . 0.0 112.368 -179.024 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.406 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 76.0 Cg_exo -50.25 -41.46 50.27 Favored 'Trans proline' 0 C--N 1.36 1.139 0 C-N-CA 123.687 2.925 . . . . 0.0 114.022 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -64.37 -34.86 79.13 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.779 0.323 . . . . 0.0 111.616 -177.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 41.7 m -107.06 21.94 16.77 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.314 0.578 . . . . 0.0 110.079 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.502 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 49.4 t -98.45 123.88 42.84 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.671 -178.098 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -91.55 -17.67 25.28 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.865 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.631 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.7 m -71.66 154.05 41.65 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.797 -178.783 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.491 ' O ' ' HE3' ' A' ' 67' ' ' LYS . . . -92.76 -106.84 1.71 Allowed Glycine 0 N--CA 1.443 -0.871 0 C-N-CA 120.682 -0.77 . . . . 0.0 111.962 178.862 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.5 p -124.62 -26.0 3.91 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 120.894 0.378 . . . . 0.0 111.198 -179.608 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.3 m -89.4 50.05 1.86 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.36 -177.604 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 34.8 t -125.19 168.06 13.97 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 120.963 0.411 . . . . 0.0 111.345 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -70.25 -28.5 65.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.792 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 18.2 p -84.77 16.96 2.99 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.977 0.418 . . . . 0.0 111.122 -179.095 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.502 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 58.0 mmtt . . . . . 0 C--O 1.26 1.624 0 CA-C-O 117.585 -1.198 . . . . 0.0 110.691 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.514 -0.435 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.544 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 87.7 m -65.94 136.72 56.47 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.18 176.53 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.624 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 68.7 p -72.76 171.46 12.56 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.07 -178.051 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.8 m -70.18 -11.78 61.14 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.327 0.584 . . . . 0.0 109.904 177.692 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.402 ' HB1' ' HB2' ' A' ' 20' ' ' GLN . . . -87.76 -39.21 15.11 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.338 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.561 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 54.0 t -73.26 -24.11 60.41 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.005 0.431 . . . . 0.0 111.316 -179.101 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.624 ' HG3' ' O ' ' A' ' 11' ' ' THR . 86.9 mtt180 -73.59 -10.53 59.8 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.093 0.473 . . . . 0.0 110.188 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 30.8 t -88.84 159.99 17.45 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.132 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -131.82 116.96 16.05 Favored Pre-proline 0 C--N 1.317 -0.838 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.985 177.395 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -73.51 176.01 43.42 Favored 'Cis proline' 0 C--O 1.242 0.704 0 C-N-CA 123.536 -1.444 . . . . 0.0 112.583 1.902 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.2 t -59.72 141.07 55.9 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.807 -179.525 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.402 ' HB2' ' HB1' ' A' ' 13' ' ' ALA . 16.3 mm-40 -115.75 11.82 15.76 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.372 -178.499 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.561 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 58.1 m -81.89 20.46 0.97 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.733 0.301 . . . . 0.0 111.667 -179.057 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.5 108.29 2.13 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.075 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.1 m 63.03 15.09 8.14 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.18 0.592 . . . . 0.0 111.421 -178.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -152.31 81.4 1.25 Allowed 'General case' 0 N--CA 1.438 -1.027 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.455 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 49.5 t -130.38 150.27 51.68 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.172 -176.522 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.403 ' H ' HG21 ' A' ' 11' ' ' THR . 69.7 mt-30 -148.12 23.19 1.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.256 178.484 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.544 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 35.2 m -65.59 171.43 4.13 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.227 0.537 . . . . 0.0 112.361 -178.394 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.21 -165.7 40.08 Favored Glycine 0 N--CA 1.438 -1.173 0 CA-C-N 115.639 -0.71 . . . . 0.0 113.01 -177.863 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -84.23 -24.2 30.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 120.919 0.39 . . . . 0.0 110.975 -178.031 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -91.51 48.51 2.86 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.796 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 21.5 t -120.64 126.71 50.93 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.8 t -109.02 7.97 26.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.262 -178.067 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.2 t -69.17 115.1 8.06 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.299 179.69 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.86 -5.36 29.9 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -176.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.16 -40.9 51.45 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.805 0.336 . . . . 0.0 111.044 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 7.8 p -111.38 -18.45 12.89 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.934 -178.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -80.48 113.49 18.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.786 0.327 . . . . 0.0 110.347 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.449 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 12.6 t -120.72 167.11 12.82 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.741 -178.512 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.466 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 41.7 t -156.4 145.12 20.12 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 178.385 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -102.43 -13.52 17.23 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.498 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 70.0 m -88.9 135.63 33.43 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 175.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 81.4 p -127.94 -166.65 1.65 Allowed 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.571 -177.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.3 m -60.61 -15.04 24.04 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 120.91 0.386 . . . . 0.0 110.723 178.436 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -67.75 -30.22 69.63 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.634 178.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 147.55 157.97 7.67 Favored Glycine 0 N--CA 1.439 -1.152 0 C-N-CA 120.991 -0.623 . . . . 0.0 112.209 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.5 t -87.76 135.12 33.51 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.535 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.42 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 8.0 mtpm? -126.75 5.46 6.69 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -179.496 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.47 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 13.7 p -99.63 -32.05 11.27 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 119.984 -0.686 . . . . 0.0 110.138 178.656 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.69 5.97 25.35 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.888 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.704 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 74.4 mmtt -93.32 0.43 56.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 117.03 0.415 . . . . 0.0 111.334 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 64.19 30.65 13.59 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.568 0.699 . . . . 0.0 110.624 178.564 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.0 p -104.17 151.34 23.45 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.243 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 26.7 p -140.25 79.7 1.72 Allowed 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.084 0.469 . . . . 0.0 110.025 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.9 152.38 13.9 Favored Glycine 0 N--CA 1.442 -0.918 0 C-N-CA 121.13 -0.557 . . . . 0.0 111.858 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.466 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 11.4 Cg_endo -54.31 -34.62 80.85 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 123.435 2.757 . . . . 0.0 113.32 -177.701 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -64.05 -36.35 83.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.968 0.413 . . . . 0.0 111.378 -178.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.3 m -106.86 22.96 15.13 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.691 -177.382 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 26.6 t -113.54 139.45 48.97 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.127 -178.121 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -124.72 12.79 8.58 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.851 0.357 . . . . 0.0 110.872 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.704 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 8.1 m -76.85 148.75 36.34 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.77 -179.021 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.682 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -81.79 -170.0 43.66 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 177.52 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.6 m -86.62 10.37 15.77 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 117.121 0.46 . . . . 0.0 111.616 -177.475 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.4 t -116.92 31.61 6.65 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.182 0.515 . . . . 0.0 109.866 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' CYS . . . . . 0.4 ' SG ' ' N ' ' A' ' 65' ' ' SER . 42.4 t -109.11 167.86 9.79 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.227 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.4 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 31.2 t -68.49 -29.27 67.84 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.451 -178.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.49 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 14.1 p -90.5 23.73 2.89 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.199 0.523 . . . . 0.0 110.411 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.682 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 47.3 mmtm . . . . . 0 C--O 1.273 2.29 0 CA-C-O 117.713 -1.137 . . . . 0.0 110.768 -179.189 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.537 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 25.9 mtmm . . . . . 0 CA--C 1.518 -0.28 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 10.7 m -82.09 162.2 22.61 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 174.734 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 80.6 p -100.54 -177.62 3.55 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 120.841 0.353 . . . . 0.0 110.616 -178.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.4 m -80.61 -30.26 36.81 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 175.755 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.66 -30.59 68.31 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.333 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.542 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 52.0 t -71.58 -22.76 61.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.169 0.509 . . . . 0.0 110.578 178.736 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -87.03 -2.65 58.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.914 0.388 . . . . 0.0 110.684 179.181 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.4 m -80.14 168.94 18.49 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.799 -179.328 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.47 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 8.7 pt-20 -136.63 108.84 9.31 Favored Pre-proline 0 C--N 1.32 -0.713 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.736 179.421 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.47 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 73.0 Cg_endo -74.64 178.77 32.78 Favored 'Cis proline' 0 C--O 1.24 0.62 0 C-N-CA 123.535 -1.444 . . . . 0.0 111.919 -0.772 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.542 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 16.7 t -58.72 138.91 56.82 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -179.469 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 87.9 mm-40 -114.37 24.33 12.01 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -174.552 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.615 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 63.9 m -96.67 29.39 3.0 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.831 0.348 . . . . 0.0 110.555 178.665 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.06 -53.23 47.48 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.875 -0.602 . . . . 0.0 113.068 -179.234 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -111.51 -6.9 14.36 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.784 0.326 . . . . 0.0 111.339 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -139.07 91.72 2.54 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.863 0.363 . . . . 0.0 110.435 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 44.0 t -118.43 128.23 54.41 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.91 -179.453 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -127.0 15.92 7.34 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.612 178.293 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.537 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 93.5 m -70.01 132.41 45.87 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 121.208 0.528 . . . . 0.0 110.513 179.563 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.75 -166.95 42.29 Favored Glycine 0 N--CA 1.437 -1.275 0 CA-C-N 115.226 -0.897 . . . . 0.0 113.654 -176.617 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -53.74 -26.44 23.34 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.039 0.936 . . . . 0.0 112.167 -179.423 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -90.08 47.65 3.15 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 120.642 -0.79 . . . . 0.0 113.447 -177.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 49.8 t -120.44 139.35 52.98 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 117.117 0.459 . . . . 0.0 109.899 177.179 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.6 t -123.15 18.68 9.96 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 121.417 0.627 . . . . 0.0 109.857 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.401 ' SG ' ' HB3' ' A' ' 35' ' ' ALA . 42.9 t -93.54 113.54 25.68 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.586 -178.765 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.39 -4.32 29.38 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.673 -179.04 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.401 ' HB3' ' SG ' ' A' ' 33' ' ' CYS . . . -77.68 -41.04 39.51 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.334 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.615 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 19.8 p -106.95 -15.3 14.74 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.914 0.388 . . . . 0.0 111.979 -178.67 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -85.64 102.05 13.24 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.564 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.0 t -108.18 178.52 4.48 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.297 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 48.1 t -156.72 149.13 23.34 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -106.78 -17.05 14.32 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 73.9 m -76.62 137.27 39.37 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 176.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 65.6 p -93.39 170.13 9.85 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.852 -173.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.51 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 20.2 m -69.38 -4.17 17.28 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.3 -179.253 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -84.02 -31.78 25.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.814 179.124 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 172.3 156.76 12.82 Favored Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.378 -179.162 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 53.8 t -74.84 142.18 44.19 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.704 0.287 . . . . 0.0 110.519 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 7.1 mtpm? -117.42 -18.6 9.79 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.735 -178.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.438 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 7.2 p -93.3 -33.23 14.0 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.857 -178.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.15 4.76 23.78 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.507 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.0 mmmp? -92.16 10.64 28.53 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 122.577 -0.366 . . . . 0.0 111.229 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 63.12 24.19 14.31 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.917 176.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 8.2 p -102.6 143.99 31.57 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.599 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.51 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 68.5 p -132.34 52.47 2.07 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-O 121.195 0.521 . . . . 0.0 110.198 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.87 161.18 9.79 Favored Glycine 0 N--CA 1.445 -0.704 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.52 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.33 -41.12 68.45 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.518 2.812 . . . . 0.0 114.129 -177.421 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -74.44 -22.96 58.87 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.012 0.434 . . . . 0.0 111.134 -178.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.407 ' HB2' ' H ' ' A' ' 53' ' ' THR . 7.4 m -96.44 -0.46 49.14 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.873 179.305 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 44.1 t -98.26 147.65 24.42 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.082 -176.657 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -138.16 11.59 2.82 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.935 0.874 . . . . 0.0 108.832 176.489 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.2 m -81.71 142.49 32.63 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.618 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.435 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -67.53 167.31 41.02 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.453 -0.88 . . . . 0.0 111.332 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 30.7 m -69.18 5.68 1.17 Allowed 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -178.411 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 33.5 t -108.7 5.7 25.04 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.652 0.263 . . . . 0.0 111.192 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 49.7 t -77.37 169.07 18.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.88 0.371 . . . . 0.0 111.105 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.8 m -64.62 -28.74 69.83 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.697 -178.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.438 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 18.7 p -89.82 25.7 2.0 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.007 0.432 . . . . 0.0 110.763 -179.731 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 47.9 mmtm . . . . . 0 C--O 1.263 1.773 0 CA-C-O 117.43 -1.272 . . . . 0.0 111.402 -178.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 N-CA-C 112.039 -0.424 . . . . 0.0 112.039 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.6 m -86.38 150.14 24.52 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.796 0.332 . . . . 0.0 110.662 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 126.33 -18.06 6.52 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -110.32 119.04 37.95 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.906 0.384 . . . . 0.0 110.48 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 134.86 -164.3 24.73 Favored Glycine 0 N--CA 1.438 -1.193 0 N-CA-C 111.296 -0.721 . . . . 0.0 111.296 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.693 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 32.5 mmtp -125.53 171.42 10.53 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 120.838 0.352 . . . . 0.0 110.742 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -95.24 -178.11 37.34 Favored Glycine 0 N--CA 1.44 -1.085 0 C-N-CA 121.005 -0.617 . . . . 0.0 113.01 -177.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -77.53 -24.86 49.88 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.998 0.428 . . . . 0.0 110.81 -178.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 98.5 mttt -92.14 6.34 46.95 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.955 -178.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.693 ' SG ' ' HB3' ' A' ' 6' ' ' LYS . 68.4 m -69.47 156.48 38.8 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.008 0.432 . . . . 0.0 110.344 177.331 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 65.2 p -92.71 169.24 10.64 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.071 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.8 m -73.99 -11.27 60.29 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.85 -42.96 18.88 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.25 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.43 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 44.8 t -69.84 -23.42 63.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.325 0.583 . . . . 0.0 110.582 178.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -85.78 5.37 32.75 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.991 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.8 t -110.04 156.88 19.94 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.93 -0.766 . . . . 0.0 108.93 177.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.437 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 6.7 pt-20 -126.17 126.67 24.74 Favored Pre-proline 0 C--N 1.322 -0.604 0 C-N-CA 121.084 -0.246 . . . . 0.0 110.361 177.343 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.437 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 11.7 Cg_exo -68.8 170.93 51.78 Favored 'Cis proline' 0 C--N 1.346 0.425 0 C-N-CA 123.236 -1.568 . . . . 0.0 111.98 0.321 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.404 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 5.3 t -60.09 116.74 4.4 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.645 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -86.23 8.69 20.15 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.433 -176.066 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.456 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 79.7 m -78.5 6.46 8.54 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.663 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.08 -20.62 65.04 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.962 -0.637 . . . . 0.0 111.61 177.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.5 m -143.37 23.55 1.81 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.055 0.455 . . . . 0.0 110.325 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 87.0 tttt -170.89 81.71 0.08 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.161 -178.643 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.3 t -121.42 138.63 54.19 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.837 0.351 . . . . 0.0 111.15 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -153.48 20.98 0.55 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.659 -0.701 . . . . 0.0 109.967 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.417 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 70.9 m -68.53 146.85 52.74 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -175.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.88 -146.42 16.75 Favored Glycine 0 N--CA 1.442 -0.949 0 CA-C-N 114.939 -1.028 . . . . 0.0 113.227 -178.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.498 ' CD ' ' H ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -75.74 -38.63 58.3 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 122.42 0.288 . . . . 0.0 111.65 -177.433 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.83 60.19 2.99 Favored Glycine 0 C--O 1.223 -0.561 0 C-N-CA 121.267 -0.492 . . . . 0.0 112.931 -178.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 35.7 t -153.81 111.3 3.48 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.887 0.375 . . . . 0.0 110.194 179.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 t -103.92 17.48 24.0 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.81 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.7 t -74.93 107.09 6.78 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.738 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.9 -10.34 56.62 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.664 -178.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.22 -36.36 83.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.91 0.386 . . . . 0.0 110.592 178.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.405 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 6.7 p -116.69 -15.2 10.79 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.792 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp -92.43 132.56 36.68 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.116 0.484 . . . . 0.0 111.561 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.0 t -136.25 153.61 51.15 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 177.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.9 t -147.43 154.36 40.73 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.59 0.233 . . . . 0.0 110.476 -178.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -112.73 -14.8 13.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.619 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 83.9 m -67.77 138.82 56.49 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 176.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.6 p -97.65 171.15 8.52 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.426 -171.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.404 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 16.5 m -71.49 -17.06 62.37 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -176.258 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -76.6 -21.67 55.26 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.931 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.401 ' O ' ' HE2' ' A' ' 47' ' ' LYS . . . 166.66 156.33 9.54 Favored Glycine 0 N--CA 1.434 -1.465 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.237 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 44.1 t -69.47 145.35 52.81 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.401 ' HE2' ' O ' ' A' ' 45' ' ' GLY . 71.8 mmtt -111.83 -35.92 5.58 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.691 0.282 . . . . 0.0 111.531 -177.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.432 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 2.8 p -76.99 -39.67 49.56 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.97 -177.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.87 4.4 19.05 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.657 -0.782 . . . . 0.0 113.468 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.436 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 11.3 mmpt? -90.39 3.32 54.14 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 117.231 0.516 . . . . 0.0 110.373 178.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 63.95 61.45 0.95 Allowed 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.842 -179.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 9.5 p -136.92 145.26 44.07 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.238 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.404 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 40.5 p -132.04 70.15 1.47 Allowed 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.519 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 102.91 164.95 25.94 Favored Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.522 -0.846 . . . . 0.0 112.014 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -61.28 -11.68 20.3 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 C-N-CA 123.555 2.836 . . . . 0.0 113.221 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -69.97 -24.02 63.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.998 0.428 . . . . 0.0 111.321 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.6 m -144.79 29.77 1.21 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.058 0.456 . . . . 0.0 110.57 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 37.5 t -85.87 109.14 18.51 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.032 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 51.5 mttp -73.04 -25.15 60.83 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.659 0.742 . . . . 0.0 109.206 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.9 m -64.52 124.32 21.54 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 114.645 -1.161 . . . . 0.0 111.844 -176.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -97.38 56.38 1.22 Allowed Glycine 0 N--CA 1.443 -0.884 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 41.2 m 68.07 176.32 0.26 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.108 0.563 . . . . 0.0 111.116 -178.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.1 t 65.11 19.48 11.8 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 122.682 0.393 . . . . 0.0 111.658 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' CYS . . . . . 0.437 ' SG ' ' N ' ' A' ' 65' ' ' SER . 50.0 t -108.25 173.35 6.36 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.854 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.437 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 9.5 m -61.33 -37.73 84.33 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 122.878 0.471 . . . . 0.0 111.863 -178.219 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.503 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 31.9 p -84.51 17.41 2.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.995 0.426 . . . . 0.0 111.153 -178.476 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.503 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 43.0 mmtm . . . . . 0 C--O 1.263 1.763 0 CA-C-O 117.704 -1.141 . . . . 0.0 110.809 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.367 0 N-CA-C 112.227 -0.349 . . . . 0.0 112.227 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.3 t -66.69 120.91 14.28 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 152.07 -82.99 0.17 Allowed Glycine 0 N--CA 1.436 -1.313 0 C-N-CA 120.248 -0.977 . . . . 0.0 112.534 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -156.25 130.89 8.94 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.653 0.263 . . . . 0.0 111.578 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.06 -51.17 4.07 Favored Glycine 0 C--N 1.331 0.291 0 N-CA-C 114.984 0.754 . . . . 0.0 114.984 174.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.459 ' NZ ' ' SG ' ' A' ' 14' ' ' CYS . 24.6 mtpp -75.21 72.95 2.32 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -175.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -113.79 -103.21 2.55 Favored Glycine 0 N--CA 1.437 -1.269 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.38 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -82.0 -18.19 44.22 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.913 0.387 . . . . 0.0 111.204 -177.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -71.79 -27.33 62.87 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.844 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.0 m -76.35 153.66 35.63 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-O 121.422 0.629 . . . . 0.0 111.831 -179.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.543 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 43.4 p -90.89 174.28 7.53 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.281 -177.354 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 m -69.85 -27.87 65.2 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.418 ' HB1' ' C ' ' A' ' 20' ' ' GLN . . . -68.6 -41.11 80.03 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.278 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.459 ' SG ' ' NZ ' ' A' ' 6' ' ' LYS . 44.4 t -70.82 -26.49 63.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.038 0.447 . . . . 0.0 110.255 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.543 ' HG3' ' O ' ' A' ' 11' ' ' THR . 22.2 mtm180 -82.01 -7.94 59.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.191 0.519 . . . . 0.0 110.126 178.202 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 49.0 m -91.87 156.22 17.65 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.371 178.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.447 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 7.5 pt-20 -132.04 125.75 20.26 Favored Pre-proline 0 C--N 1.311 -1.074 0 CA-C-O 120.689 0.28 . . . . 0.0 111.219 -178.472 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.447 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 55.3 Cg_endo -69.3 168.66 64.95 Favored 'Cis proline' 0 C--N 1.349 0.574 0 C-N-CA 123.159 -1.6 . . . . 0.0 112.001 -0.511 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.2 t -53.61 128.59 29.8 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.418 ' C ' ' HB1' ' A' ' 13' ' ' ALA . 31.0 mm-40 -108.14 19.74 19.56 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.189 -0.46 . . . . 0.0 112.031 -175.015 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 58.7 m -82.5 9.7 8.74 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -177.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.57 123.19 13.22 Favored Glycine 0 N--CA 1.442 -0.908 0 C-N-CA 120.63 -0.795 . . . . 0.0 111.376 177.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.1 m 72.74 1.83 4.14 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.439 0.696 . . . . 0.0 111.91 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -162.95 80.45 0.48 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 121.182 0.515 . . . . 0.0 110.471 177.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 47.4 t -112.62 137.22 51.18 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.365 177.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -136.95 17.95 3.02 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.973 -177.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 96.4 m -67.31 152.89 44.91 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.385 179.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.2 -144.55 5.64 Favored Glycine 0 N--CA 1.44 -1.035 0 C-N-CA 120.566 -0.826 . . . . 0.0 112.708 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.12 -18.44 23.54 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-O 121.007 0.432 . . . . 0.0 111.194 -179.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -94.57 74.18 1.02 Allowed Glycine 0 N--CA 1.44 -1.088 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.04 178.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.423 ' O ' ' HD2' ' A' ' 37' ' ' LYS . 45.0 t -146.04 119.48 9.04 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.045 0.45 . . . . 0.0 109.917 177.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.8 t -102.66 14.74 31.2 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.057 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.3 t -76.56 118.88 19.66 Favored 'General case' 0 N--CA 1.461 0.122 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.97 -14.91 62.93 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -177.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.8 -52.43 30.21 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -178.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 6.1 p -99.0 -17.57 18.22 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -177.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.423 ' HD2' ' O ' ' A' ' 31' ' ' CYS . 87.9 tttt -87.49 116.06 25.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.073 0.463 . . . . 0.0 111.095 179.237 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.8 t -125.95 -176.68 3.7 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.42 178.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.2 t -160.24 139.29 10.69 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 -89.53 -18.51 26.51 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.558 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 71.9 m -70.67 153.86 42.41 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.358 0.599 . . . . 0.0 111.464 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.7 p -127.5 -169.56 2.07 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.749 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 47.5 m -76.47 7.95 3.96 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.215 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.65 -34.14 77.19 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 175.184 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 123.06 52.42 0.21 Allowed Glycine 0 N--CA 1.438 -1.228 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.775 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 47.8 t 70.45 151.68 0.1 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.377 0.608 . . . . 0.0 111.27 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.2 tmtp? -123.25 -50.45 1.9 Allowed 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.767 -177.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 28.6 p -73.91 -35.34 64.62 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.911 -178.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.41 18.69 6.52 Favored Glycine 0 CA--C 1.522 0.481 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.914 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -101.49 9.46 41.34 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 122.648 -0.324 . . . . 0.0 111.58 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 66.84 34.99 5.14 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.409 0.684 . . . . 0.0 111.457 177.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 3.5 p -111.74 148.3 33.79 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.312 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.5 p -136.04 37.72 2.78 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-O 121.243 0.544 . . . . 0.0 111.509 -177.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.01 157.44 7.23 Favored Glycine 0 C--O 1.219 -0.807 0 C-N-CA 120.516 -0.849 . . . . 0.0 111.998 -178.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -45.31 -55.81 3.21 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.985 3.123 . . . . 0.0 114.971 -178.023 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -67.18 -35.37 79.51 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.906 0.384 . . . . 0.0 111.094 -177.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.2 m -89.45 9.92 24.63 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.01 -178.716 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 43.7 t -89.8 134.02 34.4 Favored 'General case' 0 N--CA 1.435 -1.202 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.136 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 47.8 mttt -101.19 -4.97 26.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.32 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.3 m -87.63 152.69 21.97 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.815 -174.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -81.84 -165.34 35.29 Favored Glycine 0 N--CA 1.44 -1.069 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.7 p -82.02 -17.01 48.26 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 117.1 0.45 . . . . 0.0 110.782 -178.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.1 t -99.47 69.05 1.63 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 121.269 0.557 . . . . 0.0 110.307 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 14.4 t -138.99 166.78 23.6 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.984 178.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -69.11 -26.33 64.86 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.321 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.731 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 11.8 p -84.09 6.53 21.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.008 0.432 . . . . 0.0 110.353 179.205 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.731 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 30.1 mmtp . . . . . 0 C--O 1.263 1.779 0 CA-C-O 117.601 -1.19 . . . . 0.0 110.355 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.477 0 N-CA-C 112.186 -0.366 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.1 p -154.26 162.21 41.32 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.63 61.55 4.73 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.817 -0.706 . . . . 0.0 111.893 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -119.16 -168.65 1.6 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.56 0.219 . . . . 0.0 110.538 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.97 -45.49 3.43 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.345 -0.702 . . . . 0.0 111.345 -178.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.758 ' HG2' ' SG ' ' A' ' 10' ' ' CYS . 35.2 ttpt -148.87 122.49 9.19 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 178.299 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 172.39 -152.44 16.82 Favored Glycine 0 N--CA 1.444 -0.792 0 C-N-CA 119.441 -1.361 . . . . 0.0 113.299 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 70.94 -68.01 0.23 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.022 0.929 . . . . 0.0 111.56 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.554 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 5.6 mptt -107.07 4.62 27.15 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 116.695 -0.229 . . . . 0.0 111.164 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.758 ' SG ' ' HG2' ' A' ' 6' ' ' LYS . 37.8 m -62.8 143.42 57.55 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-O 121.174 0.511 . . . . 0.0 111.38 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.438 HG22 ' HB2' ' A' ' 26' ' ' GLN . 40.8 p -90.12 168.67 11.79 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.341 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.7 m -72.35 -14.84 61.83 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.384 0.611 . . . . 0.0 109.499 175.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.14 -35.43 42.06 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.492 177.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.3 t -76.2 -16.47 59.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.682 177.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -86.17 4.72 37.32 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.228 176.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.2 t -114.08 153.54 29.28 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.714 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.492 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -130.82 127.01 22.07 Favored Pre-proline 0 C--N 1.315 -0.893 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.264 -178.701 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.492 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 36.6 Cg_endo -66.24 164.51 65.51 Favored 'Cis proline' 0 C--O 1.242 0.69 0 C-N-CA 123.341 -1.524 . . . . 0.0 111.996 -1.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.462 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 33.9 t -53.73 128.08 28.22 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.091 -178.396 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -98.6 22.77 9.45 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.573 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.566 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 89.9 m -96.67 22.33 8.25 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.59 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.26 -40.95 77.7 Favored Glycine 0 CA--C 1.52 0.363 0 C-N-CA 121.282 -0.485 . . . . 0.0 113.162 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.9 t -144.36 2.07 1.1 Allowed 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.956 0.408 . . . . 0.0 110.803 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -114.82 21.24 14.54 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.061 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 49.8 t -65.41 144.74 56.87 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.34 0.59 . . . . 0.0 112.042 -176.522 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.438 ' HB2' HG22 ' A' ' 11' ' ' THR . 34.2 mt-30 -147.34 16.17 1.16 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.378 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 79.9 m -68.82 171.3 8.1 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.435 0.636 . . . . 0.0 112.364 -177.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -115.78 -151.51 9.83 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.874 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -83.82 -18.18 38.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.022 0.411 . . . . 0.0 110.614 179.503 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.23 42.34 2.74 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 121.091 -0.576 . . . . 0.0 111.926 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.4 t -127.58 126.55 42.31 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-O 121.085 0.469 . . . . 0.0 109.969 -179.141 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 t -102.57 4.4 38.4 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.501 0.667 . . . . 0.0 110.029 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 35.1 t -82.24 116.0 21.57 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.601 -178.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.86 -0.77 49.73 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.309 -179.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.26 -42.26 69.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.996 0.427 . . . . 0.0 110.697 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.566 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 5.7 p -101.33 -39.93 7.36 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.126 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -73.15 99.99 2.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.105 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.1 t -114.5 -179.13 3.54 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.276 179.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.441 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 34.1 t -163.34 136.2 5.45 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 122.835 0.454 . . . . 0.0 109.803 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -92.58 -15.99 26.23 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.485 ' SG ' ' HB2' ' A' ' 47' ' ' LYS . 88.8 m -69.15 147.4 51.43 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.205 0.526 . . . . 0.0 111.215 178.344 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 16.5 p -123.32 179.43 4.72 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.474 -175.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.4 m -66.27 -5.25 9.8 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.897 -179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -58.79 -35.23 72.47 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 120.87 0.367 . . . . 0.0 110.213 177.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 136.99 50.62 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.24 -0.981 . . . . 0.0 113.152 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 44.4 t 66.4 166.69 0.21 Allowed 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 120.944 0.402 . . . . 0.0 111.165 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.485 ' HB2' ' SG ' ' A' ' 41' ' ' CYS . 98.1 mttt -139.92 -46.62 0.44 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.849 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.548 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 20.8 p -73.7 -34.61 64.92 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.458 -177.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.73 21.95 4.86 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.502 -0.856 . . . . 0.0 113.136 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.548 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 75.1 mmtt -107.19 6.5 28.77 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.921 0.361 . . . . 0.0 110.463 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 62.5 26.42 15.72 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.979 0.912 . . . . 0.0 111.368 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 11.6 p -95.91 151.77 19.11 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.441 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.9 p -138.19 80.95 1.83 Allowed 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.196 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 88.79 160.26 36.11 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.545 -0.835 . . . . 0.0 111.703 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.441 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 18.1 Cg_endo -59.3 -21.4 60.28 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.87 2.38 . . . . 0.0 112.788 -178.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.21 -30.11 71.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.87 178.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.3 t -139.54 63.96 1.48 Allowed 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 121.505 0.669 . . . . 0.0 109.314 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.408 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 48.8 t -133.3 132.09 40.96 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.257 -179.469 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -110.72 -3.25 15.89 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.168 0.509 . . . . 0.0 110.004 178.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.4 m -74.29 137.91 43.22 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.389 -176.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.24 169.77 53.77 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.306 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.3 m -64.94 -12.94 55.29 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -177.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.1 m -101.58 17.65 22.28 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.629 0.252 . . . . 0.0 111.627 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' CYS . . . . . 0.415 ' SG ' ' N ' ' A' ' 65' ' ' SER . 37.5 t -83.49 172.43 12.42 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 111.357 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.415 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 14.7 m -72.72 -20.37 61.22 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.232 -177.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.491 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 23.4 p -89.93 11.45 20.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.876 0.37 . . . . 0.0 111.002 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.408 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 57.9 mmtt . . . . . 0 C--O 1.269 2.117 0 CA-C-O 117.744 -1.122 . . . . 0.0 110.515 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.428 0 N-CA-C 112.344 -0.302 . . . . 0.0 112.344 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.3 m -133.69 146.83 51.19 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -77.12 -34.54 41.32 Favored Glycine 0 N--CA 1.444 -0.832 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 176.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 67.7 mmtt -101.87 -164.53 1.1 Allowed 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.407 -0.396 . . . . 0.0 110.221 177.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -177.35 172.9 45.74 Favored Glycine 0 N--CA 1.439 -1.109 0 N-CA-C 110.892 -0.883 . . . . 0.0 110.892 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.819 ' HA ' ' SG ' ' A' ' 10' ' ' CYS . 24.0 pttm -71.22 112.5 7.41 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.149 0.5 . . . . 0.0 111.222 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -175.32 -95.44 0.1 OUTLIER Glycine 0 N--CA 1.439 -1.136 0 C-N-CA 120.383 -0.913 . . . . 0.0 113.525 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -47.04 -51.49 17.31 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 -175.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.609 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 29.8 mmtp -95.91 -6.67 38.64 Favored 'General case' 0 C--N 1.308 -1.196 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -176.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.819 ' SG ' ' HA ' ' A' ' 6' ' ' LYS . 61.3 m -87.07 157.36 19.43 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.368 0.604 . . . . 0.0 111.692 -177.411 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.59 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 61.7 p -95.31 175.47 6.58 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.694 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.6 m -70.53 -17.43 62.94 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.007 0.432 . . . . 0.0 110.858 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.17 -40.07 53.38 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.024 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 53.1 t -74.72 -23.22 58.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.171 0.51 . . . . 0.0 110.229 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.59 ' HG3' ' O ' ' A' ' 11' ' ' THR . 86.5 mtt180 -77.41 0.23 23.31 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.76 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 t -102.21 158.58 16.07 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -128.87 123.03 21.74 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-O 120.679 0.276 . . . . 0.0 110.707 178.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -71.33 178.61 28.46 Favored 'Cis proline' 0 C--O 1.235 0.375 0 C-N-CA 123.412 -1.495 . . . . 0.0 111.868 -0.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.8 t -61.66 134.66 57.06 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.639 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -115.17 20.62 14.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.742 -176.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.505 ' HB3' ' HB2' ' A' ' 25' ' ' CYS . 81.3 m -81.13 59.76 4.01 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -178.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.69 -57.67 4.44 Favored Glycine 0 C--N 1.302 -1.335 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 176.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.5 m -125.66 5.74 7.49 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.125 0.488 . . . . 0.0 110.378 178.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -113.8 34.33 4.67 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.341 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.505 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 13.8 t -92.95 115.93 28.58 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 120.059 -0.657 . . . . 0.0 111.328 -179.513 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.526 ' HB2' ' CG2' ' A' ' 11' ' ' THR . 27.4 mm-40 -131.23 14.87 5.11 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.203 -0.908 . . . . 0.0 108.905 177.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.609 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 73.9 m -61.61 140.33 58.16 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.976 -177.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.528 ' H ' ' HB3' ' A' ' 9' ' ' LYS . . . -113.98 -164.23 15.2 Favored Glycine 0 C--N 1.312 -0.789 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.105 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.493 ' CD ' ' H ' ' A' ' 29' ' ' GLU . 1.0 OUTLIER -65.72 134.56 53.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.998 0.428 . . . . 0.0 110.209 179.033 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 117.46 -10.52 14.51 Favored Glycine 0 N--CA 1.438 -1.207 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -175.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 47.5 t -80.0 123.94 28.27 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.9 t -106.78 12.14 29.39 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.337 0.589 . . . . 0.0 110.914 -176.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.8 t -82.44 141.12 33.0 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.098 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -100.17 0.86 41.33 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.061 0.458 . . . . 0.0 110.765 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.48 -51.52 9.86 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.507 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 5.1 p -100.04 -19.4 16.55 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -175.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -75.95 131.55 39.67 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.484 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.559 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 10.8 t -133.26 -176.92 4.3 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.44 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 37.4 t -162.12 153.85 18.69 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 122.793 0.437 . . . . 0.0 109.913 -179.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -112.1 -12.5 13.67 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.4 m -78.25 130.03 35.77 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.2 p -103.91 175.8 5.36 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.479 -174.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.4 t -65.39 -7.2 12.68 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.038 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -71.55 -27.44 63.17 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 153.31 155.09 7.0 Favored Glycine 0 N--CA 1.437 -1.243 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.675 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.6 t -74.77 137.72 42.17 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -118.75 -3.58 10.79 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.369 -0.532 . . . . 0.0 112.332 -177.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.633 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 8.0 p -102.53 -35.72 8.64 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.035 -0.666 . . . . 0.0 110.495 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.98 13.83 7.55 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.182 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.642 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 32.5 mmtp -101.1 -1.67 33.45 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 117.077 0.438 . . . . 0.0 110.61 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 67.47 27.93 7.84 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.993 -179.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 25.0 p -99.3 150.94 21.61 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.707 178.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.2 p -142.71 62.03 1.41 Allowed 'General case' 0 C--N 1.312 -1.051 0 CA-C-O 121.146 0.498 . . . . 0.0 110.364 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 124.44 156.05 9.32 Favored Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.362 -0.695 . . . . 0.0 111.362 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.21 -38.66 81.69 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 123.054 2.503 . . . . 0.0 113.435 -177.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.38 -38.54 87.38 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.955 0.407 . . . . 0.0 111.494 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.9 t -98.37 2.75 48.27 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.598 -178.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 54.0 t -92.48 133.53 35.83 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.138 0.495 . . . . 0.0 111.709 -177.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -116.87 11.02 14.3 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.091 179.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.642 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 18.8 m -83.28 157.61 22.56 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.922 -178.654 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.481 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -88.4 -166.16 42.01 Favored Glycine 0 N--CA 1.437 -1.3 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 175.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.6 m -79.82 -15.38 57.53 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 117.467 0.634 . . . . 0.0 111.774 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.8 m -99.96 73.68 1.76 Allowed 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.887 0.375 . . . . 0.0 110.99 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.2 t -144.71 165.96 26.57 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.929 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 10.0 m -63.38 -28.97 70.35 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.712 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 16.3 p -92.83 19.29 7.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.076 0.465 . . . . 0.0 110.564 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.559 ' HE3' ' O ' ' A' ' 38' ' ' THR . 48.7 mmtm . . . . . 0 C--O 1.262 1.748 0 CA-C-O 117.681 -1.152 . . . . 0.0 111.041 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.337 0 N-CA-C 112.54 -0.224 . . . . 0.0 112.54 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.4 m 60.17 30.93 20.3 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 122.886 0.474 . . . . 0.0 111.818 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 177.28 -119.95 0.71 Allowed Glycine 0 N--CA 1.44 -1.091 0 C-N-CA 119.878 -1.153 . . . . 0.0 113.173 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.2 mtmt -102.67 6.75 39.77 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.815 0.34 . . . . 0.0 111.498 -177.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.39 166.6 19.39 Favored Glycine 0 N--CA 1.442 -0.911 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.553 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -76.8 -28.47 55.63 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.923 0.392 . . . . 0.0 110.903 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 155.47 179.19 30.41 Favored Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 111.149 -0.781 . . . . 0.0 111.149 -179.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -115.29 -22.09 9.57 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.05 0.452 . . . . 0.0 110.976 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -82.71 2.03 35.69 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.355 0.597 . . . . 0.0 110.02 176.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.626 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 38.0 m -74.13 149.44 41.03 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.254 177.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.594 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 61.6 p -77.2 164.26 25.78 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.018 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.0 m -63.15 -24.9 68.1 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.2 -46.47 70.55 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.355 177.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.615 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 47.9 t -70.22 -29.83 66.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.101 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.594 ' HG3' ' O ' ' A' ' 11' ' ' THR . 85.6 mtt180 -70.72 -8.9 55.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.042 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.8 m -90.93 166.41 13.06 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.842 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -132.25 120.47 17.09 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-O 120.47 0.176 . . . . 0.0 110.985 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -73.53 -177.31 19.01 Favored 'Cis proline' 0 C--N 1.351 0.669 0 C-N-CA 123.589 -1.421 . . . . 0.0 112.038 0.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.8 t -60.76 139.68 57.83 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.128 -178.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 81.3 mm-40 -111.55 12.11 21.3 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.223 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.615 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 78.9 m -82.89 26.89 0.57 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.86 0.362 . . . . 0.0 110.749 178.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.03 -47.29 88.62 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.854 -178.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.3 m -128.64 25.28 5.71 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 120.791 0.329 . . . . 0.0 110.649 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -164.89 95.87 0.71 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.746 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 49.1 t -122.84 145.85 48.07 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.574 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.405 ' HB3' HG22 ' A' ' 11' ' ' THR . 13.7 tt0 -149.75 14.84 0.85 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.851 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.626 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 95.1 m -61.7 142.85 56.96 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -177.488 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.54 -157.79 29.14 Favored Glycine 0 N--CA 1.438 -1.224 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.718 177.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -5.12 50.68 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 117.242 0.521 . . . . 0.0 110.971 178.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -95.26 54.01 1.81 Allowed Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.264 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.5 t -128.99 146.05 51.08 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.2 t -123.89 14.7 9.27 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.178 0.513 . . . . 0.0 110.08 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 8.6 t -92.0 136.76 32.91 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.502 -177.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -96.3 -3.65 43.56 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.129 0.49 . . . . 0.0 110.616 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.1 -31.39 58.67 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.309 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.431 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 7.6 p -114.88 -16.02 11.76 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -177.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.411 ' HE2' ' O ' ' A' ' 55' ' ' PRO . 85.2 tttt -84.77 109.51 18.11 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.949 -0.3 . . . . 0.0 110.755 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 t -121.38 176.2 5.77 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.881 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.466 ' HB3' ' N ' ' A' ' 55' ' ' PRO . 42.6 t -162.85 148.32 12.04 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 122.554 0.342 . . . . 0.0 110.342 -178.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -107.29 -14.88 14.78 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 83.5 m -77.78 144.36 37.2 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 177.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 49.5 p -127.78 -179.78 5.13 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.548 0.213 . . . . 0.0 111.435 -175.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 40.3 m -62.83 -16.08 56.91 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -177.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -66.09 -34.42 78.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.167 0.508 . . . . 0.0 110.11 177.424 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.93 151.29 6.18 Favored Glycine 0 N--CA 1.435 -1.407 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.741 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 39.6 t -73.99 139.08 44.55 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -108.74 -15.21 14.45 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -177.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.632 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 15.2 p -102.17 -33.21 9.74 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 120.186 -0.605 . . . . 0.0 110.867 -179.236 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.36 10.46 17.44 Favored Glycine 0 CA--C 1.523 0.564 0 C-N-CA 120.762 -0.732 . . . . 0.0 113.53 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.728 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 31.7 mmtp -90.81 1.64 56.76 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 117.12 0.46 . . . . 0.0 111.519 -179.042 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 50' ' ' LYS . 37.5 mm-40 70.17 21.41 5.96 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.58 0.55 . . . . 0.0 111.163 -179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.0 p -96.86 146.74 24.65 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.137 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.1 p -135.09 35.74 3.04 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-O 120.929 0.395 . . . . 0.0 110.874 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 158.83 157.28 8.42 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.429 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.466 ' N ' ' HB3' ' A' ' 39' ' ' CYS . 10.8 Cg_endo -52.22 -51.26 11.54 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 124.078 3.185 . . . . 0.0 115.104 -177.008 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -71.22 -35.04 71.35 Favored 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.938 -176.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.2 m -84.9 -0.91 55.74 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.754 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.488 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 44.2 t -74.68 146.15 42.57 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.909 -179.123 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -108.98 -4.88 16.34 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.64 -179.178 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.728 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 11.0 m -81.44 151.35 27.92 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.474 -177.003 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -109.34 62.24 0.29 Allowed Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.956 -0.565 . . . . 0.0 112.306 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.488 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 49.2 m 69.79 -37.95 0.39 Allowed 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 177.038 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.3 p -84.37 67.69 9.95 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -177.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 35.8 t -146.13 169.97 17.65 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.723 176.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.1 t -75.09 -21.53 58.88 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.384 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.49 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 9.3 p -82.15 22.49 0.8 Allowed 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.246 0.546 . . . . 0.0 110.574 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.488 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 66.8 mmtt . . . . . 0 C--O 1.271 2.208 0 CA-C-O 117.338 -1.315 . . . . 0.0 110.109 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.35 0 N-CA-C 112.188 -0.365 . . . . 0.0 112.188 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.0 m -78.51 110.23 13.41 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 110.199 -0.297 . . . . 0.0 110.199 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -66.45 104.91 1.14 Allowed Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -69.54 96.43 0.92 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.365 0.602 . . . . 0.0 111.732 -177.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -132.71 125.6 4.2 Favored Glycine 0 N--CA 1.429 -1.808 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 177.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.675 ' HA ' ' SG ' ' A' ' 10' ' ' CYS . 38.4 ttmt 77.37 95.18 0.06 Allowed 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 123.812 0.845 . . . . 0.0 111.417 -178.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 167.35 168.74 29.96 Favored Glycine 0 N--CA 1.436 -1.327 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.628 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 66.9 -70.35 0.11 Allowed 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.469 0.708 . . . . 0.0 112.474 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.481 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 27.8 mtpp -101.01 4.74 42.68 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 120.662 0.268 . . . . 0.0 111.359 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.675 ' SG ' ' HA ' ' A' ' 6' ' ' LYS . 6.9 m -77.73 163.95 25.69 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 121.031 0.443 . . . . 0.0 110.119 175.623 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 65.6 p -104.23 162.78 12.9 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.838 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.2 m -70.19 -13.75 62.32 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.285 0.564 . . . . 0.0 110.313 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.09 -34.38 32.67 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.899 176.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.607 ' SG ' ' HE2' ' A' ' 6' ' ' LYS . 43.1 t -75.53 -29.0 59.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.573 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.4 mtt180 -77.67 8.94 3.82 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.261 0.553 . . . . 0.0 111.018 177.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 39.2 t -108.08 150.14 27.55 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.415 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 11.2 pt-20 -127.85 124.37 23.24 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-O 120.601 0.239 . . . . 0.0 110.526 178.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.415 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 7.9 Cg_exo -70.15 169.83 63.1 Favored 'Cis proline' 0 C--O 1.239 0.565 0 C-N-CA 123.069 -1.638 . . . . 0.0 112.007 0.302 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 13.4 t -56.89 138.18 54.13 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.31 -177.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -112.37 16.25 20.0 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.167 -178.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 56.6 m -89.32 14.25 11.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.293 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.59 -49.1 76.52 Favored Glycine 0 CA--C 1.521 0.432 0 C-N-CA 121.293 -0.48 . . . . 0.0 113.103 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.7 m -113.0 13.13 19.42 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.898 0.38 . . . . 0.0 111.265 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 57.3 tttm -164.93 101.5 0.77 Allowed 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.391 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.428 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 45.1 t -132.18 149.7 52.33 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.196 -179.292 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -153.38 22.25 0.55 Allowed 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.901 178.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 91.0 m -68.44 144.97 54.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.095 0.474 . . . . 0.0 111.271 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.47 ' HA3' ' HE3' ' A' ' 9' ' ' LYS . . . -81.19 -156.78 15.81 Favored Glycine 0 N--CA 1.441 -0.972 0 CA-C-N 115.48 -0.782 . . . . 0.0 112.816 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.519 ' CD ' ' H ' ' A' ' 29' ' ' GLU . 0.2 OUTLIER -78.55 -31.49 47.46 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.793 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -78.87 60.69 4.13 Favored Glycine 0 N--CA 1.444 -0.803 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.209 178.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 48.4 t -129.11 142.33 50.92 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 177.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.8 t -120.43 12.61 11.67 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.13 0.49 . . . . 0.0 110.753 -178.131 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.437 ' SG ' ' HB3' ' A' ' 35' ' ' ALA . 48.9 t -90.27 115.88 27.82 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.042 0.448 . . . . 0.0 110.172 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.96 4.73 16.0 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.454 -178.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.437 ' HB3' ' SG ' ' A' ' 33' ' ' CYS . . . -80.77 -42.83 21.13 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.812 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 8.9 p -106.34 -36.13 6.93 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.375 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -80.61 116.42 20.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.207 0.527 . . . . 0.0 110.424 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.417 ' HA ' ' HG3' ' A' ' 55' ' ' PRO . 12.0 t -123.31 -176.2 3.38 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.471 -179.027 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 41.8 t -154.24 140.35 18.41 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -90.33 -17.26 27.66 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.299 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 99.6 m -73.81 154.53 39.48 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.126 0.489 . . . . 0.0 111.305 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.2 p -115.44 -173.63 2.37 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.477 -175.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.0 m -71.56 -6.01 37.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.599 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -60.03 -37.91 81.16 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.054 0.454 . . . . 0.0 110.817 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 129.03 56.4 0.1 Allowed Glycine 0 N--CA 1.443 -0.852 0 C-N-CA 119.997 -1.096 . . . . 0.0 112.784 178.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.435 ' SG ' ' N ' ' A' ' 51' ' ' GLU . 44.8 t 72.34 142.04 0.06 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.444 0.64 . . . . 0.0 112.353 178.565 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 35.9 mmtp -122.88 -40.58 2.41 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.801 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.45 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 13.5 p -72.64 -38.13 67.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.771 0.32 . . . . 0.0 110.89 -178.076 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 122.97 0.29 9.78 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.134 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -92.87 14.63 16.89 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 117.078 0.439 . . . . 0.0 111.893 -179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.435 ' N ' ' SG ' ' A' ' 46' ' ' CYS . 34.6 mt-10 60.24 36.46 20.8 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.538 -0.755 . . . . 0.0 112.627 175.018 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 3.5 p -111.13 151.55 28.01 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 120.879 0.371 . . . . 0.0 111.182 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.6 p -137.76 77.79 1.65 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.928 0.394 . . . . 0.0 110.893 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 99.37 155.48 28.6 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.246 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.417 ' HG3' ' HA ' ' A' ' 38' ' ' THR . 83.3 Cg_exo -43.34 -51.72 5.62 Favored 'Trans proline' 0 N--CA 1.478 0.612 0 C-N-CA 124.1 3.2 . . . . 0.0 114.712 -177.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -62.33 -35.8 80.21 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.012 0.434 . . . . 0.0 111.555 -177.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.3 m -99.27 19.85 14.67 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.188 -178.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 53.4 t -103.62 129.61 50.93 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-O 121.143 0.496 . . . . 0.0 110.997 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -109.8 4.31 21.61 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.471 0.653 . . . . 0.0 109.79 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 5.0 m -82.14 156.72 24.34 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.373 -178.014 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.416 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -83.64 -178.7 51.99 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.01 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.1 p -79.63 -6.97 58.21 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.3 m -100.79 10.52 41.04 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.783 0.325 . . . . 0.0 110.937 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 30.8 t -84.64 164.86 18.39 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.944 0.402 . . . . 0.0 111.69 -177.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.6 m -64.16 -34.31 77.78 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.321 0.649 . . . . 0.0 112.185 -177.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.473 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 19.7 p -82.26 20.13 1.1 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.946 0.403 . . . . 0.0 111.033 -179.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.473 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 48.1 mmtm . . . . . 0 C--O 1.263 1.773 0 CA-C-O 117.863 -1.065 . . . . 0.0 110.47 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.219 0 N-CA-C 112.114 -0.394 . . . . 0.0 112.114 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.2 t -109.61 88.26 2.7 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -134.53 30.31 2.9 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 111.187 -0.765 . . . . 0.0 111.187 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -102.82 9.01 39.2 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.636 0.255 . . . . 0.0 111.42 -177.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.91 -136.52 12.89 Favored Glycine 0 N--CA 1.44 -1.079 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.261 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.535 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 23.2 pttm -91.39 135.69 33.64 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.783 0.325 . . . . 0.0 110.743 -179.31 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 175.76 152.04 9.17 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.37 -0.919 . . . . 0.0 112.476 179.486 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 66.76 -71.93 0.09 Allowed 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.636 0.774 . . . . 0.0 112.7 178.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 14.0 mptt -69.89 -32.96 71.58 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.326 -178.129 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.693 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 73.8 m -65.28 137.11 57.34 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.162 0.506 . . . . 0.0 111.138 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.665 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 44.5 p -78.0 175.13 10.37 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.017 -177.008 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.6 m -70.21 -25.44 63.41 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 175.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.558 ' HB1' ' HB2' ' A' ' 20' ' ' GLN . . . -69.95 -40.55 75.4 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.033 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.529 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 40.5 t -69.35 -25.13 64.04 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.339 0.59 . . . . 0.0 110.773 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.665 ' HG3' ' O ' ' A' ' 11' ' ' THR . 60.0 mtt180 -81.21 -2.66 49.59 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.016 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.1 m -104.68 156.34 18.07 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.506 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 8.8 pt-20 -128.12 129.92 23.63 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-O 120.779 0.323 . . . . 0.0 111.179 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.506 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 44.4 Cg_endo -67.61 169.3 52.94 Favored 'Cis proline' 0 C--N 1.351 0.706 0 C-N-CA 123.143 -1.607 . . . . 0.0 111.15 -0.686 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.529 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 26.3 t -59.07 133.84 56.46 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-O 121.159 0.504 . . . . 0.0 110.636 -177.659 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.558 ' HB2' ' HB1' ' A' ' 13' ' ' ALA . 27.4 mm-40 -97.01 12.1 33.73 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.858 -177.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.606 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 91.6 m -96.23 23.66 6.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.314 176.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -46.77 -52.44 11.45 Favored Glycine 0 C--N 1.338 0.667 0 O-C-N 123.438 0.461 . . . . 0.0 113.595 -177.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.1 p -120.97 -20.48 6.86 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 120.857 0.36 . . . . 0.0 110.989 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -114.88 81.35 1.55 Allowed 'General case' 0 CA--C 1.507 -0.696 0 CA-C-O 121.122 0.487 . . . . 0.0 110.585 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.595 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 53.6 t -95.57 143.95 26.44 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.31 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.406 ' HB2' HG21 ' A' ' 11' ' ' THR . 55.0 mt-30 -140.68 19.46 2.34 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.245 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.693 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 85.5 m -77.8 179.17 6.84 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.875 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -129.93 -135.2 3.83 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.318 -179.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.477 ' HA ' ' HA3' ' A' ' 61' ' ' GLY . 0.5 OUTLIER -89.7 -10.44 45.73 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.122 0.487 . . . . 0.0 110.639 179.461 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -94.09 36.94 3.55 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.774 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.423 ' HA ' ' SG ' ' A' ' 10' ' ' CYS . 43.0 t -112.8 135.65 53.3 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.8 t -118.89 12.59 12.92 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-O 121.012 0.434 . . . . 0.0 110.111 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.2 t -81.43 166.26 20.53 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.064 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.06 -7.74 11.29 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 120.936 0.398 . . . . 0.0 110.935 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.24 -54.79 5.41 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.411 -178.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.606 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 3.5 p -82.9 -15.99 49.25 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.797 -178.219 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.505 ' HE2' ' O ' ' A' ' 55' ' ' PRO . 87.8 tttt -75.0 100.5 4.18 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.073 0.464 . . . . 0.0 110.865 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 t -108.32 -178.77 3.69 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.047 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.1 t -161.48 150.35 15.98 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -108.3 -18.71 13.69 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -179.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.1 m -75.36 133.88 41.12 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.0 p -103.53 176.34 5.18 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 120.886 0.374 . . . . 0.0 111.685 -175.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.505 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.6 m -70.04 0.8 5.4 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.847 -178.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -86.96 -22.88 25.32 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.218 0.532 . . . . 0.0 110.095 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 158.59 153.59 6.84 Favored Glycine 0 N--CA 1.436 -1.354 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.006 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 54.1 t -74.05 136.95 43.09 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -107.74 -27.31 10.36 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -177.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.439 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 9.4 p -86.35 -31.82 21.33 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.966 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.19 2.58 33.62 Favored Glycine 0 CA--C 1.522 0.473 0 C-N-CA 120.563 -0.827 . . . . 0.0 113.599 177.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.428 ' O ' ' HE2' ' A' ' 59' ' ' LYS . 45.4 mmtm -88.64 0.25 56.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.061 0.458 . . . . 0.0 110.28 178.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 64.51 65.2 0.65 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.053 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.6 p -136.34 144.19 44.5 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.028 176.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.505 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 22.6 p -131.79 63.71 1.61 Allowed 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.205 0.526 . . . . 0.0 111.097 -179.497 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.52 159.63 10.39 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 120.831 -0.699 . . . . 0.0 111.705 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.505 ' O ' ' HE2' ' A' ' 37' ' ' LYS . 10.9 Cg_endo -54.01 -40.04 82.81 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 123.212 2.608 . . . . 0.0 113.332 -177.532 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -67.72 -37.7 82.59 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.898 0.38 . . . . 0.0 110.99 -178.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.2 t -91.49 3.31 55.28 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.948 -178.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 53.1 t -84.77 143.18 29.29 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.109 0.481 . . . . 0.0 110.979 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 50' ' ' LYS . 63.3 pttt -122.77 14.05 10.02 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.338 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 12.2 m -96.04 162.26 13.63 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.577 -178.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.481 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -96.1 -178.38 36.03 Favored Glycine 0 N--CA 1.427 -1.916 0 N-CA-C 109.946 -1.261 . . . . 0.0 109.946 175.164 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 14.1 m -75.86 25.05 0.12 Allowed 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 117.21 0.505 . . . . 0.0 111.421 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.41 ' H ' ' C ' ' A' ' 61' ' ' GLY . 17.4 m -125.76 19.22 7.91 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.521 -178.393 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.0 t -102.76 171.4 7.43 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 178.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.3 m -72.13 -22.0 61.39 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.764 0.316 . . . . 0.0 111.397 -178.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.472 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 15.1 p -91.12 26.96 2.0 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.178 0.513 . . . . 0.0 110.279 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.481 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 43.5 mmtm . . . . . 0 C--O 1.263 1.799 0 CA-C-O 117.888 -1.053 . . . . 0.0 111.17 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.512 0 N-CA-C 112.378 -0.289 . . . . 0.0 112.378 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.5 m -104.41 -30.69 9.91 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.052 0.453 . . . . 0.0 110.66 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -157.73 133.14 3.41 Favored Glycine 0 N--CA 1.439 -1.149 0 N-CA-C 111.289 -0.724 . . . . 0.0 111.289 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.4 mtmt -90.89 105.2 17.66 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.554 0.216 . . . . 0.0 111.013 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -91.57 10.06 75.61 Favored Glycine 0 C--N 1.318 -0.455 0 C-N-CA 120.597 -0.811 . . . . 0.0 111.411 177.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.705 ' HD2' ' SG ' ' A' ' 10' ' ' CYS . 39.1 pttt -142.69 -168.13 2.68 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 122.639 0.376 . . . . 0.0 110.048 -179.315 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -135.49 -145.48 5.13 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 119.801 -1.19 . . . . 0.0 113.794 -176.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -86.83 13.57 8.69 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -177.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.561 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 31.2 mmtp -87.94 -6.18 58.17 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.0 0.428 . . . . 0.0 110.172 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.705 ' SG ' ' HD2' ' A' ' 6' ' ' LYS . 64.2 m -78.46 157.01 29.06 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.151 178.554 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.4 p -96.1 168.4 10.63 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.777 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.6 m -71.24 -16.89 62.51 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.443 0.64 . . . . 0.0 109.537 175.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.67 -38.36 47.82 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.259 178.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.524 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 50.5 t -71.85 -28.42 63.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.715 179.247 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 48.2 mtp180 -82.39 9.19 9.55 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.032 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.5 m -108.06 157.57 18.14 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -127.83 121.95 22.22 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.651 0.263 . . . . 0.0 110.996 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.35 175.31 44.19 Favored 'Cis proline' 0 C--N 1.351 0.663 0 C-N-CA 123.246 -1.564 . . . . 0.0 112.048 0.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 20.0 t -61.85 129.91 43.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.082 0.468 . . . . 0.0 110.526 -178.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.0 mm-40 -102.83 11.02 38.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.958 -177.253 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.524 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 87.0 m -76.72 2.97 12.77 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.523 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -56.65 103.38 0.26 Allowed Glycine 0 CA--C 1.518 0.223 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.385 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.5 t 64.33 24.0 13.17 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.481 0.657 . . . . 0.0 110.68 -179.431 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -144.9 14.55 1.52 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.514 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.489 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 46.4 t -70.11 141.26 52.76 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.07 -175.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -138.65 11.75 2.71 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.172 178.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 64.3 m -63.9 139.86 58.81 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.381 -178.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -81.67 -171.85 46.21 Favored Glycine 0 N--CA 1.44 -1.08 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.89 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.93 17.28 0.34 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.223 0.535 . . . . 0.0 112.214 -178.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -116.04 37.0 3.58 Favored Glycine 0 N--CA 1.439 -1.106 0 N-CA-C 111.508 -0.637 . . . . 0.0 111.508 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.7 t -123.12 156.77 34.33 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 t -131.06 7.23 4.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.331 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 16.5 t -76.81 116.02 17.11 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.07 -3.91 25.77 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.295 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -81.68 -13.48 57.82 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.643 -179.25 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.516 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 6.3 p -134.38 -31.35 1.09 Allowed 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -177.265 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -91.51 115.3 27.92 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.441 -0.503 . . . . 0.0 109.781 -177.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.57 164.93 12.06 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.381 -176.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 39.2 t -160.21 159.03 31.06 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.773 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.4 m-80 -123.81 -6.91 7.92 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 95.0 m -73.12 157.78 36.59 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.835 178.123 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 23.8 p -126.47 -177.36 3.96 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.679 -0.692 . . . . 0.0 111.728 -174.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.1 m -70.88 -1.47 11.88 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.002 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -59.04 -26.48 64.63 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.08 176.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 125.18 42.65 0.32 Allowed Glycine 0 CA--C 1.501 -0.843 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.232 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 48.3 t 69.1 138.96 0.04 OUTLIER 'General case' 0 C--N 1.341 0.207 0 C-N-CA 123.051 0.541 . . . . 0.0 110.395 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.4 mtpt -123.19 1.76 9.15 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.375 -177.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.538 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 2.8 p -111.65 -40.92 4.19 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.023 0.44 . . . . 0.0 110.015 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 119.96 14.63 5.52 Favored Glycine 0 CA--C 1.525 0.681 0 C-N-CA 120.811 -0.709 . . . . 0.0 113.228 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.697 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.3 mmtt -102.18 5.14 40.08 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 117.198 0.499 . . . . 0.0 110.778 178.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.445 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 17.7 tt0 70.93 16.82 6.45 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.387 0.675 . . . . 0.0 110.793 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.492 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 25.9 p -93.59 143.55 26.2 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 120.975 0.417 . . . . 0.0 110.514 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.3 p -124.2 31.78 5.7 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.283 0.563 . . . . 0.0 110.749 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 140.86 171.88 12.74 Favored Glycine 0 N--CA 1.441 -0.972 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 -177.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.55 -29.61 85.54 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.893 2.395 . . . . 0.0 112.628 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -62.57 -37.5 86.43 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.854 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 12.1 m -113.04 3.66 16.27 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -176.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.492 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 48.5 t -74.82 135.22 41.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.787 0.327 . . . . 0.0 110.629 -179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 17.1 ttpp -136.22 33.48 2.82 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.671 -177.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.697 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 2.7 m -96.32 -179.05 4.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.015 0.436 . . . . 0.0 110.05 176.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -99.55 -143.41 14.51 Favored Glycine 0 N--CA 1.432 -1.57 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 174.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.9 p -91.62 -28.77 17.29 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 116.923 0.361 . . . . 0.0 111.205 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.8 m -87.71 67.5 9.22 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -176.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 7.1 t -142.76 155.06 44.79 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.207 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.0 m -70.1 -24.35 63.19 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -175.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.462 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 17.5 p -86.03 7.84 22.95 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.939 0.4 . . . . 0.0 111.191 -178.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.462 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 47.3 mmtm . . . . . 0 C--O 1.262 1.741 0 CA-C-O 117.56 -1.209 . . . . 0.0 111.144 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.293 0 N-CA-C 112.289 -0.324 . . . . 0.0 112.289 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.6 m -128.57 149.32 50.67 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -85.66 -31.35 21.63 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.28 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.507 ' HB2' ' HB ' ' A' ' 32' ' ' THR . 66.3 mttm -89.19 152.02 21.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.94 0.4 . . . . 0.0 111.411 -179.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -105.63 109.87 3.31 Favored Glycine 0 N--CA 1.442 -0.96 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 177.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.741 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 21.2 ptmt -102.09 169.51 8.7 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 120.507 0.194 . . . . 0.0 110.668 -178.517 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 132.07 -47.26 1.02 Allowed Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.313 -0.946 . . . . 0.0 113.754 177.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -88.0 -42.62 12.32 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.057 0.456 . . . . 0.0 111.71 -176.28 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 31.4 mmtp -83.41 -17.48 42.05 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 121.066 0.46 . . . . 0.0 110.165 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.741 ' SG ' ' HB2' ' A' ' 6' ' ' LYS . 66.3 m -73.43 150.95 41.32 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.041 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 46.9 p -87.11 167.28 14.32 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.744 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.9 m -63.93 -27.26 69.02 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 177.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.68 -43.08 76.89 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.458 178.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.494 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 44.0 t -69.83 -34.9 74.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.921 0.391 . . . . 0.0 110.301 178.163 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -70.31 -14.37 62.56 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.199 179.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.5 m -81.72 151.1 27.66 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.404 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 7.9 pt-20 -129.64 123.22 21.1 Favored Pre-proline 0 C--N 1.313 -1.012 0 CA-C-O 120.726 0.298 . . . . 0.0 111.508 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.404 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 55.4 Cg_endo -69.2 167.56 68.95 Favored 'Cis proline' 0 C--O 1.242 0.687 0 C-N-CA 123.314 -1.536 . . . . 0.0 111.805 -1.097 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.494 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 49.7 t -52.77 147.08 9.39 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.06 0.457 . . . . 0.0 111.947 -177.508 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -124.33 15.8 9.01 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.942 -178.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 67.5 m -69.0 -77.34 0.08 Allowed 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.751 0.31 . . . . 0.0 111.625 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 63.7 -106.9 1.52 Allowed Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.501 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.3 m -97.92 -1.18 43.44 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 120.976 0.417 . . . . 0.0 110.847 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -106.37 27.22 8.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.621 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 47.6 t -73.98 142.77 45.82 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.233 0.539 . . . . 0.0 112.224 -177.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -148.79 25.0 0.95 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.164 -0.926 . . . . 0.0 109.964 178.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.621 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 67.7 m -72.27 -175.33 1.52 Allowed 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.109 0.48 . . . . 0.0 111.909 -178.579 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -117.61 -172.75 16.06 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.757 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -70.86 -12.28 61.45 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 122.858 0.463 . . . . 0.0 111.576 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -96.34 20.06 51.92 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.628 -178.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.0 t -93.49 140.7 29.29 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.075 0.464 . . . . 0.0 110.327 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.507 ' HB ' ' HB2' ' A' ' 4' ' ' LYS . 11.0 t -122.3 17.9 10.64 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.129 -178.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.457 ' SG ' ' HB3' ' A' ' 35' ' ' ALA . 45.0 t -87.67 117.61 26.61 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.78 -11.72 60.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.341 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.457 ' HB3' ' SG ' ' A' ' 33' ' ' CYS . . . -66.15 -45.37 81.23 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.019 179.514 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.463 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 6.1 p -106.34 -17.96 14.13 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.419 ' HD3' ' O ' ' A' ' 55' ' ' PRO . 21.4 ttmm -63.49 107.02 1.03 Allowed 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 178.415 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.2 t -127.08 152.62 47.04 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 120.819 0.342 . . . . 0.0 110.997 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.438 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 19.8 t -154.26 144.9 22.38 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.591 178.07 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -98.18 -26.29 14.61 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -178.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 74.7 m -67.96 144.17 55.31 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 177.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 26.8 p -123.09 -172.2 2.45 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.847 -176.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.0 m -70.4 -8.14 48.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.169 0.509 . . . . 0.0 110.575 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -67.09 -28.7 68.39 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.654 175.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.75 157.67 7.27 Favored Glycine 0 N--CA 1.439 -1.165 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.989 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.4 ' SG ' ' N ' ' A' ' 51' ' ' GLU . 42.9 t -74.26 139.13 44.09 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.341 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -127.15 -3.82 6.28 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -178.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.432 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 12.3 p -97.6 -29.67 13.3 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.49 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.44 9.01 18.24 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 120.4 -0.905 . . . . 0.0 113.584 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.732 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 47.0 mmtm -98.55 -1.08 41.93 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 117.352 0.576 . . . . 0.0 111.264 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.4 ' N ' ' SG ' ' A' ' 46' ' ' CYS . 48.5 mt-10 66.43 22.67 10.68 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.153 0.581 . . . . 0.0 111.1 -177.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 27.2 p -95.2 142.16 27.96 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.95 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.1 p -121.91 33.93 5.34 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-O 121.282 0.563 . . . . 0.0 110.593 -179.404 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 144.07 170.61 13.63 Favored Glycine 0 N--CA 1.435 -1.395 0 C-N-CA 120.762 -0.733 . . . . 0.0 111.33 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.438 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 28.6 Cg_endo -62.93 -15.69 49.18 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.834 2.356 . . . . 0.0 112.728 -178.213 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -66.78 -45.32 78.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.862 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.7 m -113.01 16.7 19.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.057 0.456 . . . . 0.0 110.769 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.47 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 38.9 t -77.82 122.44 25.44 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -124.43 18.03 8.94 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.478 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.732 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 8.3 m -68.58 147.19 52.3 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.218 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -82.29 43.15 2.98 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 120.818 -0.706 . . . . 0.0 113.231 -178.263 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.6 m 69.09 -48.89 0.59 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.957 0.903 . . . . 0.0 113.033 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.1 t -76.01 76.39 2.88 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.081 0.467 . . . . 0.0 110.18 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.9 t -140.01 170.53 15.69 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.056 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.2 t -76.3 -30.52 57.78 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.322 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.51 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 7.8 p -84.26 17.62 2.48 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 120.96 0.409 . . . . 0.0 111.323 -178.195 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.51 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 48.6 mmtm . . . . . 0 C--O 1.256 1.409 0 CA-C-O 117.735 -1.126 . . . . 0.0 110.921 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.443 0 N-CA-C 112.317 -0.313 . . . . 0.0 112.317 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.0 m -95.34 -2.86 48.35 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.852 0.358 . . . . 0.0 111.19 -178.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -85.36 76.98 2.13 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.949 -0.644 . . . . 0.0 111.852 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -94.27 -28.96 15.31 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.987 0.423 . . . . 0.0 110.374 -179.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.96 165.27 18.71 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.105 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.662 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 21.6 ptmt -66.82 143.75 56.7 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.883 0.373 . . . . 0.0 111.147 -179.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 159.97 -76.81 0.19 Allowed Glycine 0 N--CA 1.442 -0.944 0 C-N-CA 120.251 -0.976 . . . . 0.0 112.923 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -58.76 -30.9 67.88 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -176.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.452 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 71.2 mmtt -102.98 -0.95 30.16 Favored 'General case' 0 C--N 1.31 -1.121 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.621 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.662 ' SG ' ' HB2' ' A' ' 6' ' ' LYS . 94.2 m -97.23 159.24 15.03 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 121.298 0.57 . . . . 0.0 111.539 -178.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.487 HG21 ' H ' ' A' ' 26' ' ' GLN . 41.9 p -93.55 -178.67 4.79 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.498 -176.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.0 m -80.44 -20.84 42.92 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.308 0.575 . . . . 0.0 109.676 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.2 -35.83 48.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.859 179.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.463 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 43.9 t -71.67 -13.67 61.81 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.712 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.473 ' HG2' ' O ' ' A' ' 11' ' ' THR . 12.5 mmt180 -72.24 -20.59 61.52 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.812 179.388 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.437 ' HB2' ' HG2' ' A' ' 20' ' ' GLN . 37.2 m -91.72 164.78 13.6 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -175.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.431 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 14.1 pt-20 -140.84 118.04 7.83 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.506 177.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.431 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 13.1 Cg_exo -66.69 171.45 39.7 Favored 'Cis proline' 0 C--N 1.352 0.732 0 C-N-CA 123.1 -1.625 . . . . 0.0 112.033 0.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.463 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 13.7 t -66.28 150.07 49.38 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.854 -175.529 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.437 ' HG2' ' HB2' ' A' ' 16' ' ' SER . 29.1 mm-40 -113.89 7.06 16.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.489 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.425 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 78.4 m -68.12 -75.61 0.1 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.699 0.285 . . . . 0.0 111.22 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 65.91 -109.23 2.77 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.586 -0.816 . . . . 0.0 111.418 -177.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.5 t -95.19 -17.96 21.3 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.456 0.646 . . . . 0.0 109.28 178.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -92.71 55.93 2.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.94 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 48.1 t -103.06 143.86 32.04 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.701 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.487 ' H ' HG21 ' A' ' 11' ' ' THR . 28.8 mm-40 -139.41 17.45 2.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.084 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 76.3 m -70.61 148.21 48.37 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.144 0.497 . . . . 0.0 111.928 -177.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -98.98 -160.63 29.55 Favored Glycine 0 N--CA 1.441 -1.019 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.552 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -73.28 -4.89 36.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.851 0.358 . . . . 0.0 111.781 -178.343 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -93.37 22.89 32.6 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.99 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.0 t -115.69 149.48 38.33 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.901 0.382 . . . . 0.0 110.919 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.2 t -133.62 12.58 4.08 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.138 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 37.8 t -72.51 119.96 17.45 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.222 0.534 . . . . 0.0 110.436 -178.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.11 -0.54 22.31 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.607 -178.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.78 -29.26 23.97 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.503 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.425 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 7.6 p -119.88 -26.12 5.69 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -83.29 107.05 15.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.987 0.422 . . . . 0.0 110.361 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.0 t -114.82 175.73 5.36 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.237 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 45.0 t -156.64 154.26 29.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.287 -178.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -114.6 -12.91 12.18 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 81.6 m -77.38 127.66 32.93 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 174.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 70.6 p -93.36 173.67 7.59 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.711 -172.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.537 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.7 m -66.94 -2.6 5.47 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.099 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -80.69 -36.45 32.3 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.987 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 168.09 151.58 7.14 Favored Glycine 0 N--CA 1.442 -0.945 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.669 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.7 t -78.59 138.87 38.57 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 122.48 0.312 . . . . 0.0 110.421 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -129.06 2.16 5.26 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 4.3 p -93.94 -37.68 11.57 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.006 -0.678 . . . . 0.0 109.737 177.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 124.32 -4.35 8.86 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.831 -0.699 . . . . 0.0 113.294 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.811 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 43.0 mmtm -87.62 -1.54 58.02 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 117.384 0.592 . . . . 0.0 111.527 -178.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 63.96 36.93 9.72 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.992 0.901 . . . . 0.0 109.865 -178.011 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 28.6 p -108.84 141.26 41.13 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.443 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.537 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 36.1 p -131.13 79.98 1.92 Allowed 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 177.458 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 105.72 159.9 22.83 Favored Glycine 0 N--CA 1.437 -1.263 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.468 -177.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -52.21 -31.15 44.64 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 123.437 2.758 . . . . 0.0 113.806 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -63.95 -44.44 92.82 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.988 0.423 . . . . 0.0 111.602 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.534 ' HB2' ' H ' ' A' ' 53' ' ' THR . 19.5 m -89.62 -12.66 39.06 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.691 -178.251 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 49.0 t -68.05 131.56 45.67 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.948 -177.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -118.13 14.96 14.09 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.592 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.811 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.8 m -103.34 164.41 11.66 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.278 -176.019 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -96.85 -166.3 33.11 Favored Glycine 0 N--CA 1.439 -1.121 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 177.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.6 m -85.1 25.24 0.99 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 117.106 0.453 . . . . 0.0 111.312 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.5 m -131.48 20.08 4.75 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 120.739 0.304 . . . . 0.0 111.638 -178.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' CYS . . . . . 0.423 ' SG ' ' N ' ' A' ' 65' ' ' SER . 46.0 t -99.68 171.26 8.01 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.79 0.329 . . . . 0.0 110.953 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.423 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 51.0 m -60.89 -34.51 74.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.556 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.448 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 31.9 p -82.89 21.84 0.99 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 120.969 0.414 . . . . 0.0 111.104 -179.321 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.448 ' HD3' ' O ' ' A' ' 66' ' ' CYS . 54.8 mmtt . . . . . 0 C--O 1.261 1.672 0 CA-C-O 117.494 -1.241 . . . . 0.0 110.061 178.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.432 0 N-CA-C 112.211 -0.355 . . . . 0.0 112.211 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.7 m -63.01 142.67 58.29 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 178.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -61.4 121.47 26.29 Favored Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 120.657 -0.782 . . . . 0.0 111.323 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.9 ttpm? 63.14 46.45 4.62 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.356 0.598 . . . . 0.0 110.522 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -71.2 -38.8 63.06 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 177.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.648 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 48.7 mtmt -139.68 105.98 5.27 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 175.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -81.75 -161.77 28.63 Favored Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 115.925 -0.58 . . . . 0.0 114.269 -174.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.2 mp0 -80.39 -12.42 59.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.093 0.473 . . . . 0.0 110.575 -178.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -83.01 0.81 43.03 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.465 -177.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.6 m -72.85 160.53 32.0 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.402 0.62 . . . . 0.0 111.494 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.501 HG21 ' HB2' ' A' ' 26' ' ' GLN . 77.6 p -97.47 170.13 9.26 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.906 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.8 m -64.77 -26.22 68.26 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.11 0.481 . . . . 0.0 109.971 177.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.82 -48.21 72.47 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.597 177.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.648 ' SG ' ' HD2' ' A' ' 6' ' ' LYS . 42.1 t -73.56 -24.66 60.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.044 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -79.57 -1.81 39.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.011 0.434 . . . . 0.0 111.424 179.187 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.3 m -105.35 150.0 25.59 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 176.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.406 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 10.7 pt-20 -119.09 129.8 25.19 Favored Pre-proline 0 C--N 1.322 -0.594 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.926 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.406 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 4.9 Cg_exo -72.45 175.04 45.57 Favored 'Cis proline' 0 C--O 1.236 0.395 0 C-N-CA 123.231 -1.571 . . . . 0.0 111.482 -0.195 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.9 t -55.39 135.33 50.35 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.009 0.433 . . . . 0.0 111.06 -178.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -110.55 20.11 18.03 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.694 -177.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.441 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 81.8 m -87.7 27.45 1.13 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.859 0.362 . . . . 0.0 110.695 178.577 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.98 -42.08 99.64 Favored Glycine 0 CA--C 1.52 0.389 0 CA-C-N 116.1 -0.5 . . . . 0.0 113.224 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.3 p -128.96 15.76 6.29 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.969 0.414 . . . . 0.0 111.125 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -162.16 101.28 1.1 Allowed 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.91 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 53.7 t -120.75 121.16 37.62 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-O 120.926 0.394 . . . . 0.0 109.952 177.473 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.501 ' HB2' HG21 ' A' ' 11' ' ' THR . 82.9 mt-30 -129.63 19.22 5.68 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.104 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.542 ' O ' ' HB2' ' A' ' 62' ' ' SER . 70.8 m -64.93 134.11 53.26 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.334 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.97 -91.42 0.37 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.822 -177.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -139.25 159.53 41.94 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 84.11 26.07 42.1 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 110.761 -0.936 . . . . 0.0 110.761 -177.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.8 t -124.08 132.85 53.71 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.207 -0.497 . . . . 0.0 110.263 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.2 t -165.55 71.87 0.16 Allowed 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.492 0.663 . . . . 0.0 111.171 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.42 ' SG ' ' HB3' ' A' ' 35' ' ' ALA . 10.4 p -101.23 8.82 42.37 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 121.241 0.543 . . . . 0.0 110.318 178.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 69.4 -16.87 0.24 Allowed 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 114.797 -1.092 . . . . 0.0 113.43 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.42 ' HB3' ' SG ' ' A' ' 33' ' ' CYS . . . -76.78 -54.07 7.1 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -178.006 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.441 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 26.9 p -92.74 -25.2 18.3 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.885 0.374 . . . . 0.0 110.925 -179.499 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -49.09 113.17 0.74 Allowed 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.424 -178.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.5 t -124.68 165.12 18.48 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.448 -178.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.7 t -162.58 139.47 7.84 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -98.8 -10.05 23.55 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.725 0.297 . . . . 0.0 111.478 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 70.8 m -74.33 139.41 44.14 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 177.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 76.8 p -112.07 -174.09 2.39 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.578 -176.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.1 m -70.5 3.73 2.84 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.127 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -58.63 -36.71 74.51 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.148 0.499 . . . . 0.0 109.71 176.007 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 132.04 40.61 0.21 Allowed Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.257 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 43.2 t 71.47 148.01 0.08 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.98 0.512 . . . . 0.0 111.37 -178.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -126.59 -16.36 5.32 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.887 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.5 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 14.4 p -95.45 -36.06 11.47 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.464 -0.494 . . . . 0.0 111.503 -177.455 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.31 -3.86 20.18 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.215 -0.993 . . . . 0.0 112.908 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.482 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 76.0 mmtt -82.67 -4.5 57.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.911 0.386 . . . . 0.0 110.042 178.624 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 67.08 67.91 0.41 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.298 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.4 p -139.34 154.76 47.94 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.265 178.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.3 p -139.59 81.47 1.83 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.819 0.342 . . . . 0.0 111.18 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 98.58 160.46 29.97 Favored Glycine 0 C--N 1.315 -0.637 0 C-N-CA 120.548 -0.834 . . . . 0.0 112.03 178.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -56.98 -36.79 99.41 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.047 2.498 . . . . 0.0 112.655 -178.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -75.45 -11.5 60.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.198 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.6 m -129.05 25.93 5.52 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.121 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.488 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 47.1 t -103.34 150.91 23.33 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.423 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -121.15 -9.22 9.18 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-O 121.886 0.85 . . . . 0.0 108.726 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.9 m -86.32 144.17 27.51 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 114.645 -1.161 . . . . 0.0 111.511 -174.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -80.97 176.86 54.57 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.542 ' HB2' ' O ' ' A' ' 27' ' ' CYS . 18.2 m -66.4 -7.14 17.3 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 117.016 0.408 . . . . 0.0 111.778 -178.262 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.3 m -100.56 35.98 2.01 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.333 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 22.7 t -112.53 174.27 5.97 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 120.761 0.315 . . . . 0.0 111.081 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.0 m -71.43 -25.19 62.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.69 -178.389 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.5 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 32.1 p -87.02 16.91 4.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.822 0.344 . . . . 0.0 111.043 -179.186 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.488 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 53.8 mmtt . . . . . 0 C--O 1.257 1.452 0 CA-C-O 117.525 -1.226 . . . . 0.0 110.763 -179.214 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.243 0 N-CA-C 112.042 -0.423 . . . . 0.0 112.042 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.4 m -105.03 102.35 11.85 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 120.991 0.424 . . . . 0.0 110.624 179.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 83.16 -12.28 50.95 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.023 -0.608 . . . . 0.0 113.035 178.388 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -92.02 117.66 30.04 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 122.662 -0.316 . . . . 0.0 111.224 -179.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -108.7 -135.23 7.39 Favored Glycine 0 N--CA 1.442 -0.96 0 N-CA-C 110.734 -0.947 . . . . 0.0 110.734 177.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 92.0 mttt 62.34 90.7 0.07 Allowed 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 122.861 0.464 . . . . 0.0 111.442 178.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -91.55 60.32 2.89 Favored Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 121.197 -0.525 . . . . 0.0 112.623 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 69.52 -65.83 0.29 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.767 0.827 . . . . 0.0 111.904 178.086 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -109.66 77.69 1.08 Allowed 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.52 0.676 . . . . 0.0 110.642 -177.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.3 m -117.6 156.32 28.33 Favored 'General case' 0 C--N 1.273 -2.751 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.198 177.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.607 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 82.2 p -83.46 175.1 10.06 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.054 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.2 m -76.91 -16.39 59.4 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 176.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.58 -42.91 40.87 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.558 178.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 50.0 t -69.37 -27.72 65.57 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.186 0.517 . . . . 0.0 110.223 178.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.607 ' HG3' ' O ' ' A' ' 11' ' ' THR . 37.6 mtt180 -85.46 1.86 47.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.392 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.7 t -94.33 161.68 14.14 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.416 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 8.0 pt-20 -122.28 115.94 29.9 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-O 120.537 0.208 . . . . 0.0 110.646 179.13 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 3.8 Cg_exo -79.14 -178.09 22.74 Favored 'Cis proline' 0 C--N 1.351 0.664 0 C-N-CA 124.068 -1.222 . . . . 0.0 111.717 -0.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.7 t -58.81 123.43 16.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.017 0.436 . . . . 0.0 110.001 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -101.07 18.76 18.93 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.655 -176.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.422 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 72.7 m -83.33 9.4 11.0 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -178.619 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.83 -36.95 93.96 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.507 -0.854 . . . . 0.0 111.224 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.7 m -97.85 -32.84 11.49 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 120.592 0.234 . . . . 0.0 111.324 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 9.5 ptpp? -139.04 103.75 4.86 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.14 0.495 . . . . 0.0 111.673 -178.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 44.5 t -112.39 114.88 27.83 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-O 121.2 0.524 . . . . 0.0 109.801 176.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.417 ' H ' HG21 ' A' ' 11' ' ' THR . 97.5 mt-30 -127.39 22.97 6.44 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.461 -177.634 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 98.2 m -61.31 157.62 16.14 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.666 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.33 -101.92 1.29 Allowed Glycine 0 N--CA 1.437 -1.269 0 C-N-CA 120.587 -0.816 . . . . 0.0 115.115 -174.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.576 ' HG3' ' H ' ' A' ' 30' ' ' GLY . 5.4 pt-20 -105.71 -84.34 0.5 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -172.212 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.576 ' H ' ' HG3' ' A' ' 29' ' ' GLU . . . -83.99 66.76 3.84 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 121.003 -0.617 . . . . 0.0 113.909 -175.127 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.1 t -74.43 139.49 44.02 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 176.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.7 t -112.39 14.75 20.4 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 121.298 0.57 . . . . 0.0 110.93 -176.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 43.7 t -96.16 148.83 22.3 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.697 178.302 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.9 5.94 26.84 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.869 0.366 . . . . 0.0 110.815 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -84.86 -44.91 12.79 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.035 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.422 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 6.0 p -101.47 -5.02 25.79 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.867 -178.247 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -81.85 115.63 21.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.868 0.366 . . . . 0.0 110.32 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 t -126.46 171.67 10.84 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.836 -179.439 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.402 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 48.0 t -155.95 148.5 23.85 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -179.443 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -109.65 -12.47 14.65 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -178.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 73.9 m -79.17 133.99 36.71 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.018 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.8 p -100.34 176.31 5.41 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-O 120.838 0.351 . . . . 0.0 111.514 -175.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.585 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 50.2 m -74.33 6.56 3.52 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.259 0.552 . . . . 0.0 110.899 178.694 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -85.84 -30.02 23.28 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.519 176.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 161.2 151.5 6.27 Favored Glycine 0 N--CA 1.437 -1.285 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.74 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.3 t -72.38 143.38 48.6 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -121.63 -25.72 5.05 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.471 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 8.1 p -77.97 -34.68 50.85 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.923 -177.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.76 -0.49 27.43 Favored Glycine 0 CA--C 1.523 0.565 0 C-N-CA 120.535 -0.84 . . . . 0.0 113.023 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -90.2 0.08 57.36 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.917 0.358 . . . . 0.0 110.729 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 64.38 62.72 0.8 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.966 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.9 p -134.43 154.97 51.11 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.412 176.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.585 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 19.3 p -137.7 51.13 1.92 Allowed 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.396 0.617 . . . . 0.0 110.78 -178.441 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 128.12 164.9 11.7 Favored Glycine 0 N--CA 1.439 -1.114 0 C-N-CA 120.838 -0.696 . . . . 0.0 111.363 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.402 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 16.8 Cg_endo -57.77 -20.85 45.17 Favored 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 122.968 2.445 . . . . 0.0 113.632 -178.022 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -74.42 -41.85 60.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.902 0.382 . . . . 0.0 111.168 -179.515 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.7 p -98.29 1.08 46.79 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.173 0.511 . . . . 0.0 111.104 -178.657 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 43.4 t -86.03 129.9 34.7 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.943 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -117.96 7.18 12.25 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.799 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 5.6 m -75.14 154.7 37.62 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.813 -178.01 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -84.07 -156.05 22.88 Favored Glycine 0 N--CA 1.441 -1.0 0 C-N-CA 120.81 -0.709 . . . . 0.0 111.838 178.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 p -86.89 -8.81 56.92 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 120.745 0.307 . . . . 0.0 111.704 -178.321 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.7 m -115.37 60.34 0.7 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.133 0.492 . . . . 0.0 111.533 -177.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' CYS . . . . . 0.443 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 39.6 t -126.19 167.65 15.14 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.815 177.497 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 31.8 t -61.76 -32.77 73.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.388 -178.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.471 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 27.3 p -88.56 22.27 2.64 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 120.799 0.333 . . . . 0.0 111.404 -178.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.443 ' HG2' ' HB3' ' A' ' 64' ' ' CYS . 52.4 mmtt . . . . . 0 C--O 1.257 1.493 0 CA-C-O 117.458 -1.258 . . . . 0.0 110.778 178.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.472 0 N-CA-C 112.089 -0.404 . . . . 0.0 112.089 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.7 m -116.1 25.35 10.74 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.393 0.615 . . . . 0.0 109.693 179.195 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 135.54 155.72 7.37 Favored Glycine 0 N--CA 1.44 -1.086 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.21 -178.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -107.93 99.76 9.18 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-O 121.004 0.43 . . . . 0.0 110.944 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.406 ' O ' ' HB2' ' A' ' 6' ' ' LYS . . . -90.91 -14.89 57.29 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 111.406 -0.678 . . . . 0.0 111.406 179.006 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.411 ' NZ ' ' SG ' ' A' ' 14' ' ' CYS . 31.6 mtmt 74.04 -71.57 0.13 Allowed 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.586 0.754 . . . . 0.0 112.287 178.604 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -153.71 168.08 32.18 Favored Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.375 -0.917 . . . . 0.0 112.527 -179.347 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -78.44 -21.07 49.69 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.099 0.476 . . . . 0.0 110.173 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.486 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 5.9 tmtt? -74.24 -17.49 60.87 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.734 177.133 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.485 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 62.8 m -65.39 147.31 53.65 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.676 178.364 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.594 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 68.4 p -88.86 171.07 10.19 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.851 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.0 m -67.21 -26.87 66.82 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.393 0.616 . . . . 0.0 109.604 176.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.421 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . . . -69.82 -40.2 76.05 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.352 -179.605 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.411 ' SG ' ' NZ ' ' A' ' 6' ' ' LYS . 50.4 t -74.36 -20.63 60.02 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.361 0.601 . . . . 0.0 110.518 179.501 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.594 ' HG3' ' O ' ' A' ' 11' ' ' THR . 62.4 mtt180 -84.29 0.92 47.21 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.206 0.526 . . . . 0.0 109.948 178.579 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.2 m -102.78 159.06 15.81 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.493 178.454 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -128.8 124.38 22.51 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-O 120.7 0.286 . . . . 0.0 111.317 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.22 -178.65 21.11 Favored 'Cis proline' 0 C--N 1.351 0.679 0 C-N-CA 123.283 -1.549 . . . . 0.0 111.618 -1.04 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.9 t -61.72 135.31 57.56 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 120.887 0.375 . . . . 0.0 110.697 -178.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.3 mm-40 -112.08 16.96 19.99 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.802 -177.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.439 ' HB3' ' HB2' ' A' ' 25' ' ' CYS . 93.2 m -86.51 26.08 1.13 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -177.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.46 -42.99 99.23 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 120.527 -0.844 . . . . 0.0 111.602 178.264 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.5 p -139.39 20.04 2.57 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.308 0.575 . . . . 0.0 110.321 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 57.3 mttm -131.67 31.13 4.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.815 -177.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.439 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 18.1 t -91.82 145.63 24.41 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -174.354 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -156.81 16.72 0.3 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.192 178.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.486 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 99.6 m -64.99 164.15 13.28 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -176.322 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -146.3 -145.0 4.16 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 114.965 -1.016 . . . . 0.0 111.346 -179.239 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -68.02 154.14 42.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.12 0.46 . . . . 0.0 110.324 177.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.55 -33.8 5.6 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -174.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 24.0 t -74.24 147.78 42.13 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 t -145.12 27.19 1.29 Allowed 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.5 0.667 . . . . 0.0 109.762 -178.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 47.6 t -94.86 119.47 33.48 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.26 -176.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.24 -7.72 48.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.709 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.18 -27.46 60.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.663 -0.244 . . . . 0.0 111.456 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 10.1 p -134.64 11.47 3.72 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 112.33 0.492 . . . . 0.0 112.33 -177.392 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.0 mmtp -91.09 138.71 31.39 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.83 133.32 37.7 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.97 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 27.3 t -150.88 145.51 25.7 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.198 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -101.63 -19.75 15.31 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 121.018 -0.273 . . . . 0.0 111.732 179.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 74.0 m -74.39 133.3 42.48 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.8 p -109.89 -173.77 2.33 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.048 -175.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.4 m -69.66 -14.69 62.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.438 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.68 -40.06 95.9 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.916 177.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 164.07 155.2 8.17 Favored Glycine 0 N--CA 1.43 -1.759 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.42 179.477 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 47.0 t -77.49 130.43 36.98 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 178.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -105.68 -26.52 11.78 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.552 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 8.3 p -78.89 -40.99 30.8 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.744 -177.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.91 12.82 10.79 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.045 178.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.476 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 74.8 mmtt -95.67 3.75 53.66 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.989 0.394 . . . . 0.0 110.549 178.321 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 34.0 tt0 66.12 29.64 9.78 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.929 178.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.5 p -102.19 150.99 22.73 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.564 178.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.8 p -141.11 66.05 1.38 Allowed 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.425 0.631 . . . . 0.0 110.255 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 121.24 154.52 9.27 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.563 179.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -53.65 -31.66 61.21 Favored 'Trans proline' 0 N--CA 1.48 0.728 0 C-N-CA 124.146 3.231 . . . . 0.0 115.039 -176.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -69.13 -41.89 76.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.866 0.365 . . . . 0.0 111.191 -178.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.6 m -96.69 0.02 49.03 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.804 -177.341 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.462 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 14.9 t -92.24 126.15 37.2 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.082 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -119.41 14.23 12.82 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.557 177.513 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 20.7 m -69.61 150.23 47.28 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.36 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -69.59 164.88 50.68 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.389 -179.313 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.8 p -72.93 -3.3 25.0 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.202 0.525 . . . . 0.0 111.606 -178.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.2 t -111.94 13.01 20.81 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.294 0.568 . . . . 0.0 109.78 178.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 65' ' ' SER . 47.1 t -73.85 169.72 16.81 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.828 -177.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.401 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 8.6 m -63.89 -34.49 78.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.789 -178.092 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.552 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 21.6 p -87.43 25.11 1.48 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.713 0.292 . . . . 0.0 111.324 -178.471 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.462 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 61.1 mmtt . . . . . 0 C--O 1.271 2.195 0 CA-C-O 118.087 -0.959 . . . . 0.0 110.866 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.19 0 CA-C-O 120.894 0.163 . . . . 0.0 112.811 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.6 p -78.34 119.83 22.23 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.907 0.384 . . . . 0.0 111.107 -179.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 122.13 4.47 9.28 Favored Glycine 0 N--CA 1.442 -0.933 0 C-N-CA 120.216 -0.992 . . . . 0.0 112.678 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -79.03 104.18 9.48 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 177.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 126.42 132.85 3.76 Favored Glycine 0 N--CA 1.436 -1.359 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.034 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.84 -23.03 20.68 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 120.801 0.334 . . . . 0.0 110.242 178.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.901 ' HA2' ' SG ' ' A' ' 10' ' ' CYS . . . -94.75 85.45 0.99 Allowed Glycine 0 N--CA 1.441 -0.983 0 C-N-CA 120.943 -0.646 . . . . 0.0 114.032 -175.707 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -86.29 -46.83 9.95 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 176.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -138.49 24.65 2.67 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.748 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.901 ' SG ' ' HA2' ' A' ' 7' ' ' GLY . 35.7 m -73.75 166.07 23.97 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.466 -176.36 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.55 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 72.5 p -90.61 173.32 8.11 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.231 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.1 m -71.81 -20.44 61.84 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 120.956 0.408 . . . . 0.0 109.997 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.89 -38.67 37.01 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.829 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.7 t -67.07 -20.72 65.87 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.225 0.536 . . . . 0.0 110.04 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.55 ' HG2' ' O ' ' A' ' 11' ' ' THR . 27.9 mmt180 -67.36 -25.94 66.22 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.048 177.849 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.2 m -85.75 147.08 26.5 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.035 -179.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.542 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 10.2 pt-20 -132.15 126.91 20.75 Favored Pre-proline 0 C--N 1.32 -0.699 0 CA-C-O 120.678 0.275 . . . . 0.0 111.052 -179.619 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 30.6 Cg_endo -63.25 160.53 60.41 Favored 'Cis proline' 0 C--O 1.241 0.662 0 C-N-CA 123.27 -1.554 . . . . 0.0 112.302 -0.694 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 32.3 t -52.96 149.15 6.78 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.888 0.743 . . . . 0.0 112.167 -176.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -122.7 14.18 10.09 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -176.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 63.8 m -61.31 -67.97 0.36 Allowed 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.027 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 60.04 -96.34 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 121.084 -0.579 . . . . 0.0 112.31 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.3 t -91.35 -29.24 17.22 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.747 0.308 . . . . 0.0 110.698 179.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -103.18 73.86 1.25 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -177.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 42.4 t -103.02 136.42 42.88 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 174.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.432 ' HB2' HG22 ' A' ' 11' ' ' THR . 53.1 mt-30 -142.93 22.49 1.93 Allowed 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.507 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 91.3 m -69.48 143.52 53.48 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.605 -178.538 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.98 -171.27 47.16 Favored Glycine 0 N--CA 1.433 -1.557 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 176.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -63.75 -21.79 66.58 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.092 0.473 . . . . 0.0 110.633 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.68 63.27 4.48 Favored Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.301 178.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 50.4 t -133.02 128.64 36.77 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 178.498 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.8 t -106.35 9.27 31.91 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.082 0.468 . . . . 0.0 110.61 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 36.9 t -91.64 129.17 37.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.129 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -96.91 7.06 47.46 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.961 0.41 . . . . 0.0 111.132 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -82.46 -37.62 25.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.135 0.493 . . . . 0.0 111.006 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 9.9 p -103.04 -41.43 6.11 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.989 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.5 ttpt -69.38 103.16 1.93 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.161 0.505 . . . . 0.0 110.535 -179.045 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.8 t -106.15 169.01 8.75 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.375 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.9 t -149.91 145.0 26.26 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -178.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -99.43 -24.16 14.88 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -179.34 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.2 m -66.41 140.21 58.04 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.295 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 75.0 p -113.66 177.64 4.56 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.88 0.371 . . . . 0.0 111.507 -175.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.528 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 17.6 m -70.32 -9.66 56.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.869 179.326 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -69.44 -40.71 77.03 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 176.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 170.28 149.27 6.3 Favored Glycine 0 N--CA 1.44 -1.073 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.885 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.1 t -69.95 146.64 51.01 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 178.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -115.34 -38.71 3.74 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.66 -177.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.544 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 11.7 p -75.37 -35.47 61.1 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.359 -176.472 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.8 -0.15 30.41 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.601 -0.809 . . . . 0.0 113.014 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.435 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.1 mmtt -82.8 0.23 44.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.863 0.363 . . . . 0.0 110.393 179.518 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 67.34 50.32 0.97 Allowed 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.705 178.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 17.7 p -124.74 152.85 43.27 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.238 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.528 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 23.7 p -134.03 38.34 3.18 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-O 121.199 0.523 . . . . 0.0 110.966 -178.655 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 142.78 161.95 9.04 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -177.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -50.04 -42.92 44.31 Favored 'Trans proline' 0 N--CA 1.481 0.739 0 C-N-CA 123.411 2.741 . . . . 0.0 113.918 -177.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -65.4 -38.29 89.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.911 0.386 . . . . 0.0 111.5 -178.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.6 t -92.64 8.95 36.85 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.96 0.409 . . . . 0.0 110.126 -179.347 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 50.3 t -100.4 136.19 40.66 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.764 -178.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -126.43 16.71 7.66 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.653 0.74 . . . . 0.0 109.376 178.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.435 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 11.8 m -83.26 149.54 26.72 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.072 -178.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -83.12 -155.69 19.64 Favored Glycine 0 N--CA 1.443 -0.882 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 176.13 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 28.6 m -78.64 -33.5 47.19 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 120.849 0.357 . . . . 0.0 111.139 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.1 m -83.75 67.85 9.67 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.991 -177.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 11.2 t -142.45 161.99 36.62 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-O 120.933 0.397 . . . . 0.0 111.028 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.9 m -68.17 -33.25 74.11 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.998 -177.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.544 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 16.0 p -84.18 11.42 8.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.696 0.284 . . . . 0.0 111.443 -177.318 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm . . . . . 0 C--O 1.259 1.587 0 CA-C-O 117.246 -1.359 . . . . 0.0 111.341 -179.296 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.413 0 N-CA-C 112.303 -0.319 . . . . 0.0 112.303 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.3 t 62.79 83.83 0.15 Allowed 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 121.234 0.54 . . . . 0.0 110.751 -178.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -79.03 79.31 1.61 Allowed Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.985 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -96.25 136.2 37.05 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.806 0.336 . . . . 0.0 110.584 -179.402 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 126.11 -130.63 7.18 Favored Glycine 0 N--CA 1.438 -1.221 0 C-N-CA 120.701 -0.762 . . . . 0.0 111.673 -179.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.414 ' HD2' ' HA ' ' A' ' 6' ' ' LYS . 11.6 tptm -151.48 153.65 35.03 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.041 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -105.05 164.21 14.31 Favored Glycine 0 N--CA 1.442 -0.911 0 C-N-CA 120.355 -0.926 . . . . 0.0 112.389 -178.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -85.0 -9.78 57.69 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.196 0.522 . . . . 0.0 110.351 178.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -81.8 -7.69 59.62 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.347 177.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.406 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 86.7 m -70.68 165.88 21.98 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.427 178.784 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.569 HG21 ' H ' ' A' ' 26' ' ' GLN . 55.2 p -100.96 174.32 6.07 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.372 -179.57 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.1 m -74.87 -20.2 59.84 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 176.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.49 ' HB1' ' C ' ' A' ' 20' ' ' GLN . . . -74.72 -33.04 62.31 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.374 178.262 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.519 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 42.7 t -74.38 -12.38 60.5 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.596 0.712 . . . . 0.0 109.325 177.514 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.0 mmt180 -86.15 -1.0 57.02 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.953 176.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.3 m -96.54 154.4 17.3 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 120.847 0.356 . . . . 0.0 111.1 -178.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -136.26 112.46 10.21 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.755 178.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -66.82 165.28 66.54 Favored 'Cis proline' 0 C--N 1.356 0.927 0 C-N-CA 123.607 -1.414 . . . . 0.0 112.417 -0.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.519 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 5.1 t -57.81 151.84 16.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.494 -176.543 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.49 ' C ' ' HB1' ' A' ' 13' ' ' ALA . 27.8 mm-40 -129.52 17.51 5.88 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -174.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.0 m -66.74 -76.6 0.08 Allowed 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 57.47 -114.36 5.46 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 121.036 -0.602 . . . . 0.0 112.66 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.4 p -76.53 -17.99 58.95 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.84 0.352 . . . . 0.0 111.351 -178.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -101.13 20.87 14.84 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.348 -177.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.0 t -72.93 119.24 16.89 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 121.442 0.639 . . . . 0.0 111.122 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.569 ' H ' HG21 ' A' ' 11' ' ' THR . 76.4 mt-30 -121.42 6.75 10.1 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.833 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.406 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 93.8 m -55.87 117.52 3.76 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.368 -178.185 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -87.76 -170.52 46.27 Favored Glycine 0 N--CA 1.44 -1.088 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.009 -179.39 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -63.84 115.01 4.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.411 0.624 . . . . 0.0 110.349 179.007 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 143.16 -14.1 2.33 Favored Glycine 0 N--CA 1.442 -0.937 0 N-CA-C 110.934 -0.866 . . . . 0.0 110.934 -177.001 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.3 t -75.27 151.39 38.37 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 177.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.6 t -136.72 15.7 3.12 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 121.537 0.685 . . . . 0.0 109.921 -178.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.5 t -93.28 122.97 36.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.269 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -84.67 5.98 25.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -177.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.99 -34.62 32.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.141 0.496 . . . . 0.0 110.781 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 2.6 p -108.72 -33.2 7.06 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.197 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -63.2 110.5 1.88 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.656 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.3 t -111.29 170.0 8.41 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.518 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 41.7 t -157.06 149.23 22.92 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -116.5 -7.67 11.63 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 72.4 m -81.64 132.15 35.29 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 32.7 p -112.98 177.84 4.49 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-O 120.622 0.248 . . . . 0.0 111.596 -174.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.4 p -60.09 -16.99 36.53 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.386 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -57.59 -37.77 73.77 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 176.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 154.85 152.66 6.21 Favored Glycine 0 N--CA 1.43 -1.766 0 N-CA-C 110.534 -1.027 . . . . 0.0 110.534 -179.256 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 43.3 t -67.87 144.89 55.08 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -117.35 -21.48 8.68 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.572 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 12.2 p -89.76 -32.42 16.97 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.13 -177.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.8 -5.31 14.17 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.469 -0.872 . . . . 0.0 113.252 178.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.681 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 67.2 mmtt -79.99 -5.23 55.34 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.932 0.366 . . . . 0.0 111.05 -179.663 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 68.6 23.89 7.08 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.775 -178.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 25.5 p -93.18 151.29 19.92 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.266 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.3 p -139.46 81.85 1.85 Allowed 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.078 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.23 153.48 15.28 Favored Glycine 0 C--O 1.223 -0.539 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.03 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -53.43 -40.75 77.33 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 123.324 2.683 . . . . 0.0 113.755 -177.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -73.24 -23.13 60.31 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.017 0.437 . . . . 0.0 111.501 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.1 t -105.0 12.11 32.66 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.222 0.534 . . . . 0.0 109.974 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.424 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 37.1 t -101.63 150.72 22.81 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.713 -177.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -110.43 -27.54 8.97 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.166 0.508 . . . . 0.0 109.818 176.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.681 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.0 OUTLIER -63.4 126.7 28.34 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.746 -178.504 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -86.95 -60.61 1.66 Allowed Glycine 0 N--CA 1.442 -0.943 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.917 -179.299 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.7 t -157.12 171.35 20.6 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.8 m 64.85 23.77 12.69 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.446 0.698 . . . . 0.0 111.969 178.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' CYS . . . . . 0.433 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 46.3 t -106.58 169.76 8.34 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 120.884 -0.327 . . . . 0.0 110.798 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.402 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 36.2 m -71.36 -22.14 61.94 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.075 -178.226 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.572 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 18.4 p -93.68 18.29 10.41 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.867 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.433 ' HG2' ' HB3' ' A' ' 64' ' ' CYS . 63.2 mmtt . . . . . 0 C--O 1.261 1.708 0 CA-C-O 117.478 -1.249 . . . . 0.0 110.051 179.281 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.475 ' N ' ' HB2' ' A' ' 4' ' ' LYS . . . . . . . . 0 N--CA 1.487 2.04 0 N-CA-C 112.423 -0.271 . . . . 0.0 112.423 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.6 t -83.23 91.73 7.33 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 120.757 0.313 . . . . 0.0 110.428 -179.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 59.37 36.47 89.18 Favored Glycine 0 C--N 1.337 0.594 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.215 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.478 ' HB3' ' O ' ' A' ' 6' ' ' LYS . 45.0 mmtm -108.82 116.09 31.33 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -176.363 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -91.32 -3.91 69.0 Favored Glycine 0 N--CA 1.449 -0.46 0 N-CA-C 109.604 -1.399 . . . . 0.0 109.604 174.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.497 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 9.0 ptpp? -138.17 178.71 6.92 Favored 'General case' 0 N--CA 1.442 -0.864 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.054 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -154.27 -169.96 19.64 Favored Glycine 0 N--CA 1.44 -1.054 0 C-N-CA 119.722 -1.227 . . . . 0.0 112.553 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -74.86 -11.06 60.05 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.22 0.533 . . . . 0.0 110.343 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.573 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 88.4 mttt -86.3 0.39 53.98 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.327 178.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.564 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 89.8 m -77.65 153.81 32.78 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 176.242 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.447 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 46.9 p -91.72 168.06 11.74 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.799 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.0 m -67.91 -20.8 65.13 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.189 0.518 . . . . 0.0 109.768 177.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.49 -38.55 59.46 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.735 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.483 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 52.9 t -70.82 -22.46 62.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.371 0.605 . . . . 0.0 110.016 178.525 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.447 ' HG3' ' O ' ' A' ' 11' ' ' THR . 40.2 mtp180 -89.74 20.29 4.17 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.983 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.5 m -113.47 171.56 7.49 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.564 178.034 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.423 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 13.4 pt-20 -129.83 112.89 17.54 Favored Pre-proline 0 CA--C 1.54 0.56 0 CA-C-O 120.675 0.274 . . . . 0.0 110.958 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.423 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 6.1 Cg_exo -79.27 -172.8 11.72 Favored 'Cis proline' 0 C--N 1.348 0.535 0 C-N-CA 123.89 -1.296 . . . . 0.0 111.598 -0.211 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.7 t -61.15 137.36 58.24 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.763 0.316 . . . . 0.0 110.158 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -121.35 26.78 8.69 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.429 -175.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.483 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 77.6 m -88.34 17.71 5.02 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.746 0.308 . . . . 0.0 111.622 -178.589 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.38 107.1 1.33 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 121.296 -0.478 . . . . 0.0 113.145 -178.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.6 m 64.36 18.54 11.37 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.083 0.553 . . . . 0.0 111.768 178.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -146.01 29.51 1.09 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.822 0.82 . . . . 0.0 108.811 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 34.1 t -84.98 149.5 25.56 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.362 -175.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.1 mm-40 -146.41 14.84 1.27 Allowed 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.339 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.573 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 60.0 m -66.44 136.37 55.62 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 121.247 0.546 . . . . 0.0 112.153 -178.367 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -106.21 -151.44 19.13 Favored Glycine 0 N--CA 1.44 -1.083 0 CA-C-N 115.195 -0.911 . . . . 0.0 112.1 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.481 ' HG2' ' HD2' ' A' ' 9' ' ' LYS . 13.6 pt-20 -65.05 155.12 35.77 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.952 0.406 . . . . 0.0 110.314 178.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.76 -35.46 4.83 Favored Glycine 0 N--CA 1.444 -0.811 0 N-CA-C 110.779 -0.929 . . . . 0.0 110.779 -177.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.8 t -80.96 128.93 34.24 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 121.059 0.457 . . . . 0.0 110.301 178.156 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.45 ' HA ' ' NZ ' ' A' ' 37' ' ' LYS . 6.4 t -123.56 18.45 9.62 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 121.407 0.622 . . . . 0.0 110.101 177.583 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 52.7 t -63.85 123.95 20.26 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.568 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.19 -10.46 59.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.991 -177.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.2 -41.47 61.36 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -178.177 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.6 p -111.37 -13.48 13.9 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -177.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.45 ' NZ ' ' HA ' ' A' ' 32' ' ' THR . 39.5 ttmt -77.89 108.43 11.13 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.576 177.301 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.9 t -124.91 162.45 24.39 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.78 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.5 t -143.11 156.71 44.86 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 120.678 0.275 . . . . 0.0 110.677 -178.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -107.59 -21.04 13.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.79 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 77.0 m -78.91 136.73 37.36 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 175.619 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.5 p -119.46 -177.12 3.29 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 -175.064 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.7 p -62.4 -12.48 21.84 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.76 -178.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -67.18 -29.46 69.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.206 0.527 . . . . 0.0 109.892 176.039 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 148.74 157.6 7.64 Favored Glycine 0 N--CA 1.44 -1.087 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.861 179.116 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 53.3 t -72.73 134.91 45.22 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -121.33 -3.17 9.46 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.599 -177.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 1.2 p -99.02 -37.74 9.24 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.146 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.82 19.12 5.38 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.696 -0.764 . . . . 0.0 113.037 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -113.61 8.25 17.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 117.035 0.418 . . . . 0.0 111.124 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 64.61 17.42 10.89 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.689 178.154 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 17.3 p -89.89 153.35 20.7 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.283 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.9 p -139.17 40.3 2.1 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.95 0.405 . . . . 0.0 110.724 -179.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.42 163.88 10.02 Favored Glycine 0 N--CA 1.439 -1.155 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.409 -178.497 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.3 -28.94 86.36 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.108 2.539 . . . . 0.0 113.918 -176.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -74.3 -36.78 63.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.858 0.361 . . . . 0.0 111.019 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.2 p -93.96 -10.6 33.16 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.091 0.472 . . . . 0.0 111.03 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 45.6 t -69.63 133.48 47.63 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.664 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 59' ' ' LYS . 37.5 ttmt -112.71 -7.2 13.83 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.843 -179.751 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.551 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 9.0 m -64.33 124.79 22.64 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.315 -177.288 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.25 50.07 3.57 Favored Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.486 -179.135 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 57.6 m 66.34 -177.31 0.19 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.102 0.561 . . . . 0.0 111.127 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.3 m 66.19 6.85 4.43 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.36 0.6 . . . . 0.0 111.048 -178.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.7 t -100.09 167.5 10.43 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.064 -179.402 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.2 p -65.97 -30.18 70.69 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -176.387 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 22.0 p -94.36 -4.49 48.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.77 0.319 . . . . 0.0 111.454 -177.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.551 ' HE3' ' O ' ' A' ' 60' ' ' CYS . 1.8 mmmp? . . . . . 0 C--O 1.27 2.162 0 CA-C-O 118.016 -0.992 . . . . 0.0 111.342 -178.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.508 0 N-CA-C 112.324 -0.31 . . . . 0.0 112.324 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.5 m -159.6 109.38 1.88 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 142.69 -57.39 0.56 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.161 -1.019 . . . . 0.0 112.767 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.42 -51.62 64.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.943 0.401 . . . . 0.0 111.519 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 179.18 49.09 0.08 OUTLIER Glycine 0 CA--C 1.491 -1.417 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 -179.082 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.455 ' NZ ' ' SG ' ' A' ' 14' ' ' CYS . 40.3 tptt -138.69 114.9 10.29 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 121.029 -0.268 . . . . 0.0 110.808 -174.876 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 149.38 -58.92 0.45 Allowed Glycine 0 N--CA 1.441 -1.004 0 C-N-CA 119.846 -1.169 . . . . 0.0 114.156 177.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -87.31 -33.43 19.22 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -174.267 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 12.1 mptt -84.97 -13.97 49.0 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.314 178.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.1 m -83.49 168.73 16.2 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 121.841 0.829 . . . . 0.0 112.034 -177.165 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.458 HG21 ' H ' ' A' ' 26' ' ' GLN . 59.9 p -100.19 168.68 9.65 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-N 114.381 -1.282 . . . . 0.0 109.309 178.033 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.0 m -67.62 -17.55 64.65 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.349 0.595 . . . . 0.0 109.764 177.037 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.489 ' HB1' ' C ' ' A' ' 20' ' ' GLN . . . -79.57 -39.48 31.66 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.718 -178.53 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.455 ' SG ' ' NZ ' ' A' ' 6' ' ' LYS . 50.2 t -69.99 -25.48 63.63 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.183 0.516 . . . . 0.0 110.475 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 -83.43 8.64 13.22 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.828 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.8 t -115.46 148.53 39.32 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 177.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.524 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 16.3 pt-20 -124.82 130.12 24.35 Favored Pre-proline 0 C--N 1.323 -0.551 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.984 179.044 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.524 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 15.2 Cg_exo -66.97 166.94 59.94 Favored 'Cis proline' 0 C--N 1.35 0.627 0 C-N-CA 123.095 -1.627 . . . . 0.0 111.92 -0.029 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.2 t -56.35 123.18 13.77 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.186 -178.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.489 ' C ' ' HB1' ' A' ' 13' ' ' ALA . 84.2 mm-40 -100.86 19.69 16.76 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.953 -175.434 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.404 ' HB3' ' HB2' ' A' ' 25' ' ' CYS . 56.3 m -85.35 8.15 19.82 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.445 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.68 -23.93 69.29 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.289 -0.957 . . . . 0.0 110.821 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.2 p -99.05 -56.33 2.46 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.218 -0.491 . . . . 0.0 110.228 178.032 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -121.99 113.85 20.14 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.966 -178.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.404 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 17.3 t -130.97 129.65 42.39 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-O 121.001 0.429 . . . . 0.0 110.235 176.779 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.458 ' H ' HG21 ' A' ' 11' ' ' THR . 8.4 tt0 -143.11 14.69 1.87 Allowed 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.308 -178.556 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 72.6 m -59.61 131.44 50.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.657 -177.04 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.25 -156.15 32.48 Favored Glycine 0 N--CA 1.441 -0.985 0 CA-C-N 115.077 -0.965 . . . . 0.0 113.952 -176.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -67.42 148.27 51.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.249 -0.476 . . . . 0.0 111.016 -179.012 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.9 -26.47 24.34 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.426 -178.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.42 ' SG ' ' NZ ' ' A' ' 6' ' ' LYS . 48.6 t -77.36 116.76 18.22 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-O 121.089 0.471 . . . . 0.0 109.845 179.19 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.8 t -115.35 17.6 16.44 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.017 -179.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 47.1 t -62.08 110.07 1.48 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.467 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.51 -13.4 13.66 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -176.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.19 -53.19 15.31 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.445 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.9 p -102.75 -9.45 19.99 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.691 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -72.14 103.89 3.45 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.444 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 12.7 t -120.24 166.98 12.75 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.194 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.459 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 40.6 t -159.55 143.54 14.8 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.155 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -102.22 -15.7 16.55 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -179.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 76.5 m -77.93 136.37 38.0 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 175.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.1 p -115.08 -178.76 3.45 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -175.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.4 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 5.9 p -61.05 -15.15 29.13 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.101 -179.602 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -66.74 -33.67 76.15 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.209 0.528 . . . . 0.0 109.959 177.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 154.33 160.14 9.64 Favored Glycine 0 N--CA 1.435 -1.393 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.123 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.3 t -76.71 151.09 36.22 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.054 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -135.45 7.77 3.34 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 179.294 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.8 p -116.31 -19.61 10.1 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.855 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.25 14.91 29.36 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.683 -0.77 . . . . 0.0 113.494 178.496 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.622 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 42.1 mmtm -103.65 4.44 35.52 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 117.046 0.423 . . . . 0.0 111.25 179.212 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 62.26 21.49 12.52 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.244 178.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.4 p -95.35 146.7 24.19 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.376 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.4 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 47.4 p -133.05 38.91 3.33 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.244 0.545 . . . . 0.0 110.171 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.95 162.5 9.44 Favored Glycine 0 N--CA 1.436 -1.332 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -177.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.459 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 13.8 Cg_endo -56.66 -28.58 75.96 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.937 2.425 . . . . 0.0 112.713 -178.122 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -68.23 -35.61 78.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.724 -178.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.3 p -105.27 8.44 33.87 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.228 0.537 . . . . 0.0 110.841 -179.111 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 42.6 t -92.32 123.36 35.59 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.131 -176.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -90.42 -22.63 21.34 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.996 177.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.622 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.9 m -62.37 146.63 50.77 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.217 -177.598 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -105.49 -86.66 1.93 Allowed Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 110.954 -0.859 . . . . 0.0 110.954 177.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.1 m -130.16 171.75 12.52 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 178.282 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 37.8 m 64.61 33.81 10.4 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 177.706 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 35.3 t -119.73 160.38 22.66 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.68 0.276 . . . . 0.0 110.266 177.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.3 m -65.8 -23.03 66.61 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -178.404 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.508 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 8.9 p -95.01 13.42 25.12 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.293 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.508 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 47.2 mmtm . . . . . 0 C--O 1.259 1.56 0 CA-C-O 117.112 -1.423 . . . . 0.0 110.912 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 112.382 -0.287 . . . . 0.0 112.382 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.4 p -155.46 19.43 0.41 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.057 0.456 . . . . 0.0 110.999 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -117.73 93.57 0.58 Allowed Glycine 0 N--CA 1.442 -0.916 0 C-N-CA 120.568 -0.825 . . . . 0.0 113.034 -177.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -117.35 57.41 0.8 Allowed 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 176.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -81.31 75.53 2.29 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-N 115.669 -0.696 . . . . 0.0 113.098 -177.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -139.16 131.56 28.5 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.567 ' HA2' ' SG ' ' A' ' 10' ' ' CYS . . . 90.29 19.83 44.29 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.34 -0.933 . . . . 0.0 112.455 179.299 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -87.86 -27.79 22.0 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.036 0.446 . . . . 0.0 110.398 179.075 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -140.65 30.27 1.89 Allowed 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.023 -178.538 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.567 ' SG ' ' HA2' ' A' ' 7' ' ' GLY . 85.9 m -89.15 177.12 6.71 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-O 121.348 0.594 . . . . 0.0 111.663 -177.17 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.519 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 40.7 p -108.68 171.77 7.23 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.072 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.1 m -70.79 -26.9 63.53 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.47 -38.55 81.14 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.387 178.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 52.7 t -72.11 -34.6 68.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.244 178.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 11' ' ' THR . 70.3 mtp180 -65.87 -29.04 69.42 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.275 178.42 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 49.1 m -67.77 152.25 45.89 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.142 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -126.26 120.04 23.57 Favored Pre-proline 0 C--N 1.318 -0.77 0 CA-C-O 120.763 0.316 . . . . 0.0 111.048 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -73.77 174.6 50.13 Favored 'Cis proline' 0 C--O 1.237 0.442 0 C-N-CA 123.426 -1.489 . . . . 0.0 112.141 0.27 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.0 t -55.5 136.22 50.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.092 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -111.98 17.6 19.54 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.289 0.566 . . . . 0.0 110.703 -178.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.459 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 93.3 m -81.85 29.54 0.39 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.333 -179.041 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.52 -45.72 95.29 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 176.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.2 m -131.58 4.29 4.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.048 0.451 . . . . 0.0 110.098 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -118.61 31.14 6.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.24 -177.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.54 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 16.7 t -82.97 127.28 33.39 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.13 -0.628 . . . . 0.0 111.18 -178.673 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.456 ' H ' HG21 ' A' ' 11' ' ' THR . 84.4 mt-30 -142.77 18.83 1.99 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.181 -0.918 . . . . 0.0 108.904 -178.68 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 86.5 m -67.33 145.66 54.88 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.415 -176.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -96.62 -154.59 30.26 Favored Glycine 0 N--CA 1.438 -1.187 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.312 177.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -78.38 14.46 1.22 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.053 0.454 . . . . 0.0 111.263 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -110.21 34.62 5.31 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 121.102 -0.571 . . . . 0.0 111.865 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.5 t -130.92 148.68 52.71 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.045 0.45 . . . . 0.0 110.346 179.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.9 t -136.53 16.8 3.13 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.35 178.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.6 t -80.63 124.47 29.02 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.362 -178.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -81.18 9.11 7.34 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.439 -178.467 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -93.14 -13.08 28.91 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.976 0.417 . . . . 0.0 110.806 179.033 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.54 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 7.5 p -139.15 -27.78 0.8 Allowed 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 116.125 -0.488 . . . . 0.0 112.144 -178.396 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.433 ' HE3' ' O ' ' A' ' 60' ' ' CYS . 88.0 tttt -79.44 126.81 31.32 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 178.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.0 t -132.33 175.26 9.42 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.854 -177.572 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.406 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 40.6 t -158.92 148.26 18.85 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.346 -179.005 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -109.46 -12.35 14.72 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 179.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.7 m -81.07 133.63 35.51 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 177.017 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 75.4 p -113.73 176.6 4.96 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.412 -176.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.453 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 22.7 t -62.66 -18.71 62.85 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.905 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -64.86 -20.6 66.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.482 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.84 146.7 4.38 Favored Glycine 0 N--CA 1.439 -1.145 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.399 178.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 38.1 t -75.32 142.33 43.25 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.634 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -120.41 -6.92 9.78 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 11.2 p -99.71 -38.09 8.84 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.833 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.49 -0.98 16.11 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.67 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.631 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 73.4 mmtt -84.96 0.52 51.0 Favored 'General case' 0 C--O 1.239 0.551 0 O-C-N 122.625 -0.338 . . . . 0.0 110.852 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 63.92 35.39 10.9 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.268 178.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 24.1 p -107.85 155.48 20.21 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.901 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.453 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 50.1 p -140.75 50.18 1.67 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 120.971 0.415 . . . . 0.0 110.676 179.105 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 133.87 154.05 7.21 Favored Glycine 0 C--O 1.225 -0.429 0 C-N-CA 120.449 -0.881 . . . . 0.0 112.368 -179.024 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.406 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 76.0 Cg_exo -50.25 -41.46 50.27 Favored 'Trans proline' 0 C--N 1.36 1.139 0 C-N-CA 123.687 2.925 . . . . 0.0 114.022 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -64.37 -34.86 79.13 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.779 0.323 . . . . 0.0 111.616 -177.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 41.7 m -107.06 21.94 16.77 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.314 0.578 . . . . 0.0 110.079 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.502 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 49.4 t -98.45 123.88 42.84 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.671 -178.098 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -91.55 -17.67 25.28 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.865 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.631 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.7 m -71.66 154.05 41.65 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.797 -178.783 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.491 ' O ' ' HE3' ' A' ' 67' ' ' LYS . . . -92.76 -106.84 1.71 Allowed Glycine 0 N--CA 1.443 -0.871 0 C-N-CA 120.682 -0.77 . . . . 0.0 111.962 178.862 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.5 p -124.62 -26.0 3.91 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 120.894 0.378 . . . . 0.0 111.198 -179.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.3 m -89.4 50.05 1.86 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.36 -177.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 34.8 t -125.19 168.06 13.97 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 120.963 0.411 . . . . 0.0 111.345 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -70.25 -28.5 65.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.792 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 18.2 p -84.77 16.96 2.99 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.977 0.418 . . . . 0.0 111.122 -179.095 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.502 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 58.0 mmtt . . . . . 0 C--O 1.26 1.624 0 CA-C-O 117.585 -1.198 . . . . 0.0 110.691 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.221 0 N-CA-C 112.294 -0.322 . . . . 0.0 112.294 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.0 t -130.25 -170.74 2.38 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 118.26 -42.12 1.88 Allowed Glycine 0 N--CA 1.444 -0.831 0 C-N-CA 121.0 -0.619 . . . . 0.0 111.656 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -103.44 103.01 12.94 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.918 0.39 . . . . 0.0 110.177 178.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 159.78 179.85 34.86 Favored Glycine 0 N--CA 1.44 -1.091 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.982 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.442 ' NZ ' ' SG ' ' A' ' 14' ' ' CYS . 61.9 mttm 70.99 142.64 0.05 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.622 0.769 . . . . 0.0 112.149 -179.31 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -116.94 -146.13 8.32 Favored Glycine 0 N--CA 1.436 -1.323 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.874 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -95.34 3.14 54.73 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.526 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -79.92 -24.11 41.31 Favored 'General case' 0 CA--C 1.514 -0.435 0 C-N-CA 120.171 -0.612 . . . . 0.0 109.368 176.202 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.544 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 87.7 m -65.94 136.72 56.47 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.18 176.53 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.624 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 68.7 p -72.76 171.46 12.56 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.07 -178.051 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.8 m -70.18 -11.78 61.14 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.327 0.584 . . . . 0.0 109.904 177.692 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.402 ' HB1' ' HB2' ' A' ' 20' ' ' GLN . . . -87.76 -39.21 15.11 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.338 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.561 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 54.0 t -73.26 -24.11 60.41 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.005 0.431 . . . . 0.0 111.316 -179.101 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.624 ' HG3' ' O ' ' A' ' 11' ' ' THR . 86.9 mtt180 -73.59 -10.53 59.8 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.093 0.473 . . . . 0.0 110.188 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 30.8 t -88.84 159.99 17.45 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.132 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -131.82 116.96 16.05 Favored Pre-proline 0 C--N 1.317 -0.838 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.985 177.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -73.51 176.01 43.42 Favored 'Cis proline' 0 C--O 1.242 0.704 0 C-N-CA 123.536 -1.444 . . . . 0.0 112.583 1.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.2 t -59.72 141.07 55.9 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.807 -179.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.402 ' HB2' ' HB1' ' A' ' 13' ' ' ALA . 16.3 mm-40 -115.75 11.82 15.76 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.372 -178.499 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.561 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 58.1 m -81.89 20.46 0.97 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.733 0.301 . . . . 0.0 111.667 -179.057 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.5 108.29 2.13 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.075 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.1 m 63.03 15.09 8.14 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.18 0.592 . . . . 0.0 111.421 -178.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -152.31 81.4 1.25 Allowed 'General case' 0 N--CA 1.438 -1.027 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.455 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 49.5 t -130.38 150.27 51.68 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.172 -176.522 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.403 ' H ' HG21 ' A' ' 11' ' ' THR . 69.7 mt-30 -148.12 23.19 1.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.256 178.484 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.544 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 35.2 m -65.59 171.43 4.13 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.227 0.537 . . . . 0.0 112.361 -178.394 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.21 -165.7 40.08 Favored Glycine 0 N--CA 1.438 -1.173 0 CA-C-N 115.639 -0.71 . . . . 0.0 113.01 -177.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -84.23 -24.2 30.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 120.919 0.39 . . . . 0.0 110.975 -178.031 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -91.51 48.51 2.86 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.796 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 21.5 t -120.64 126.71 50.93 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.8 t -109.02 7.97 26.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.262 -178.067 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.2 t -69.17 115.1 8.06 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.299 179.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.86 -5.36 29.9 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -176.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.16 -40.9 51.45 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.805 0.336 . . . . 0.0 111.044 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 7.8 p -111.38 -18.45 12.89 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.934 -178.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -80.48 113.49 18.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.786 0.327 . . . . 0.0 110.347 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.449 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 12.6 t -120.72 167.11 12.82 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.741 -178.512 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.466 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 41.7 t -156.4 145.12 20.12 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 178.385 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -102.43 -13.52 17.23 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.498 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 70.0 m -88.9 135.63 33.43 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 175.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 81.4 p -127.94 -166.65 1.65 Allowed 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.571 -177.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.3 m -60.61 -15.04 24.04 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 120.91 0.386 . . . . 0.0 110.723 178.436 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -67.75 -30.22 69.63 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.634 178.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 147.55 157.97 7.67 Favored Glycine 0 N--CA 1.439 -1.152 0 C-N-CA 120.991 -0.623 . . . . 0.0 112.209 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.5 t -87.76 135.12 33.51 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.535 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.42 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 8.0 mtpm? -126.75 5.46 6.69 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -179.496 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.47 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 13.7 p -99.63 -32.05 11.27 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 119.984 -0.686 . . . . 0.0 110.138 178.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.69 5.97 25.35 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.888 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.704 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 74.4 mmtt -93.32 0.43 56.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 117.03 0.415 . . . . 0.0 111.334 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 64.19 30.65 13.59 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.568 0.699 . . . . 0.0 110.624 178.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.0 p -104.17 151.34 23.45 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.243 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 26.7 p -140.25 79.7 1.72 Allowed 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.084 0.469 . . . . 0.0 110.025 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.9 152.38 13.9 Favored Glycine 0 N--CA 1.442 -0.918 0 C-N-CA 121.13 -0.557 . . . . 0.0 111.858 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.466 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 11.4 Cg_endo -54.31 -34.62 80.85 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 123.435 2.757 . . . . 0.0 113.32 -177.701 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -64.05 -36.35 83.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.968 0.413 . . . . 0.0 111.378 -178.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.3 m -106.86 22.96 15.13 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.691 -177.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 26.6 t -113.54 139.45 48.97 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.127 -178.121 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -124.72 12.79 8.58 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.851 0.357 . . . . 0.0 110.872 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.704 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 8.1 m -76.85 148.75 36.34 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.77 -179.021 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.682 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -81.79 -170.0 43.66 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 177.52 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.6 m -86.62 10.37 15.77 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 117.121 0.46 . . . . 0.0 111.616 -177.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.4 t -116.92 31.61 6.65 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.182 0.515 . . . . 0.0 109.866 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' CYS . . . . . 0.4 ' SG ' ' N ' ' A' ' 65' ' ' SER . 42.4 t -109.11 167.86 9.79 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.227 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.4 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 31.2 t -68.49 -29.27 67.84 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.451 -178.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.49 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 14.1 p -90.5 23.73 2.89 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.199 0.523 . . . . 0.0 110.411 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.682 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 47.3 mmtm . . . . . 0 C--O 1.273 2.29 0 CA-C-O 117.713 -1.137 . . . . 0.0 110.768 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.426 0 N-CA-C 112.413 -0.275 . . . . 0.0 112.413 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.2 m -76.01 113.96 14.12 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.795 0.331 . . . . 0.0 110.391 179.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 95.92 159.93 32.68 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.936 -0.65 . . . . 0.0 111.753 -178.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.438 ' H ' ' HD3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -105.91 15.83 26.04 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.053 0.454 . . . . 0.0 110.849 179.987 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -78.44 161.85 48.85 Favored Glycine 0 CA--C 1.495 -1.188 0 C-N-CA 120.699 -0.763 . . . . 0.0 111.994 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? 63.97 75.24 0.39 Allowed 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 121.551 0.691 . . . . 0.0 109.927 179.174 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -96.09 -140.96 11.44 Favored Glycine 0 N--CA 1.437 -1.29 0 CA-C-N 115.134 -0.939 . . . . 0.0 112.287 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -96.65 8.76 43.45 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 120.607 0.241 . . . . 0.0 111.56 -177.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.537 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 25.9 mtmm -111.45 18.86 18.76 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.223 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 10.7 m -82.09 162.2 22.61 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 174.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 80.6 p -100.54 -177.62 3.55 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 120.841 0.353 . . . . 0.0 110.616 -178.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.4 m -80.61 -30.26 36.81 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 175.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.66 -30.59 68.31 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.333 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.542 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 52.0 t -71.58 -22.76 61.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.169 0.509 . . . . 0.0 110.578 178.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -87.03 -2.65 58.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.914 0.388 . . . . 0.0 110.684 179.181 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.4 m -80.14 168.94 18.49 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.799 -179.328 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.47 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 8.7 pt-20 -136.63 108.84 9.31 Favored Pre-proline 0 C--N 1.32 -0.713 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.736 179.421 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.47 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 73.0 Cg_endo -74.64 178.77 32.78 Favored 'Cis proline' 0 C--O 1.24 0.62 0 C-N-CA 123.535 -1.444 . . . . 0.0 111.919 -0.772 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.542 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 16.7 t -58.72 138.91 56.82 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -179.469 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 87.9 mm-40 -114.37 24.33 12.01 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -174.552 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.615 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 63.9 m -96.67 29.39 3.0 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.831 0.348 . . . . 0.0 110.555 178.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.06 -53.23 47.48 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.875 -0.602 . . . . 0.0 113.068 -179.234 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -111.51 -6.9 14.36 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.784 0.326 . . . . 0.0 111.339 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -139.07 91.72 2.54 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.863 0.363 . . . . 0.0 110.435 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 44.0 t -118.43 128.23 54.41 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.91 -179.453 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -127.0 15.92 7.34 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.612 178.293 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.537 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 93.5 m -70.01 132.41 45.87 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 121.208 0.528 . . . . 0.0 110.513 179.563 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.75 -166.95 42.29 Favored Glycine 0 N--CA 1.437 -1.275 0 CA-C-N 115.226 -0.897 . . . . 0.0 113.654 -176.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -53.74 -26.44 23.34 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.039 0.936 . . . . 0.0 112.167 -179.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -90.08 47.65 3.15 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 120.642 -0.79 . . . . 0.0 113.447 -177.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 49.8 t -120.44 139.35 52.98 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 117.117 0.459 . . . . 0.0 109.899 177.179 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.6 t -123.15 18.68 9.96 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 121.417 0.627 . . . . 0.0 109.857 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.401 ' SG ' ' HB3' ' A' ' 35' ' ' ALA . 42.9 t -93.54 113.54 25.68 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.586 -178.765 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.39 -4.32 29.38 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.673 -179.04 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.401 ' HB3' ' SG ' ' A' ' 33' ' ' CYS . . . -77.68 -41.04 39.51 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.334 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.615 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 19.8 p -106.95 -15.3 14.74 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.914 0.388 . . . . 0.0 111.979 -178.67 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -85.64 102.05 13.24 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.564 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.0 t -108.18 178.52 4.48 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.297 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 48.1 t -156.72 149.13 23.34 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -106.78 -17.05 14.32 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 73.9 m -76.62 137.27 39.37 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 176.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 65.6 p -93.39 170.13 9.85 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.852 -173.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.51 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 20.2 m -69.38 -4.17 17.28 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.3 -179.253 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -84.02 -31.78 25.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.814 179.124 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 172.3 156.76 12.82 Favored Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.378 -179.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 53.8 t -74.84 142.18 44.19 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.704 0.287 . . . . 0.0 110.519 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 7.1 mtpm? -117.42 -18.6 9.79 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.735 -178.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.438 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 7.2 p -93.3 -33.23 14.0 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.857 -178.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.15 4.76 23.78 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.507 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.0 mmmp? -92.16 10.64 28.53 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 122.577 -0.366 . . . . 0.0 111.229 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 63.12 24.19 14.31 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.917 176.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 8.2 p -102.6 143.99 31.57 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.599 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.51 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 68.5 p -132.34 52.47 2.07 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-O 121.195 0.521 . . . . 0.0 110.198 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.87 161.18 9.79 Favored Glycine 0 N--CA 1.445 -0.704 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.52 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.33 -41.12 68.45 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.518 2.812 . . . . 0.0 114.129 -177.421 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -74.44 -22.96 58.87 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.012 0.434 . . . . 0.0 111.134 -178.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.407 ' HB2' ' H ' ' A' ' 53' ' ' THR . 7.4 m -96.44 -0.46 49.14 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.873 179.305 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 44.1 t -98.26 147.65 24.42 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.082 -176.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -138.16 11.59 2.82 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.935 0.874 . . . . 0.0 108.832 176.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.2 m -81.71 142.49 32.63 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.618 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.435 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -67.53 167.31 41.02 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.453 -0.88 . . . . 0.0 111.332 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 30.7 m -69.18 5.68 1.17 Allowed 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -178.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 33.5 t -108.7 5.7 25.04 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.652 0.263 . . . . 0.0 111.192 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 49.7 t -77.37 169.07 18.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.88 0.371 . . . . 0.0 111.105 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.8 m -64.62 -28.74 69.83 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.697 -178.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.438 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 18.7 p -89.82 25.7 2.0 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.007 0.432 . . . . 0.0 110.763 -179.731 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 47.9 mmtm . . . . . 0 C--O 1.263 1.773 0 CA-C-O 117.43 -1.272 . . . . 0.0 111.402 -178.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 98.5 mttt . . . . . 0 N--CA 1.446 -0.659 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 68.4 m -69.47 156.48 38.8 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.008 0.432 . . . . 0.0 110.344 177.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 65.2 p -92.71 169.24 10.64 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.071 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.8 m -73.99 -11.27 60.29 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.85 -42.96 18.88 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.25 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.43 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 44.8 t -69.84 -23.42 63.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.325 0.583 . . . . 0.0 110.582 178.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -85.78 5.37 32.75 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.991 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.8 t -110.04 156.88 19.94 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.93 -0.766 . . . . 0.0 108.93 177.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.437 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 6.7 pt-20 -126.17 126.67 24.74 Favored Pre-proline 0 C--N 1.322 -0.604 0 C-N-CA 121.084 -0.246 . . . . 0.0 110.361 177.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.437 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 11.7 Cg_exo -68.8 170.93 51.78 Favored 'Cis proline' 0 C--N 1.346 0.425 0 C-N-CA 123.236 -1.568 . . . . 0.0 111.98 0.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.404 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 5.3 t -60.09 116.74 4.4 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.645 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -86.23 8.69 20.15 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.433 -176.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.456 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 79.7 m -78.5 6.46 8.54 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.663 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.08 -20.62 65.04 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.962 -0.637 . . . . 0.0 111.61 177.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.5 m -143.37 23.55 1.81 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.055 0.455 . . . . 0.0 110.325 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 87.0 tttt -170.89 81.71 0.08 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.161 -178.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.3 t -121.42 138.63 54.19 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.837 0.351 . . . . 0.0 111.15 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -153.48 20.98 0.55 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.659 -0.701 . . . . 0.0 109.967 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.417 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 70.9 m -68.53 146.85 52.74 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -175.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.88 -146.42 16.75 Favored Glycine 0 N--CA 1.442 -0.949 0 CA-C-N 114.939 -1.028 . . . . 0.0 113.227 -178.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.498 ' CD ' ' H ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -75.74 -38.63 58.3 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 122.42 0.288 . . . . 0.0 111.65 -177.433 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.83 60.19 2.99 Favored Glycine 0 C--O 1.223 -0.561 0 C-N-CA 121.267 -0.492 . . . . 0.0 112.931 -178.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 35.7 t -153.81 111.3 3.48 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.887 0.375 . . . . 0.0 110.194 179.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 t -103.92 17.48 24.0 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.81 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.7 t -74.93 107.09 6.78 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.738 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.9 -10.34 56.62 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.664 -178.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.22 -36.36 83.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.91 0.386 . . . . 0.0 110.592 178.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.405 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 6.7 p -116.69 -15.2 10.79 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.792 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp -92.43 132.56 36.68 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.116 0.484 . . . . 0.0 111.561 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.0 t -136.25 153.61 51.15 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 177.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.9 t -147.43 154.36 40.73 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.59 0.233 . . . . 0.0 110.476 -178.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -112.73 -14.8 13.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.619 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 83.9 m -67.77 138.82 56.49 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 176.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.6 p -97.65 171.15 8.52 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.426 -171.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.404 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 16.5 m -71.49 -17.06 62.37 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -176.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -76.6 -21.67 55.26 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.931 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . 0.401 ' O ' ' HE2' ' A' ' 47' ' ' LYS . . . 166.66 156.33 9.54 Favored Glycine 0 N--CA 1.434 -1.465 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.237 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 44.1 t -69.47 145.35 52.81 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.401 ' HE2' ' O ' ' A' ' 45' ' ' GLY . 71.8 mmtt -111.83 -35.92 5.58 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.691 0.282 . . . . 0.0 111.531 -177.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.432 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 2.8 p -76.99 -39.67 49.56 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.97 -177.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.87 4.4 19.05 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.657 -0.782 . . . . 0.0 113.468 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.436 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 11.3 mmpt? -90.39 3.32 54.14 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 117.231 0.516 . . . . 0.0 110.373 178.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 63.95 61.45 0.95 Allowed 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.842 -179.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 9.5 p -136.92 145.26 44.07 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.238 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.404 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 40.5 p -132.04 70.15 1.47 Allowed 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.519 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 102.91 164.95 25.94 Favored Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.522 -0.846 . . . . 0.0 112.014 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -61.28 -11.68 20.3 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 C-N-CA 123.555 2.836 . . . . 0.0 113.221 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -69.97 -24.02 63.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.998 0.428 . . . . 0.0 111.321 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.6 m -144.79 29.77 1.21 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.058 0.456 . . . . 0.0 110.57 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 37.5 t -85.87 109.14 18.51 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.032 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 51.5 mttp -73.04 -25.15 60.83 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.659 0.742 . . . . 0.0 109.206 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.9 m -64.52 124.32 21.54 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 114.645 -1.161 . . . . 0.0 111.844 -176.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -97.38 56.38 1.22 Allowed Glycine 0 N--CA 1.443 -0.884 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 41.2 m 68.07 176.32 0.26 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.108 0.563 . . . . 0.0 111.116 -178.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.1 t 65.11 19.48 11.8 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 122.682 0.393 . . . . 0.0 111.658 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . 0.437 ' SG ' ' N ' ' A' ' 65' ' ' SER . 50.0 t -108.25 173.35 6.36 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.854 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.437 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 9.5 m -61.33 -37.73 84.33 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 122.878 0.471 . . . . 0.0 111.863 -178.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.503 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 31.9 p -84.51 17.41 2.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.995 0.426 . . . . 0.0 111.153 -178.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.503 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 43.0 mmtm . . . . . 0 C--O 1.263 1.763 0 CA-C-O 117.704 -1.141 . . . . 0.0 110.809 -179.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp . . . . . 0 CA--C 1.513 -0.453 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.0 m -76.35 153.66 35.63 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-O 121.422 0.629 . . . . 0.0 111.831 -179.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.543 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 43.4 p -90.89 174.28 7.53 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.281 -177.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 m -69.85 -27.87 65.2 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.418 ' HB1' ' C ' ' A' ' 20' ' ' GLN . . . -68.6 -41.11 80.03 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.278 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 44.4 t -70.82 -26.49 63.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.038 0.447 . . . . 0.0 110.255 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.543 ' HG3' ' O ' ' A' ' 11' ' ' THR . 22.2 mtm180 -82.01 -7.94 59.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.191 0.519 . . . . 0.0 110.126 178.202 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 49.0 m -91.87 156.22 17.65 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.371 178.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.447 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 7.5 pt-20 -132.04 125.75 20.26 Favored Pre-proline 0 C--N 1.311 -1.074 0 CA-C-O 120.689 0.28 . . . . 0.0 111.219 -178.472 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.447 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 55.3 Cg_endo -69.3 168.66 64.95 Favored 'Cis proline' 0 C--N 1.349 0.574 0 C-N-CA 123.159 -1.6 . . . . 0.0 112.001 -0.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.2 t -53.61 128.59 29.8 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.418 ' C ' ' HB1' ' A' ' 13' ' ' ALA . 31.0 mm-40 -108.14 19.74 19.56 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.189 -0.46 . . . . 0.0 112.031 -175.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 58.7 m -82.5 9.7 8.74 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -177.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.57 123.19 13.22 Favored Glycine 0 N--CA 1.442 -0.908 0 C-N-CA 120.63 -0.795 . . . . 0.0 111.376 177.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.1 m 72.74 1.83 4.14 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.439 0.696 . . . . 0.0 111.91 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -162.95 80.45 0.48 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 121.182 0.515 . . . . 0.0 110.471 177.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 47.4 t -112.62 137.22 51.18 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.365 177.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -136.95 17.95 3.02 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.973 -177.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 96.4 m -67.31 152.89 44.91 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.385 179.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.2 -144.55 5.64 Favored Glycine 0 N--CA 1.44 -1.035 0 C-N-CA 120.566 -0.826 . . . . 0.0 112.708 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.12 -18.44 23.54 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-O 121.007 0.432 . . . . 0.0 111.194 -179.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -94.57 74.18 1.02 Allowed Glycine 0 N--CA 1.44 -1.088 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.04 178.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.423 ' O ' ' HD2' ' A' ' 37' ' ' LYS . 45.0 t -146.04 119.48 9.04 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.045 0.45 . . . . 0.0 109.917 177.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.8 t -102.66 14.74 31.2 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.057 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.3 t -76.56 118.88 19.66 Favored 'General case' 0 N--CA 1.461 0.122 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.97 -14.91 62.93 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -177.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.8 -52.43 30.21 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -178.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 6.1 p -99.0 -17.57 18.22 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -177.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.423 ' HD2' ' O ' ' A' ' 31' ' ' CYS . 87.9 tttt -87.49 116.06 25.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.073 0.463 . . . . 0.0 111.095 179.237 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.8 t -125.95 -176.68 3.7 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.42 178.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.2 t -160.24 139.29 10.69 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 -89.53 -18.51 26.51 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.558 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 71.9 m -70.67 153.86 42.41 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.358 0.599 . . . . 0.0 111.464 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.7 p -127.5 -169.56 2.07 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.749 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 47.5 m -76.47 7.95 3.96 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.215 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.65 -34.14 77.19 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 175.184 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 123.06 52.42 0.21 Allowed Glycine 0 N--CA 1.438 -1.228 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.775 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 47.8 t 70.45 151.68 0.1 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.377 0.608 . . . . 0.0 111.27 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.2 tmtp? -123.25 -50.45 1.9 Allowed 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.767 -177.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 28.6 p -73.91 -35.34 64.62 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.911 -178.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.41 18.69 6.52 Favored Glycine 0 CA--C 1.522 0.481 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.914 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -101.49 9.46 41.34 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 122.648 -0.324 . . . . 0.0 111.58 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 66.84 34.99 5.14 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.409 0.684 . . . . 0.0 111.457 177.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 3.5 p -111.74 148.3 33.79 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.312 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.5 p -136.04 37.72 2.78 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-O 121.243 0.544 . . . . 0.0 111.509 -177.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.01 157.44 7.23 Favored Glycine 0 C--O 1.219 -0.807 0 C-N-CA 120.516 -0.849 . . . . 0.0 111.998 -178.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -45.31 -55.81 3.21 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.985 3.123 . . . . 0.0 114.971 -178.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -67.18 -35.37 79.51 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.906 0.384 . . . . 0.0 111.094 -177.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.2 m -89.45 9.92 24.63 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.01 -178.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 43.7 t -89.8 134.02 34.4 Favored 'General case' 0 N--CA 1.435 -1.202 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.136 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 47.8 mttt -101.19 -4.97 26.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.32 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.3 m -87.63 152.69 21.97 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.815 -174.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -81.84 -165.34 35.29 Favored Glycine 0 N--CA 1.44 -1.069 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.7 p -82.02 -17.01 48.26 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 117.1 0.45 . . . . 0.0 110.782 -178.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.1 t -99.47 69.05 1.63 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 121.269 0.557 . . . . 0.0 110.307 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 14.4 t -138.99 166.78 23.6 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.984 178.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -69.11 -26.33 64.86 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.321 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.731 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 11.8 p -84.09 6.53 21.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.008 0.432 . . . . 0.0 110.353 179.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.731 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 30.1 mmtp . . . . . 0 C--O 1.263 1.779 0 CA-C-O 117.601 -1.19 . . . . 0.0 110.355 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.554 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 5.6 mptt . . . . . 0 N--CA 1.445 -0.683 0 CA-C-O 120.473 0.178 . . . . 0.0 111.164 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.507 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 37.8 m -62.8 143.42 57.55 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-O 121.174 0.511 . . . . 0.0 111.38 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.438 HG22 ' HB2' ' A' ' 26' ' ' GLN . 40.8 p -90.12 168.67 11.79 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.341 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.7 m -72.35 -14.84 61.83 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.384 0.611 . . . . 0.0 109.499 175.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.14 -35.43 42.06 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.492 177.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.3 t -76.2 -16.47 59.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.682 177.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -86.17 4.72 37.32 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.228 176.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.2 t -114.08 153.54 29.28 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.714 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.492 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -130.82 127.01 22.07 Favored Pre-proline 0 C--N 1.315 -0.893 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.264 -178.701 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.492 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 36.6 Cg_endo -66.24 164.51 65.51 Favored 'Cis proline' 0 C--O 1.242 0.69 0 C-N-CA 123.341 -1.524 . . . . 0.0 111.996 -1.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.462 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 33.9 t -53.73 128.08 28.22 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.091 -178.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -98.6 22.77 9.45 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.573 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.566 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 89.9 m -96.67 22.33 8.25 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.59 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.26 -40.95 77.7 Favored Glycine 0 CA--C 1.52 0.363 0 C-N-CA 121.282 -0.485 . . . . 0.0 113.162 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.9 t -144.36 2.07 1.1 Allowed 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.956 0.408 . . . . 0.0 110.803 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -114.82 21.24 14.54 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.061 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 49.8 t -65.41 144.74 56.87 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.34 0.59 . . . . 0.0 112.042 -176.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.438 ' HB2' HG22 ' A' ' 11' ' ' THR . 34.2 mt-30 -147.34 16.17 1.16 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.378 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 79.9 m -68.82 171.3 8.1 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.435 0.636 . . . . 0.0 112.364 -177.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -115.78 -151.51 9.83 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.874 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -83.82 -18.18 38.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.022 0.411 . . . . 0.0 110.614 179.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.23 42.34 2.74 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 121.091 -0.576 . . . . 0.0 111.926 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.4 t -127.58 126.55 42.31 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-O 121.085 0.469 . . . . 0.0 109.969 -179.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 t -102.57 4.4 38.4 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.501 0.667 . . . . 0.0 110.029 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 35.1 t -82.24 116.0 21.57 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.601 -178.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.86 -0.77 49.73 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.309 -179.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.26 -42.26 69.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.996 0.427 . . . . 0.0 110.697 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.566 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 5.7 p -101.33 -39.93 7.36 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.126 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -73.15 99.99 2.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.105 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.1 t -114.5 -179.13 3.54 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.276 179.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.441 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 34.1 t -163.34 136.2 5.45 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 122.835 0.454 . . . . 0.0 109.803 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -92.58 -15.99 26.23 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.485 ' SG ' ' HB2' ' A' ' 47' ' ' LYS . 88.8 m -69.15 147.4 51.43 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.205 0.526 . . . . 0.0 111.215 178.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 16.5 p -123.32 179.43 4.72 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.474 -175.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.4 m -66.27 -5.25 9.8 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.897 -179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -58.79 -35.23 72.47 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 120.87 0.367 . . . . 0.0 110.213 177.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 136.99 50.62 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.24 -0.981 . . . . 0.0 113.152 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 44.4 t 66.4 166.69 0.21 Allowed 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 120.944 0.402 . . . . 0.0 111.165 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.485 ' HB2' ' SG ' ' A' ' 41' ' ' CYS . 98.1 mttt -139.92 -46.62 0.44 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.849 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.548 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 20.8 p -73.7 -34.61 64.92 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.458 -177.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.73 21.95 4.86 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.502 -0.856 . . . . 0.0 113.136 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.548 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 75.1 mmtt -107.19 6.5 28.77 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.921 0.361 . . . . 0.0 110.463 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 62.5 26.42 15.72 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.979 0.912 . . . . 0.0 111.368 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 11.6 p -95.91 151.77 19.11 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.441 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.9 p -138.19 80.95 1.83 Allowed 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.196 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 88.79 160.26 36.11 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.545 -0.835 . . . . 0.0 111.703 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.441 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 18.1 Cg_endo -59.3 -21.4 60.28 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.87 2.38 . . . . 0.0 112.788 -178.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.21 -30.11 71.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.87 178.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.3 t -139.54 63.96 1.48 Allowed 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 121.505 0.669 . . . . 0.0 109.314 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.408 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 48.8 t -133.3 132.09 40.96 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.257 -179.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -110.72 -3.25 15.89 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.168 0.509 . . . . 0.0 110.004 178.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.4 m -74.29 137.91 43.22 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.389 -176.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.24 169.77 53.77 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.306 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.3 m -64.94 -12.94 55.29 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -177.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.1 m -101.58 17.65 22.28 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.629 0.252 . . . . 0.0 111.627 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . 0.415 ' SG ' ' N ' ' A' ' 65' ' ' SER . 37.5 t -83.49 172.43 12.42 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 111.357 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.415 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 14.7 m -72.72 -20.37 61.22 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.232 -177.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.491 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 23.4 p -89.93 11.45 20.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.876 0.37 . . . . 0.0 111.002 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.408 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 57.9 mmtt . . . . . 0 C--O 1.269 2.117 0 CA-C-O 117.744 -1.122 . . . . 0.0 110.515 -179.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.609 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 29.8 mmtp . . . . . 0 CA--C 1.51 -0.57 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 61.3 m -87.07 157.36 19.43 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.368 0.604 . . . . 0.0 111.692 -177.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.59 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 61.7 p -95.31 175.47 6.58 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.694 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.6 m -70.53 -17.43 62.94 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.007 0.432 . . . . 0.0 110.858 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.17 -40.07 53.38 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.024 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 53.1 t -74.72 -23.22 58.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.171 0.51 . . . . 0.0 110.229 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.59 ' HG3' ' O ' ' A' ' 11' ' ' THR . 86.5 mtt180 -77.41 0.23 23.31 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.76 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 t -102.21 158.58 16.07 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -128.87 123.03 21.74 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-O 120.679 0.276 . . . . 0.0 110.707 178.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -71.33 178.61 28.46 Favored 'Cis proline' 0 C--O 1.235 0.375 0 C-N-CA 123.412 -1.495 . . . . 0.0 111.868 -0.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.8 t -61.66 134.66 57.06 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.639 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -115.17 20.62 14.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.742 -176.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.505 ' HB3' ' HB2' ' A' ' 25' ' ' CYS . 81.3 m -81.13 59.76 4.01 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -178.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.69 -57.67 4.44 Favored Glycine 0 C--N 1.302 -1.335 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 176.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.5 m -125.66 5.74 7.49 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.125 0.488 . . . . 0.0 110.378 178.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -113.8 34.33 4.67 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.341 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.505 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 13.8 t -92.95 115.93 28.58 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 120.059 -0.657 . . . . 0.0 111.328 -179.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.526 ' HB2' ' CG2' ' A' ' 11' ' ' THR . 15.2 mm100 -131.23 14.87 5.11 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.203 -0.908 . . . . 0.0 108.905 177.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.609 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 73.9 m -61.61 140.33 58.16 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.976 -177.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.528 ' H ' ' HB3' ' A' ' 9' ' ' LYS . . . -113.98 -164.23 15.2 Favored Glycine 0 C--N 1.312 -0.789 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.105 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.493 ' CD ' ' H ' ' A' ' 29' ' ' GLU . 1.0 OUTLIER -65.72 134.56 53.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.998 0.428 . . . . 0.0 110.209 179.033 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 117.46 -10.52 14.51 Favored Glycine 0 N--CA 1.438 -1.207 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -175.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 47.5 t -80.0 123.94 28.27 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.9 t -106.78 12.14 29.39 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.337 0.589 . . . . 0.0 110.914 -176.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.8 t -82.44 141.12 33.0 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.098 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -100.17 0.86 41.33 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.061 0.458 . . . . 0.0 110.765 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.48 -51.52 9.86 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.507 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 5.1 p -100.04 -19.4 16.55 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -175.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -75.95 131.55 39.67 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.484 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.559 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 10.8 t -133.26 -176.92 4.3 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.44 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 37.4 t -162.12 153.85 18.69 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 122.793 0.437 . . . . 0.0 109.913 -179.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -112.1 -12.5 13.67 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.4 m -78.25 130.03 35.77 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.2 p -103.91 175.8 5.36 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.479 -174.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.4 t -65.39 -7.2 12.68 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.038 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -71.55 -27.44 63.17 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 153.31 155.09 7.0 Favored Glycine 0 N--CA 1.437 -1.243 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.675 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.6 t -74.77 137.72 42.17 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -118.75 -3.58 10.79 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.369 -0.532 . . . . 0.0 112.332 -177.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.633 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 8.0 p -102.53 -35.72 8.64 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.035 -0.666 . . . . 0.0 110.495 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.98 13.83 7.55 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.182 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.642 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 32.5 mmtp -101.1 -1.67 33.45 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 117.077 0.438 . . . . 0.0 110.61 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 67.47 27.93 7.84 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.993 -179.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 25.0 p -99.3 150.94 21.61 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.707 178.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.2 p -142.71 62.03 1.41 Allowed 'General case' 0 C--N 1.312 -1.051 0 CA-C-O 121.146 0.498 . . . . 0.0 110.364 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 124.44 156.05 9.32 Favored Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.362 -0.695 . . . . 0.0 111.362 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.21 -38.66 81.69 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 123.054 2.503 . . . . 0.0 113.435 -177.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.38 -38.54 87.38 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.955 0.407 . . . . 0.0 111.494 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.9 t -98.37 2.75 48.27 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.598 -178.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 54.0 t -92.48 133.53 35.83 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.138 0.495 . . . . 0.0 111.709 -177.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -116.87 11.02 14.3 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.091 179.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.642 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 18.8 m -83.28 157.61 22.56 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.922 -178.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.481 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -88.4 -166.16 42.01 Favored Glycine 0 N--CA 1.437 -1.3 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 175.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.6 m -79.82 -15.38 57.53 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 117.467 0.634 . . . . 0.0 111.774 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.8 m -99.96 73.68 1.76 Allowed 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.887 0.375 . . . . 0.0 110.99 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.2 t -144.71 165.96 26.57 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.929 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 10.0 m -63.38 -28.97 70.35 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.712 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 16.3 p -92.83 19.29 7.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.076 0.465 . . . . 0.0 110.564 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.559 ' HE3' ' O ' ' A' ' 38' ' ' THR . 48.7 mmtm . . . . . 0 C--O 1.262 1.748 0 CA-C-O 117.681 -1.152 . . . . 0.0 111.041 -179.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 97.9 mttt . . . . . 0 CA--C 1.509 -0.617 0 CA-C-O 121.355 0.597 . . . . 0.0 110.02 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.626 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 38.0 m -74.13 149.44 41.03 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.254 177.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.594 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 61.6 p -77.2 164.26 25.78 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.018 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.0 m -63.15 -24.9 68.1 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.2 -46.47 70.55 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.355 177.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.615 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 47.9 t -70.22 -29.83 66.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.101 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.594 ' HG3' ' O ' ' A' ' 11' ' ' THR . 85.6 mtt180 -70.72 -8.9 55.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.042 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.8 m -90.93 166.41 13.06 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.842 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -132.25 120.47 17.09 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-O 120.47 0.176 . . . . 0.0 110.985 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -73.53 -177.31 19.01 Favored 'Cis proline' 0 C--N 1.351 0.669 0 C-N-CA 123.589 -1.421 . . . . 0.0 112.038 0.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.8 t -60.76 139.68 57.83 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.128 -178.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 81.3 mm-40 -111.55 12.11 21.3 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.223 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.615 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 78.9 m -82.89 26.89 0.57 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.86 0.362 . . . . 0.0 110.749 178.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.03 -47.29 88.62 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.854 -178.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.3 m -128.64 25.28 5.71 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 120.791 0.329 . . . . 0.0 110.649 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -164.89 95.87 0.71 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.746 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 49.1 t -122.84 145.85 48.07 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.574 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.405 ' HB3' HG22 ' A' ' 11' ' ' THR . 13.7 tt0 -149.75 14.84 0.85 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.851 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.626 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 95.1 m -61.7 142.85 56.96 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -177.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.54 -157.79 29.14 Favored Glycine 0 N--CA 1.438 -1.224 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.718 177.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -5.12 50.68 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 117.242 0.521 . . . . 0.0 110.971 178.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -95.26 54.01 1.81 Allowed Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.264 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.5 t -128.99 146.05 51.08 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.2 t -123.89 14.7 9.27 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.178 0.513 . . . . 0.0 110.08 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 8.6 t -92.0 136.76 32.91 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.502 -177.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -96.3 -3.65 43.56 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.129 0.49 . . . . 0.0 110.616 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.1 -31.39 58.67 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.309 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.431 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 7.6 p -114.88 -16.02 11.76 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -177.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.411 ' HE2' ' O ' ' A' ' 55' ' ' PRO . 85.2 tttt -84.77 109.51 18.11 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.949 -0.3 . . . . 0.0 110.755 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 t -121.38 176.2 5.77 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.881 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.466 ' HB3' ' N ' ' A' ' 55' ' ' PRO . 42.6 t -162.85 148.32 12.04 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 122.554 0.342 . . . . 0.0 110.342 -178.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -107.29 -14.88 14.78 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 83.5 m -77.78 144.36 37.2 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 177.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 49.5 p -127.78 -179.78 5.13 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.548 0.213 . . . . 0.0 111.435 -175.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 40.3 m -62.83 -16.08 56.91 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -177.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -66.09 -34.42 78.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.167 0.508 . . . . 0.0 110.11 177.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.93 151.29 6.18 Favored Glycine 0 N--CA 1.435 -1.407 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.741 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 39.6 t -73.99 139.08 44.55 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -108.74 -15.21 14.45 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -177.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.632 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 15.2 p -102.17 -33.21 9.74 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 120.186 -0.605 . . . . 0.0 110.867 -179.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.36 10.46 17.44 Favored Glycine 0 CA--C 1.523 0.564 0 C-N-CA 120.762 -0.732 . . . . 0.0 113.53 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.728 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 31.7 mmtp -90.81 1.64 56.76 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 117.12 0.46 . . . . 0.0 111.519 -179.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 50' ' ' LYS . 37.5 mm-40 70.17 21.41 5.96 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.58 0.55 . . . . 0.0 111.163 -179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.0 p -96.86 146.74 24.65 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.137 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.1 p -135.09 35.74 3.04 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-O 120.929 0.395 . . . . 0.0 110.874 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 158.83 157.28 8.42 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.429 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.466 ' N ' ' HB3' ' A' ' 39' ' ' CYS . 10.8 Cg_endo -52.22 -51.26 11.54 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 124.078 3.185 . . . . 0.0 115.104 -177.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -71.22 -35.04 71.35 Favored 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.938 -176.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.2 m -84.9 -0.91 55.74 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.754 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.488 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 44.2 t -74.68 146.15 42.57 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.909 -179.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -108.98 -4.88 16.34 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.64 -179.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.728 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 11.0 m -81.44 151.35 27.92 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.474 -177.003 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -109.34 62.24 0.29 Allowed Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.956 -0.565 . . . . 0.0 112.306 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.488 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 49.2 m 69.79 -37.95 0.39 Allowed 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 177.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.3 p -84.37 67.69 9.95 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -177.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 35.8 t -146.13 169.97 17.65 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.723 176.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.1 t -75.09 -21.53 58.88 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.384 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.49 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 9.3 p -82.15 22.49 0.8 Allowed 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.246 0.546 . . . . 0.0 110.574 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.488 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 66.8 mmtt . . . . . 0 C--O 1.271 2.208 0 CA-C-O 117.338 -1.315 . . . . 0.0 110.109 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.481 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 27.8 mtpp . . . . . 0 N--CA 1.444 -0.753 0 CA-C-O 120.662 0.268 . . . . 0.0 111.359 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.9 m -77.73 163.95 25.69 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 121.031 0.443 . . . . 0.0 110.119 175.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 65.6 p -104.23 162.78 12.9 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.838 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.2 m -70.19 -13.75 62.32 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.285 0.564 . . . . 0.0 110.313 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.09 -34.38 32.67 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.899 176.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.439 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 43.1 t -75.53 -29.0 59.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.573 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.4 mtt180 -77.67 8.94 3.82 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.261 0.553 . . . . 0.0 111.018 177.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 39.2 t -108.08 150.14 27.55 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.415 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 11.2 pt-20 -127.85 124.37 23.24 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-O 120.601 0.239 . . . . 0.0 110.526 178.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.415 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 7.9 Cg_exo -70.15 169.83 63.1 Favored 'Cis proline' 0 C--O 1.239 0.565 0 C-N-CA 123.069 -1.638 . . . . 0.0 112.007 0.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 13.4 t -56.89 138.18 54.13 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.31 -177.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -112.37 16.25 20.0 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.167 -178.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 56.6 m -89.32 14.25 11.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.293 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.59 -49.1 76.52 Favored Glycine 0 CA--C 1.521 0.432 0 C-N-CA 121.293 -0.48 . . . . 0.0 113.103 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.7 m -113.0 13.13 19.42 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.898 0.38 . . . . 0.0 111.265 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 57.3 tttm -164.93 101.5 0.77 Allowed 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.391 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.428 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 45.1 t -132.18 149.7 52.33 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.196 -179.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -153.38 22.25 0.55 Allowed 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.901 178.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 91.0 m -68.44 144.97 54.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.095 0.474 . . . . 0.0 111.271 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.47 ' HA3' ' HE3' ' A' ' 9' ' ' LYS . . . -81.19 -156.78 15.81 Favored Glycine 0 N--CA 1.441 -0.972 0 CA-C-N 115.48 -0.782 . . . . 0.0 112.816 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.519 ' CD ' ' H ' ' A' ' 29' ' ' GLU . 0.2 OUTLIER -78.55 -31.49 47.46 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.793 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -78.87 60.69 4.13 Favored Glycine 0 N--CA 1.444 -0.803 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.209 178.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 48.4 t -129.11 142.33 50.92 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 177.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.8 t -120.43 12.61 11.67 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.13 0.49 . . . . 0.0 110.753 -178.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.437 ' SG ' ' HB3' ' A' ' 35' ' ' ALA . 48.9 t -90.27 115.88 27.82 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.042 0.448 . . . . 0.0 110.172 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.96 4.73 16.0 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.454 -178.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.437 ' HB3' ' SG ' ' A' ' 33' ' ' CYS . . . -80.77 -42.83 21.13 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.812 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 8.9 p -106.34 -36.13 6.93 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.375 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -80.61 116.42 20.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.207 0.527 . . . . 0.0 110.424 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.417 ' HA ' ' HG3' ' A' ' 55' ' ' PRO . 12.0 t -123.31 -176.2 3.38 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.471 -179.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 41.8 t -154.24 140.35 18.41 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.33 -17.26 27.66 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.299 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 99.6 m -73.81 154.53 39.48 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.126 0.489 . . . . 0.0 111.305 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.2 p -115.44 -173.63 2.37 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.477 -175.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.0 m -71.56 -6.01 37.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.599 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -60.03 -37.91 81.16 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.054 0.454 . . . . 0.0 110.817 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 129.03 56.4 0.1 Allowed Glycine 0 N--CA 1.443 -0.852 0 C-N-CA 119.997 -1.096 . . . . 0.0 112.784 178.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.435 ' SG ' ' N ' ' A' ' 51' ' ' GLU . 44.8 t 72.34 142.04 0.06 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.444 0.64 . . . . 0.0 112.353 178.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 35.9 mmtp -122.88 -40.58 2.41 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.801 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.45 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 13.5 p -72.64 -38.13 67.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.771 0.32 . . . . 0.0 110.89 -178.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 122.97 0.29 9.78 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.134 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -92.87 14.63 16.89 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 117.078 0.439 . . . . 0.0 111.893 -179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.435 ' N ' ' SG ' ' A' ' 46' ' ' CYS . 34.6 mt-10 60.24 36.46 20.8 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.538 -0.755 . . . . 0.0 112.627 175.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 3.5 p -111.13 151.55 28.01 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 120.879 0.371 . . . . 0.0 111.182 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.6 p -137.76 77.79 1.65 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.928 0.394 . . . . 0.0 110.893 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 99.37 155.48 28.6 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.246 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.417 ' HG3' ' HA ' ' A' ' 38' ' ' THR . 83.3 Cg_exo -43.34 -51.72 5.62 Favored 'Trans proline' 0 N--CA 1.478 0.612 0 C-N-CA 124.1 3.2 . . . . 0.0 114.712 -177.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -62.33 -35.8 80.21 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.012 0.434 . . . . 0.0 111.555 -177.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.3 m -99.27 19.85 14.67 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.188 -178.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 53.4 t -103.62 129.61 50.93 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-O 121.143 0.496 . . . . 0.0 110.997 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -109.8 4.31 21.61 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.471 0.653 . . . . 0.0 109.79 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.464 ' HB2' ' HZ3' ' A' ' 67' ' ' LYS . 5.0 m -82.14 156.72 24.34 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.373 -178.014 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.416 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -83.64 -178.7 51.99 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.01 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.1 p -79.63 -6.97 58.21 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.3 m -100.79 10.52 41.04 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.783 0.325 . . . . 0.0 110.937 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 30.8 t -84.64 164.86 18.39 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.944 0.402 . . . . 0.0 111.69 -177.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.6 m -64.16 -34.31 77.78 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.321 0.649 . . . . 0.0 112.185 -177.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.473 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 19.7 p -82.26 20.13 1.1 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.946 0.403 . . . . 0.0 111.033 -179.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.473 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 48.1 mmtm . . . . . 0 C--O 1.263 1.773 0 CA-C-O 117.863 -1.065 . . . . 0.0 110.47 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 14.0 mptt . . . . . 0 N--CA 1.45 -0.454 0 CA-C-O 120.654 0.264 . . . . 0.0 111.326 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.693 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 73.8 m -65.28 137.11 57.34 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.162 0.506 . . . . 0.0 111.138 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.665 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 44.5 p -78.0 175.13 10.37 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.017 -177.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.6 m -70.21 -25.44 63.41 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 175.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.558 ' HB1' ' HB2' ' A' ' 20' ' ' GLN . . . -69.95 -40.55 75.4 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.033 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.529 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 40.5 t -69.35 -25.13 64.04 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.339 0.59 . . . . 0.0 110.773 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.665 ' HG3' ' O ' ' A' ' 11' ' ' THR . 60.0 mtt180 -81.21 -2.66 49.59 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.016 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.1 m -104.68 156.34 18.07 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.506 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 8.8 pt-20 -128.12 129.92 23.63 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-O 120.779 0.323 . . . . 0.0 111.179 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.506 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 44.4 Cg_endo -67.61 169.3 52.94 Favored 'Cis proline' 0 C--N 1.351 0.706 0 C-N-CA 123.143 -1.607 . . . . 0.0 111.15 -0.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.529 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 26.3 t -59.07 133.84 56.46 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-O 121.159 0.504 . . . . 0.0 110.636 -177.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.558 ' HB2' ' HB1' ' A' ' 13' ' ' ALA . 27.4 mm-40 -97.01 12.1 33.73 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.858 -177.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.606 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 91.6 m -96.23 23.66 6.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.314 176.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -46.77 -52.44 11.45 Favored Glycine 0 C--N 1.338 0.667 0 O-C-N 123.438 0.461 . . . . 0.0 113.595 -177.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.1 p -120.97 -20.48 6.86 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 120.857 0.36 . . . . 0.0 110.989 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -114.88 81.35 1.55 Allowed 'General case' 0 CA--C 1.507 -0.696 0 CA-C-O 121.122 0.487 . . . . 0.0 110.585 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.598 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 53.6 t -95.57 143.95 26.44 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.31 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.406 ' HB2' HG21 ' A' ' 11' ' ' THR . 55.0 mt-30 -140.68 19.46 2.34 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.245 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.693 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 85.5 m -77.8 179.17 6.84 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.875 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -129.93 -135.2 3.83 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.318 -179.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.477 ' HA ' ' HA3' ' A' ' 61' ' ' GLY . 0.5 OUTLIER -89.7 -10.44 45.73 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.122 0.487 . . . . 0.0 110.639 179.461 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -94.09 36.94 3.55 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.774 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.423 ' HA ' ' SG ' ' A' ' 10' ' ' CYS . 43.0 t -112.8 135.65 53.3 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.8 t -118.89 12.59 12.92 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-O 121.012 0.434 . . . . 0.0 110.111 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.2 t -81.43 166.26 20.53 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.064 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.06 -7.74 11.29 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 120.936 0.398 . . . . 0.0 110.935 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.24 -54.79 5.41 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.411 -178.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.606 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 3.5 p -82.9 -15.99 49.25 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.797 -178.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.505 ' HE2' ' O ' ' A' ' 55' ' ' PRO . 87.8 tttt -75.0 100.5 4.18 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.073 0.464 . . . . 0.0 110.865 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 t -108.32 -178.77 3.69 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.047 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.1 t -161.48 150.35 15.98 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.412 HD22 ' C ' ' A' ' 66' ' ' CYS . 23.9 m-80 -108.3 -18.71 13.69 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -179.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.1 m -75.36 133.88 41.12 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.0 p -103.53 176.34 5.18 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 120.886 0.374 . . . . 0.0 111.685 -175.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.505 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.6 m -70.04 0.8 5.4 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.847 -178.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -86.96 -22.88 25.32 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.218 0.532 . . . . 0.0 110.095 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 158.59 153.59 6.84 Favored Glycine 0 N--CA 1.436 -1.354 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.006 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 54.1 t -74.05 136.95 43.09 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -107.74 -27.31 10.36 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -177.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.439 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 9.4 p -86.35 -31.82 21.33 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.966 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.19 2.58 33.62 Favored Glycine 0 CA--C 1.522 0.473 0 C-N-CA 120.563 -0.827 . . . . 0.0 113.599 177.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.428 ' O ' ' HE2' ' A' ' 59' ' ' LYS . 45.4 mmtm -88.64 0.25 56.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.061 0.458 . . . . 0.0 110.28 178.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 64.51 65.2 0.65 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.053 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.6 p -136.34 144.19 44.5 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.028 176.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.505 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 22.6 p -131.79 63.71 1.61 Allowed 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.205 0.526 . . . . 0.0 111.097 -179.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.52 159.63 10.39 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 120.831 -0.699 . . . . 0.0 111.705 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.505 ' O ' ' HE2' ' A' ' 37' ' ' LYS . 10.9 Cg_endo -54.01 -40.04 82.81 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 123.212 2.608 . . . . 0.0 113.332 -177.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -67.72 -37.7 82.59 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.898 0.38 . . . . 0.0 110.99 -178.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.2 t -91.49 3.31 55.28 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.948 -178.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 53.1 t -84.77 143.18 29.29 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.109 0.481 . . . . 0.0 110.979 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 50' ' ' LYS . 63.3 pttt -122.77 14.05 10.02 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.338 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 12.2 m -96.04 162.26 13.63 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.577 -178.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.481 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -96.1 -178.38 36.03 Favored Glycine 0 N--CA 1.427 -1.916 0 N-CA-C 109.946 -1.261 . . . . 0.0 109.946 175.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 14.1 m -75.86 25.05 0.12 Allowed 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 117.21 0.505 . . . . 0.0 111.421 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.41 ' H ' ' C ' ' A' ' 61' ' ' GLY . 17.4 m -125.76 19.22 7.91 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.521 -178.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.0 t -102.76 171.4 7.43 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 178.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.3 m -72.13 -22.0 61.39 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.764 0.316 . . . . 0.0 111.397 -178.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.472 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 15.1 p -91.12 26.96 2.0 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.178 0.513 . . . . 0.0 110.279 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.481 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 43.5 mmtm . . . . . 0 C--O 1.263 1.799 0 CA-C-O 117.888 -1.053 . . . . 0.0 111.17 -179.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.561 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 31.2 mmtp . . . . . 0 CA--C 1.507 -0.707 0 CA-C-O 121.0 0.428 . . . . 0.0 110.172 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.479 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 64.2 m -78.46 157.01 29.06 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.151 178.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.4 p -96.1 168.4 10.63 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.777 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.6 m -71.24 -16.89 62.51 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.443 0.64 . . . . 0.0 109.537 175.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.67 -38.36 47.82 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.259 178.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.524 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 50.5 t -71.85 -28.42 63.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.715 179.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 48.2 mtp180 -82.39 9.19 9.55 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.032 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.5 m -108.06 157.57 18.14 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -127.83 121.95 22.22 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.651 0.263 . . . . 0.0 110.996 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.35 175.31 44.19 Favored 'Cis proline' 0 C--N 1.351 0.663 0 C-N-CA 123.246 -1.564 . . . . 0.0 112.048 0.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 20.0 t -61.85 129.91 43.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.082 0.468 . . . . 0.0 110.526 -178.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.0 mm-40 -102.83 11.02 38.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.958 -177.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.524 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 87.0 m -76.72 2.97 12.77 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -56.65 103.38 0.26 Allowed Glycine 0 CA--C 1.518 0.223 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.385 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.5 t 64.33 24.0 13.17 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.481 0.657 . . . . 0.0 110.68 -179.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -144.9 14.55 1.52 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.514 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.501 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 46.4 t -70.11 141.26 52.76 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.07 -175.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -138.65 11.75 2.71 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.172 178.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 64.3 m -63.9 139.86 58.81 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.381 -178.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -81.67 -171.85 46.21 Favored Glycine 0 N--CA 1.44 -1.08 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.89 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.93 17.28 0.34 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.223 0.535 . . . . 0.0 112.214 -178.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -116.04 37.0 3.58 Favored Glycine 0 N--CA 1.439 -1.106 0 N-CA-C 111.508 -0.637 . . . . 0.0 111.508 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.7 t -123.12 156.77 34.33 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 t -131.06 7.23 4.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.331 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 16.5 t -76.81 116.02 17.11 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.07 -3.91 25.77 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.295 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -81.68 -13.48 57.82 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.643 -179.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.516 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 6.3 p -134.38 -31.35 1.09 Allowed 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -177.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -91.51 115.3 27.92 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.441 -0.503 . . . . 0.0 109.781 -177.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.57 164.93 12.06 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.381 -176.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 39.2 t -160.21 159.03 31.06 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.773 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.4 m-80 -123.81 -6.91 7.92 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 95.0 m -73.12 157.78 36.59 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.835 178.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 23.8 p -126.47 -177.36 3.96 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.679 -0.692 . . . . 0.0 111.728 -174.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.1 m -70.88 -1.47 11.88 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.002 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -59.04 -26.48 64.63 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.08 176.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 125.18 42.65 0.32 Allowed Glycine 0 CA--C 1.501 -0.843 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.232 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 48.3 t 69.1 138.96 0.04 OUTLIER 'General case' 0 C--N 1.341 0.207 0 C-N-CA 123.051 0.541 . . . . 0.0 110.395 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.4 mtpt -123.19 1.76 9.15 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.375 -177.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.538 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 2.8 p -111.65 -40.92 4.19 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.023 0.44 . . . . 0.0 110.015 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 119.96 14.63 5.52 Favored Glycine 0 CA--C 1.525 0.681 0 C-N-CA 120.811 -0.709 . . . . 0.0 113.228 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.697 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.3 mmtt -102.18 5.14 40.08 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 117.198 0.499 . . . . 0.0 110.778 178.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.445 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 17.7 tt0 70.93 16.82 6.45 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.387 0.675 . . . . 0.0 110.793 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.492 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 25.9 p -93.59 143.55 26.2 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 120.975 0.417 . . . . 0.0 110.514 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.3 p -124.2 31.78 5.7 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.283 0.563 . . . . 0.0 110.749 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 140.86 171.88 12.74 Favored Glycine 0 N--CA 1.441 -0.972 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 -177.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.55 -29.61 85.54 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.893 2.395 . . . . 0.0 112.628 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -62.57 -37.5 86.43 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.854 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 12.1 m -113.04 3.66 16.27 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -176.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.492 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 48.5 t -74.82 135.22 41.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.787 0.327 . . . . 0.0 110.629 -179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 17.1 ttpp -136.22 33.48 2.82 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.671 -177.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.697 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 2.7 m -96.32 -179.05 4.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.015 0.436 . . . . 0.0 110.05 176.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -99.55 -143.41 14.51 Favored Glycine 0 N--CA 1.432 -1.57 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 174.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.9 p -91.62 -28.77 17.29 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 116.923 0.361 . . . . 0.0 111.205 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.8 m -87.71 67.5 9.22 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -176.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 7.1 t -142.76 155.06 44.79 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.207 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.0 m -70.1 -24.35 63.19 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -175.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.462 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 17.5 p -86.03 7.84 22.95 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.939 0.4 . . . . 0.0 111.191 -178.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.462 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 47.3 mmtm . . . . . 0 C--O 1.262 1.741 0 CA-C-O 117.56 -1.209 . . . . 0.0 111.144 -179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 31.4 mmtp . . . . . 0 N--CA 1.441 -0.901 0 CA-C-O 121.066 0.46 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.621 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 66.3 m -73.43 150.95 41.32 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.041 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 46.9 p -87.11 167.28 14.32 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.744 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.9 m -63.93 -27.26 69.02 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 177.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.68 -43.08 76.89 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.458 178.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.494 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 44.0 t -69.83 -34.9 74.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.921 0.391 . . . . 0.0 110.301 178.163 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -70.31 -14.37 62.56 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.199 179.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.5 m -81.72 151.1 27.66 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.404 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 7.9 pt-20 -129.64 123.22 21.1 Favored Pre-proline 0 C--N 1.313 -1.012 0 CA-C-O 120.726 0.298 . . . . 0.0 111.508 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.404 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 55.4 Cg_endo -69.2 167.56 68.95 Favored 'Cis proline' 0 C--O 1.242 0.687 0 C-N-CA 123.314 -1.536 . . . . 0.0 111.805 -1.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.494 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 49.7 t -52.77 147.08 9.39 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.06 0.457 . . . . 0.0 111.947 -177.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -124.33 15.8 9.01 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.942 -178.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 67.5 m -69.0 -77.34 0.08 Allowed 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.751 0.31 . . . . 0.0 111.625 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 63.7 -106.9 1.52 Allowed Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.501 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.3 m -97.92 -1.18 43.44 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 120.976 0.417 . . . . 0.0 110.847 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -106.37 27.22 8.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.621 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 47.6 t -73.98 142.77 45.82 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.233 0.539 . . . . 0.0 112.224 -177.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -148.79 25.0 0.95 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.164 -0.926 . . . . 0.0 109.964 178.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.621 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 67.7 m -72.27 -175.33 1.52 Allowed 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.109 0.48 . . . . 0.0 111.909 -178.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -117.61 -172.75 16.06 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.757 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -70.86 -12.28 61.45 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 122.858 0.463 . . . . 0.0 111.576 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -96.34 20.06 51.92 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.628 -178.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.0 t -93.49 140.7 29.29 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.075 0.464 . . . . 0.0 110.327 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.0 t -122.3 17.9 10.64 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.129 -178.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.457 ' SG ' ' HB3' ' A' ' 35' ' ' ALA . 45.0 t -87.67 117.61 26.61 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.78 -11.72 60.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.341 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.457 ' HB3' ' SG ' ' A' ' 33' ' ' CYS . . . -66.15 -45.37 81.23 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.019 179.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.463 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 6.1 p -106.34 -17.96 14.13 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.419 ' HD3' ' O ' ' A' ' 55' ' ' PRO . 21.4 ttmm -63.49 107.02 1.03 Allowed 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 178.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.2 t -127.08 152.62 47.04 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 120.819 0.342 . . . . 0.0 110.997 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.438 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 19.8 t -154.26 144.9 22.38 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.591 178.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -98.18 -26.29 14.61 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -178.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 74.7 m -67.96 144.17 55.31 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 177.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 26.8 p -123.09 -172.2 2.45 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.847 -176.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.0 m -70.4 -8.14 48.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.169 0.509 . . . . 0.0 110.575 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -67.09 -28.7 68.39 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.654 175.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.75 157.67 7.27 Favored Glycine 0 N--CA 1.439 -1.165 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.989 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.4 ' SG ' ' N ' ' A' ' 51' ' ' GLU . 42.9 t -74.26 139.13 44.09 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -127.15 -3.82 6.28 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -178.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.432 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 12.3 p -97.6 -29.67 13.3 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.49 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.44 9.01 18.24 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 120.4 -0.905 . . . . 0.0 113.584 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.732 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 47.0 mmtm -98.55 -1.08 41.93 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 117.352 0.576 . . . . 0.0 111.264 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.4 ' N ' ' SG ' ' A' ' 46' ' ' CYS . 48.5 mt-10 66.43 22.67 10.68 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.153 0.581 . . . . 0.0 111.1 -177.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 27.2 p -95.2 142.16 27.96 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.95 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.1 p -121.91 33.93 5.34 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-O 121.282 0.563 . . . . 0.0 110.593 -179.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 144.07 170.61 13.63 Favored Glycine 0 N--CA 1.435 -1.395 0 C-N-CA 120.762 -0.733 . . . . 0.0 111.33 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.438 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 28.6 Cg_endo -62.93 -15.69 49.18 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.834 2.356 . . . . 0.0 112.728 -178.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -66.78 -45.32 78.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.862 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.7 m -113.01 16.7 19.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.057 0.456 . . . . 0.0 110.769 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.438 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 38.9 t -77.82 122.44 25.44 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -124.43 18.03 8.94 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.478 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.732 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 8.3 m -68.58 147.19 52.3 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.218 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -82.29 43.15 2.98 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 120.818 -0.706 . . . . 0.0 113.231 -178.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.6 m 69.09 -48.89 0.59 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.957 0.903 . . . . 0.0 113.033 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.1 t -76.01 76.39 2.88 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.081 0.467 . . . . 0.0 110.18 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.9 t -140.01 170.53 15.69 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.056 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.2 t -76.3 -30.52 57.78 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.322 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.51 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 7.8 p -84.26 17.62 2.48 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 120.96 0.409 . . . . 0.0 111.323 -178.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.51 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 48.6 mmtm . . . . . 0 C--O 1.256 1.409 0 CA-C-O 117.735 -1.126 . . . . 0.0 110.921 179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.452 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 71.2 mmtt . . . . . 0 CA--C 1.505 -0.783 0 CA-C-O 120.613 0.244 . . . . 0.0 111.621 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.2 m -97.23 159.24 15.03 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 121.298 0.57 . . . . 0.0 111.539 -178.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.487 HG21 ' H ' ' A' ' 26' ' ' GLN . 41.9 p -93.55 -178.67 4.79 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.498 -176.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.0 m -80.44 -20.84 42.92 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.308 0.575 . . . . 0.0 109.676 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.2 -35.83 48.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.859 179.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.463 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 43.9 t -71.67 -13.67 61.81 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.712 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.473 ' HG2' ' O ' ' A' ' 11' ' ' THR . 12.5 mmt180 -72.24 -20.59 61.52 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.812 179.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.437 ' HB2' ' HG2' ' A' ' 20' ' ' GLN . 37.2 m -91.72 164.78 13.6 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -175.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.431 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 14.1 pt-20 -140.84 118.04 7.83 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.506 177.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.431 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 13.1 Cg_exo -66.69 171.45 39.7 Favored 'Cis proline' 0 C--N 1.352 0.732 0 C-N-CA 123.1 -1.625 . . . . 0.0 112.033 0.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.463 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 13.7 t -66.28 150.07 49.38 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.854 -175.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.437 ' HG2' ' HB2' ' A' ' 16' ' ' SER . 29.1 mm-40 -113.89 7.06 16.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.489 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.425 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 78.4 m -68.12 -75.61 0.1 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.699 0.285 . . . . 0.0 111.22 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 65.91 -109.23 2.77 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.586 -0.816 . . . . 0.0 111.418 -177.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.5 t -95.19 -17.96 21.3 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.456 0.646 . . . . 0.0 109.28 178.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -92.71 55.93 2.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.94 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 48.1 t -103.06 143.86 32.04 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.701 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.487 ' H ' HG21 ' A' ' 11' ' ' THR . 28.8 mm-40 -139.41 17.45 2.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.084 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 76.3 m -70.61 148.21 48.37 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.144 0.497 . . . . 0.0 111.928 -177.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -98.98 -160.63 29.55 Favored Glycine 0 N--CA 1.441 -1.019 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.552 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -73.28 -4.89 36.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.851 0.358 . . . . 0.0 111.781 -178.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -93.37 22.89 32.6 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.99 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.0 t -115.69 149.48 38.33 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.901 0.382 . . . . 0.0 110.919 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.2 t -133.62 12.58 4.08 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.138 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 37.8 t -72.51 119.96 17.45 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.222 0.534 . . . . 0.0 110.436 -178.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.11 -0.54 22.31 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.607 -178.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.78 -29.26 23.97 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.503 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.425 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 7.6 p -119.88 -26.12 5.69 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -83.29 107.05 15.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.987 0.422 . . . . 0.0 110.361 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.0 t -114.82 175.73 5.36 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.237 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 45.0 t -156.64 154.26 29.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.287 -178.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -114.6 -12.91 12.18 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 81.6 m -77.38 127.66 32.93 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 174.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 70.6 p -93.36 173.67 7.59 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.711 -172.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.537 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.7 m -66.94 -2.6 5.47 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.099 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -80.69 -36.45 32.3 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.987 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 168.09 151.58 7.14 Favored Glycine 0 N--CA 1.442 -0.945 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.669 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.7 t -78.59 138.87 38.57 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 122.48 0.312 . . . . 0.0 110.421 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -129.06 2.16 5.26 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 4.3 p -93.94 -37.68 11.57 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.006 -0.678 . . . . 0.0 109.737 177.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 124.32 -4.35 8.86 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.831 -0.699 . . . . 0.0 113.294 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.811 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 43.0 mmtm -87.62 -1.54 58.02 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 117.384 0.592 . . . . 0.0 111.527 -178.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 63.96 36.93 9.72 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.992 0.901 . . . . 0.0 109.865 -178.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 28.6 p -108.84 141.26 41.13 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.443 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.537 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 36.1 p -131.13 79.98 1.92 Allowed 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 177.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 105.72 159.9 22.83 Favored Glycine 0 N--CA 1.437 -1.263 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.468 -177.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -52.21 -31.15 44.64 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 123.437 2.758 . . . . 0.0 113.806 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -63.95 -44.44 92.82 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.988 0.423 . . . . 0.0 111.602 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.534 ' HB2' ' H ' ' A' ' 53' ' ' THR . 19.5 m -89.62 -12.66 39.06 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.691 -178.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 49.0 t -68.05 131.56 45.67 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.948 -177.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -118.13 14.96 14.09 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.592 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.811 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.8 m -103.34 164.41 11.66 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.278 -176.019 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -96.85 -166.3 33.11 Favored Glycine 0 N--CA 1.439 -1.121 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 177.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.6 m -85.1 25.24 0.99 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 117.106 0.453 . . . . 0.0 111.312 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.5 m -131.48 20.08 4.75 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 120.739 0.304 . . . . 0.0 111.638 -178.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . 0.423 ' SG ' ' N ' ' A' ' 65' ' ' SER . 46.0 t -99.68 171.26 8.01 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.79 0.329 . . . . 0.0 110.953 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.423 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 51.0 m -60.89 -34.51 74.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.556 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.448 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 31.9 p -82.89 21.84 0.99 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 120.969 0.414 . . . . 0.0 111.104 -179.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.448 ' HD3' ' O ' ' A' ' 66' ' ' CYS . 54.8 mmtt . . . . . 0 C--O 1.261 1.672 0 CA-C-O 117.494 -1.241 . . . . 0.0 110.061 178.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp . . . . . 0 C--O 1.237 0.438 0 CA-C-O 120.868 0.366 . . . . 0.0 111.465 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.6 m -72.85 160.53 32.0 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.402 0.62 . . . . 0.0 111.494 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.501 HG21 ' HB2' ' A' ' 26' ' ' GLN . 77.6 p -97.47 170.13 9.26 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.906 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.8 m -64.77 -26.22 68.26 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.11 0.481 . . . . 0.0 109.971 177.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.82 -48.21 72.47 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.597 177.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.1 t -73.56 -24.66 60.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.044 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -79.57 -1.81 39.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.011 0.434 . . . . 0.0 111.424 179.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.3 m -105.35 150.0 25.59 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 176.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.406 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 10.7 pt-20 -119.09 129.8 25.19 Favored Pre-proline 0 C--N 1.322 -0.594 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.926 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.406 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 4.9 Cg_exo -72.45 175.04 45.57 Favored 'Cis proline' 0 C--O 1.236 0.395 0 C-N-CA 123.231 -1.571 . . . . 0.0 111.482 -0.195 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.9 t -55.39 135.33 50.35 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.009 0.433 . . . . 0.0 111.06 -178.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -110.55 20.11 18.03 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.694 -177.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.441 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 81.8 m -87.7 27.45 1.13 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.859 0.362 . . . . 0.0 110.695 178.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.98 -42.08 99.64 Favored Glycine 0 CA--C 1.52 0.389 0 CA-C-N 116.1 -0.5 . . . . 0.0 113.224 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.3 p -128.96 15.76 6.29 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.969 0.414 . . . . 0.0 111.125 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -162.16 101.28 1.1 Allowed 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.91 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 53.7 t -120.75 121.16 37.62 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-O 120.926 0.394 . . . . 0.0 109.952 177.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.501 ' HB2' HG21 ' A' ' 11' ' ' THR . 82.9 mt-30 -129.63 19.22 5.68 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.104 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.542 ' O ' ' HB2' ' A' ' 62' ' ' SER . 70.8 m -64.93 134.11 53.26 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.97 -91.42 0.37 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.822 -177.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -139.25 159.53 41.94 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 84.11 26.07 42.1 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 110.761 -0.936 . . . . 0.0 110.761 -177.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.8 t -124.08 132.85 53.71 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.207 -0.497 . . . . 0.0 110.263 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.2 t -165.55 71.87 0.16 Allowed 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.492 0.663 . . . . 0.0 111.171 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.42 ' SG ' ' HB3' ' A' ' 35' ' ' ALA . 10.4 p -101.23 8.82 42.37 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 121.241 0.543 . . . . 0.0 110.318 178.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 69.4 -16.87 0.24 Allowed 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 114.797 -1.092 . . . . 0.0 113.43 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.42 ' HB3' ' SG ' ' A' ' 33' ' ' CYS . . . -76.78 -54.07 7.1 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -178.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.441 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 26.9 p -92.74 -25.2 18.3 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.885 0.374 . . . . 0.0 110.925 -179.499 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -49.09 113.17 0.74 Allowed 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.424 -178.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.5 t -124.68 165.12 18.48 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.448 -178.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.7 t -162.58 139.47 7.84 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -98.8 -10.05 23.55 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.725 0.297 . . . . 0.0 111.478 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 70.8 m -74.33 139.41 44.14 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 177.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 76.8 p -112.07 -174.09 2.39 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.578 -176.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.1 m -70.5 3.73 2.84 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.127 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -58.63 -36.71 74.51 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.148 0.499 . . . . 0.0 109.71 176.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 132.04 40.61 0.21 Allowed Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.257 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 43.2 t 71.47 148.01 0.08 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.98 0.512 . . . . 0.0 111.37 -178.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -126.59 -16.36 5.32 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.887 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.5 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 14.4 p -95.45 -36.06 11.47 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.464 -0.494 . . . . 0.0 111.503 -177.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.31 -3.86 20.18 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.215 -0.993 . . . . 0.0 112.908 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.482 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 76.0 mmtt -82.67 -4.5 57.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.911 0.386 . . . . 0.0 110.042 178.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 67.08 67.91 0.41 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.298 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.4 p -139.34 154.76 47.94 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.265 178.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.3 p -139.59 81.47 1.83 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.819 0.342 . . . . 0.0 111.18 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 98.58 160.46 29.97 Favored Glycine 0 C--N 1.315 -0.637 0 C-N-CA 120.548 -0.834 . . . . 0.0 112.03 178.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -56.98 -36.79 99.41 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.047 2.498 . . . . 0.0 112.655 -178.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -75.45 -11.5 60.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.198 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.6 m -129.05 25.93 5.52 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.121 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.461 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 47.1 t -103.34 150.91 23.33 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.423 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -121.15 -9.22 9.18 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-O 121.886 0.85 . . . . 0.0 108.726 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.9 m -86.32 144.17 27.51 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 114.645 -1.161 . . . . 0.0 111.511 -174.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -80.97 176.86 54.57 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.542 ' HB2' ' O ' ' A' ' 27' ' ' CYS . 18.2 m -66.4 -7.14 17.3 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 117.016 0.408 . . . . 0.0 111.778 -178.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.3 m -100.56 35.98 2.01 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.333 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 22.7 t -112.53 174.27 5.97 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 120.761 0.315 . . . . 0.0 111.081 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.0 m -71.43 -25.19 62.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.69 -178.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.5 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 32.1 p -87.02 16.91 4.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.822 0.344 . . . . 0.0 111.043 -179.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.461 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 53.8 mmtt . . . . . 0 C--O 1.257 1.452 0 CA-C-O 117.525 -1.226 . . . . 0.0 110.763 -179.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.4 mttp . . . . . 0 CA--C 1.498 -1.054 0 CA-C-O 121.52 0.676 . . . . 0.0 110.642 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.3 m -117.6 156.32 28.33 Favored 'General case' 0 C--N 1.273 -2.751 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.198 177.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.607 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 82.2 p -83.46 175.1 10.06 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.054 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.2 m -76.91 -16.39 59.4 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 176.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.58 -42.91 40.87 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.558 178.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 50.0 t -69.37 -27.72 65.57 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.186 0.517 . . . . 0.0 110.223 178.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.607 ' HG3' ' O ' ' A' ' 11' ' ' THR . 37.6 mtt180 -85.46 1.86 47.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.392 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.7 t -94.33 161.68 14.14 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.416 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 8.0 pt-20 -122.28 115.94 29.9 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-O 120.537 0.208 . . . . 0.0 110.646 179.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 3.8 Cg_exo -79.14 -178.09 22.74 Favored 'Cis proline' 0 C--N 1.351 0.664 0 C-N-CA 124.068 -1.222 . . . . 0.0 111.717 -0.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.7 t -58.81 123.43 16.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.017 0.436 . . . . 0.0 110.001 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -101.07 18.76 18.93 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.655 -176.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.422 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 72.7 m -83.33 9.4 11.0 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -178.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.83 -36.95 93.96 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.507 -0.854 . . . . 0.0 111.224 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.7 m -97.85 -32.84 11.49 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 120.592 0.234 . . . . 0.0 111.324 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 9.5 ptpp? -139.04 103.75 4.86 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.14 0.495 . . . . 0.0 111.673 -178.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 44.5 t -112.39 114.88 27.83 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-O 121.2 0.524 . . . . 0.0 109.801 176.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.417 ' H ' HG21 ' A' ' 11' ' ' THR . 97.5 mt-30 -127.39 22.97 6.44 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.461 -177.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 98.2 m -61.31 157.62 16.14 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.666 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.33 -101.92 1.29 Allowed Glycine 0 N--CA 1.437 -1.269 0 C-N-CA 120.587 -0.816 . . . . 0.0 115.115 -174.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.576 ' HG3' ' H ' ' A' ' 30' ' ' GLY . 5.4 pt-20 -105.71 -84.34 0.5 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -172.212 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.576 ' H ' ' HG3' ' A' ' 29' ' ' GLU . . . -83.99 66.76 3.84 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 121.003 -0.617 . . . . 0.0 113.909 -175.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.1 t -74.43 139.49 44.02 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 176.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.7 t -112.39 14.75 20.4 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 121.298 0.57 . . . . 0.0 110.93 -176.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 43.7 t -96.16 148.83 22.3 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.697 178.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.9 5.94 26.84 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.869 0.366 . . . . 0.0 110.815 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -84.86 -44.91 12.79 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.035 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.422 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 6.0 p -101.47 -5.02 25.79 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.867 -178.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -81.85 115.63 21.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.868 0.366 . . . . 0.0 110.32 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 t -126.46 171.67 10.84 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.836 -179.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.402 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 48.0 t -155.95 148.5 23.85 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -179.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -109.65 -12.47 14.65 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -178.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 73.9 m -79.17 133.99 36.71 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.8 p -100.34 176.31 5.41 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-O 120.838 0.351 . . . . 0.0 111.514 -175.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.585 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 50.2 m -74.33 6.56 3.52 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.259 0.552 . . . . 0.0 110.899 178.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -85.84 -30.02 23.28 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.519 176.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 161.2 151.5 6.27 Favored Glycine 0 N--CA 1.437 -1.285 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.74 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.3 t -72.38 143.38 48.6 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -121.63 -25.72 5.05 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.471 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 8.1 p -77.97 -34.68 50.85 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.923 -177.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.76 -0.49 27.43 Favored Glycine 0 CA--C 1.523 0.565 0 C-N-CA 120.535 -0.84 . . . . 0.0 113.023 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -90.2 0.08 57.36 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.917 0.358 . . . . 0.0 110.729 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 64.38 62.72 0.8 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.966 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.9 p -134.43 154.97 51.11 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.412 176.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.585 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 19.3 p -137.7 51.13 1.92 Allowed 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.396 0.617 . . . . 0.0 110.78 -178.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 128.12 164.9 11.7 Favored Glycine 0 N--CA 1.439 -1.114 0 C-N-CA 120.838 -0.696 . . . . 0.0 111.363 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.402 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 16.8 Cg_endo -57.77 -20.85 45.17 Favored 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 122.968 2.445 . . . . 0.0 113.632 -178.022 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -74.42 -41.85 60.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.902 0.382 . . . . 0.0 111.168 -179.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.7 p -98.29 1.08 46.79 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.173 0.511 . . . . 0.0 111.104 -178.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 43.4 t -86.03 129.9 34.7 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.943 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -117.96 7.18 12.25 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.799 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 5.6 m -75.14 154.7 37.62 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.813 -178.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -84.07 -156.05 22.88 Favored Glycine 0 N--CA 1.441 -1.0 0 C-N-CA 120.81 -0.709 . . . . 0.0 111.838 178.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 p -86.89 -8.81 56.92 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 120.745 0.307 . . . . 0.0 111.704 -178.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.7 m -115.37 60.34 0.7 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.133 0.492 . . . . 0.0 111.533 -177.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . 0.443 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 39.6 t -126.19 167.65 15.14 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.815 177.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 31.8 t -61.76 -32.77 73.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.388 -178.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.471 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 27.3 p -88.56 22.27 2.64 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 120.799 0.333 . . . . 0.0 111.404 -178.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.443 ' HG2' ' HB3' ' A' ' 64' ' ' CYS . 52.4 mmtt . . . . . 0 C--O 1.257 1.493 0 CA-C-O 117.458 -1.258 . . . . 0.0 110.778 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.486 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 5.9 tmtt? . . . . . 0 CA--C 1.511 -0.541 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.485 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 62.8 m -65.39 147.31 53.65 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.676 178.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.594 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 68.4 p -88.86 171.07 10.19 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.851 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.0 m -67.21 -26.87 66.82 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.393 0.616 . . . . 0.0 109.604 176.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.421 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . . . -69.82 -40.2 76.05 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.352 -179.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 50.4 t -74.36 -20.63 60.02 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.361 0.601 . . . . 0.0 110.518 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.594 ' HG3' ' O ' ' A' ' 11' ' ' THR . 62.4 mtt180 -84.29 0.92 47.21 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.206 0.526 . . . . 0.0 109.948 178.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.2 m -102.78 159.06 15.81 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.493 178.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -128.8 124.38 22.51 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-O 120.7 0.286 . . . . 0.0 111.317 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.22 -178.65 21.11 Favored 'Cis proline' 0 C--N 1.351 0.679 0 C-N-CA 123.283 -1.549 . . . . 0.0 111.618 -1.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.9 t -61.72 135.31 57.56 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 120.887 0.375 . . . . 0.0 110.697 -178.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.3 mm-40 -112.08 16.96 19.99 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.802 -177.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.439 ' HB3' ' HB2' ' A' ' 25' ' ' CYS . 93.2 m -86.51 26.08 1.13 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -177.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.46 -42.99 99.23 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 120.527 -0.844 . . . . 0.0 111.602 178.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.5 p -139.39 20.04 2.57 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.308 0.575 . . . . 0.0 110.321 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 57.3 mttm -131.67 31.13 4.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.815 -177.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.439 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 18.1 t -91.82 145.63 24.41 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -174.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -156.81 16.72 0.3 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.192 178.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.486 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 99.6 m -64.99 164.15 13.28 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -176.322 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -146.3 -145.0 4.16 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 114.965 -1.016 . . . . 0.0 111.346 -179.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -68.02 154.14 42.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.12 0.46 . . . . 0.0 110.324 177.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.55 -33.8 5.6 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -174.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 24.0 t -74.24 147.78 42.13 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 t -145.12 27.19 1.29 Allowed 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.5 0.667 . . . . 0.0 109.762 -178.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 47.6 t -94.86 119.47 33.48 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.26 -176.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.24 -7.72 48.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.709 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.18 -27.46 60.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.663 -0.244 . . . . 0.0 111.456 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 10.1 p -134.64 11.47 3.72 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 112.33 0.492 . . . . 0.0 112.33 -177.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.0 mmtp -91.09 138.71 31.39 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.83 133.32 37.7 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.97 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 27.3 t -150.88 145.51 25.7 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.198 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -101.63 -19.75 15.31 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 121.018 -0.273 . . . . 0.0 111.732 179.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 74.0 m -74.39 133.3 42.48 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.8 p -109.89 -173.77 2.33 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.048 -175.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.4 m -69.66 -14.69 62.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.438 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.68 -40.06 95.9 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.916 177.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 164.07 155.2 8.17 Favored Glycine 0 N--CA 1.43 -1.759 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.42 179.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 47.0 t -77.49 130.43 36.98 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 178.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -105.68 -26.52 11.78 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.552 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 8.3 p -78.89 -40.99 30.8 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.744 -177.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.91 12.82 10.79 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.045 178.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.476 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 74.8 mmtt -95.67 3.75 53.66 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.989 0.394 . . . . 0.0 110.549 178.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 34.0 tt0 66.12 29.64 9.78 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.929 178.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.5 p -102.19 150.99 22.73 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.564 178.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.8 p -141.11 66.05 1.38 Allowed 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.425 0.631 . . . . 0.0 110.255 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 121.24 154.52 9.27 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.563 179.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -53.65 -31.66 61.21 Favored 'Trans proline' 0 N--CA 1.48 0.728 0 C-N-CA 124.146 3.231 . . . . 0.0 115.039 -176.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -69.13 -41.89 76.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.866 0.365 . . . . 0.0 111.191 -178.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.6 m -96.69 0.02 49.03 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.804 -177.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.462 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 14.9 t -92.24 126.15 37.2 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.082 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -119.41 14.23 12.82 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.557 177.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 20.7 m -69.61 150.23 47.28 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.36 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -69.59 164.88 50.68 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.389 -179.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.8 p -72.93 -3.3 25.0 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.202 0.525 . . . . 0.0 111.606 -178.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.2 t -111.94 13.01 20.81 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.294 0.568 . . . . 0.0 109.78 178.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 65' ' ' SER . 47.1 t -73.85 169.72 16.81 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.828 -177.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.401 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 8.6 m -63.89 -34.49 78.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.789 -178.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.552 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 21.6 p -87.43 25.11 1.48 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.713 0.292 . . . . 0.0 111.324 -178.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.462 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 61.1 mmtt . . . . . 0 C--O 1.271 2.195 0 CA-C-O 118.087 -0.959 . . . . 0.0 110.866 179.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp . . . . . 0 CA--C 1.51 -0.573 0 CA-C-O 121.334 0.588 . . . . 0.0 109.748 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.507 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 35.7 m -73.75 166.07 23.97 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.466 -176.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.55 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 72.5 p -90.61 173.32 8.11 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.231 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.1 m -71.81 -20.44 61.84 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 120.956 0.408 . . . . 0.0 109.997 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.89 -38.67 37.01 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.829 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.7 t -67.07 -20.72 65.87 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.225 0.536 . . . . 0.0 110.04 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.55 ' HG2' ' O ' ' A' ' 11' ' ' THR . 27.9 mmt180 -67.36 -25.94 66.22 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.048 177.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.2 m -85.75 147.08 26.5 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.035 -179.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.542 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 10.2 pt-20 -132.15 126.91 20.75 Favored Pre-proline 0 C--N 1.32 -0.699 0 CA-C-O 120.678 0.275 . . . . 0.0 111.052 -179.619 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 30.6 Cg_endo -63.25 160.53 60.41 Favored 'Cis proline' 0 C--O 1.241 0.662 0 C-N-CA 123.27 -1.554 . . . . 0.0 112.302 -0.694 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 32.3 t -52.96 149.15 6.78 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.888 0.743 . . . . 0.0 112.167 -176.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -122.7 14.18 10.09 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -176.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 63.8 m -61.31 -67.97 0.36 Allowed 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.027 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 60.04 -96.34 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 121.084 -0.579 . . . . 0.0 112.31 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.3 t -91.35 -29.24 17.22 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.747 0.308 . . . . 0.0 110.698 179.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -103.18 73.86 1.25 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -177.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 42.4 t -103.02 136.42 42.88 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 174.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.432 ' HB2' HG22 ' A' ' 11' ' ' THR . 53.1 mt-30 -142.93 22.49 1.93 Allowed 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.507 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 91.3 m -69.48 143.52 53.48 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.605 -178.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.98 -171.27 47.16 Favored Glycine 0 N--CA 1.433 -1.557 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 176.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -63.75 -21.79 66.58 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.092 0.473 . . . . 0.0 110.633 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.68 63.27 4.48 Favored Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.301 178.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 50.4 t -133.02 128.64 36.77 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 178.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.8 t -106.35 9.27 31.91 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.082 0.468 . . . . 0.0 110.61 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 36.9 t -91.64 129.17 37.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.129 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -96.91 7.06 47.46 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.961 0.41 . . . . 0.0 111.132 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -82.46 -37.62 25.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.135 0.493 . . . . 0.0 111.006 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 9.9 p -103.04 -41.43 6.11 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.989 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.5 ttpt -69.38 103.16 1.93 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.161 0.505 . . . . 0.0 110.535 -179.045 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.8 t -106.15 169.01 8.75 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.375 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.9 t -149.91 145.0 26.26 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -178.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -99.43 -24.16 14.88 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -179.34 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.2 m -66.41 140.21 58.04 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 75.0 p -113.66 177.64 4.56 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.88 0.371 . . . . 0.0 111.507 -175.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.528 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 17.6 m -70.32 -9.66 56.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.869 179.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -69.44 -40.71 77.03 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 176.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 170.28 149.27 6.3 Favored Glycine 0 N--CA 1.44 -1.073 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.885 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.1 t -69.95 146.64 51.01 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 178.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -115.34 -38.71 3.74 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.66 -177.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.544 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 11.7 p -75.37 -35.47 61.1 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.359 -176.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.8 -0.15 30.41 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.601 -0.809 . . . . 0.0 113.014 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.435 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.1 mmtt -82.8 0.23 44.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.863 0.363 . . . . 0.0 110.393 179.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 67.34 50.32 0.97 Allowed 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.705 178.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 17.7 p -124.74 152.85 43.27 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.238 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.528 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 23.7 p -134.03 38.34 3.18 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-O 121.199 0.523 . . . . 0.0 110.966 -178.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 142.78 161.95 9.04 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -177.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -50.04 -42.92 44.31 Favored 'Trans proline' 0 N--CA 1.481 0.739 0 C-N-CA 123.411 2.741 . . . . 0.0 113.918 -177.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -65.4 -38.29 89.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.911 0.386 . . . . 0.0 111.5 -178.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.6 t -92.64 8.95 36.85 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.96 0.409 . . . . 0.0 110.126 -179.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 50.3 t -100.4 136.19 40.66 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.764 -178.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -126.43 16.71 7.66 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.653 0.74 . . . . 0.0 109.376 178.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.435 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 11.8 m -83.26 149.54 26.72 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.072 -178.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -83.12 -155.69 19.64 Favored Glycine 0 N--CA 1.443 -0.882 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 176.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 28.6 m -78.64 -33.5 47.19 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 120.849 0.357 . . . . 0.0 111.139 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.1 m -83.75 67.85 9.67 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.991 -177.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 11.2 t -142.45 161.99 36.62 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-O 120.933 0.397 . . . . 0.0 111.028 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.9 m -68.17 -33.25 74.11 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.998 -177.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.544 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 16.0 p -84.18 11.42 8.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.696 0.284 . . . . 0.0 111.443 -177.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm . . . . . 0 C--O 1.259 1.587 0 CA-C-O 117.246 -1.359 . . . . 0.0 111.341 -179.296 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt . . . . . 0 N--CA 1.449 -0.516 0 CA-C-O 120.886 0.374 . . . . 0.0 110.347 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.406 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 86.7 m -70.68 165.88 21.98 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.427 178.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.569 HG21 ' H ' ' A' ' 26' ' ' GLN . 55.2 p -100.96 174.32 6.07 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.372 -179.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.1 m -74.87 -20.2 59.84 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 176.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.49 ' HB1' ' C ' ' A' ' 20' ' ' GLN . . . -74.72 -33.04 62.31 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.374 178.262 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.519 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 42.7 t -74.38 -12.38 60.5 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.596 0.712 . . . . 0.0 109.325 177.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.0 mmt180 -86.15 -1.0 57.02 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.953 176.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.3 m -96.54 154.4 17.3 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 120.847 0.356 . . . . 0.0 111.1 -178.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -136.26 112.46 10.21 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.755 178.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -66.82 165.28 66.54 Favored 'Cis proline' 0 C--N 1.356 0.927 0 C-N-CA 123.607 -1.414 . . . . 0.0 112.417 -0.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.519 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 5.1 t -57.81 151.84 16.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.494 -176.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.49 ' C ' ' HB1' ' A' ' 13' ' ' ALA . 27.8 mm-40 -129.52 17.51 5.88 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -174.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.0 m -66.74 -76.6 0.08 Allowed 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 57.47 -114.36 5.46 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 121.036 -0.602 . . . . 0.0 112.66 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.4 p -76.53 -17.99 58.95 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.84 0.352 . . . . 0.0 111.351 -178.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -101.13 20.87 14.84 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.348 -177.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.0 t -72.93 119.24 16.89 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 121.442 0.639 . . . . 0.0 111.122 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.569 ' H ' HG21 ' A' ' 11' ' ' THR . 76.4 mt-30 -121.42 6.75 10.1 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.833 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.406 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 93.8 m -55.87 117.52 3.76 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.368 -178.185 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -87.76 -170.52 46.27 Favored Glycine 0 N--CA 1.44 -1.088 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.009 -179.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -63.84 115.01 4.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.411 0.624 . . . . 0.0 110.349 179.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 143.16 -14.1 2.33 Favored Glycine 0 N--CA 1.442 -0.937 0 N-CA-C 110.934 -0.866 . . . . 0.0 110.934 -177.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.3 t -75.27 151.39 38.37 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 177.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.6 t -136.72 15.7 3.12 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 121.537 0.685 . . . . 0.0 109.921 -178.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.5 t -93.28 122.97 36.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.269 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -84.67 5.98 25.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -177.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.99 -34.62 32.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.141 0.496 . . . . 0.0 110.781 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 2.6 p -108.72 -33.2 7.06 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.197 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -63.2 110.5 1.88 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.656 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.3 t -111.29 170.0 8.41 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.518 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 41.7 t -157.06 149.23 22.92 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -116.5 -7.67 11.63 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 72.4 m -81.64 132.15 35.29 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 32.7 p -112.98 177.84 4.49 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-O 120.622 0.248 . . . . 0.0 111.596 -174.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.4 p -60.09 -16.99 36.53 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.386 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -57.59 -37.77 73.77 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 176.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 154.85 152.66 6.21 Favored Glycine 0 N--CA 1.43 -1.766 0 N-CA-C 110.534 -1.027 . . . . 0.0 110.534 -179.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 43.3 t -67.87 144.89 55.08 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -117.35 -21.48 8.68 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.572 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 12.2 p -89.76 -32.42 16.97 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.13 -177.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.8 -5.31 14.17 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.469 -0.872 . . . . 0.0 113.252 178.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.681 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 67.2 mmtt -79.99 -5.23 55.34 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.932 0.366 . . . . 0.0 111.05 -179.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 68.6 23.89 7.08 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.775 -178.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 25.5 p -93.18 151.29 19.92 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.266 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.3 p -139.46 81.85 1.85 Allowed 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.078 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.23 153.48 15.28 Favored Glycine 0 C--O 1.223 -0.539 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.03 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -53.43 -40.75 77.33 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 123.324 2.683 . . . . 0.0 113.755 -177.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -73.24 -23.13 60.31 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.017 0.437 . . . . 0.0 111.501 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.1 t -105.0 12.11 32.66 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.222 0.534 . . . . 0.0 109.974 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.424 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 37.1 t -101.63 150.72 22.81 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.713 -177.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -110.43 -27.54 8.97 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.166 0.508 . . . . 0.0 109.818 176.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.681 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.0 OUTLIER -63.4 126.7 28.34 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.746 -178.504 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -86.95 -60.61 1.66 Allowed Glycine 0 N--CA 1.442 -0.943 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.917 -179.299 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.7 t -157.12 171.35 20.6 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.8 m 64.85 23.77 12.69 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.446 0.698 . . . . 0.0 111.969 178.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . 0.433 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 46.3 t -106.58 169.76 8.34 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 120.884 -0.327 . . . . 0.0 110.798 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.402 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 36.2 m -71.36 -22.14 61.94 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.075 -178.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.572 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 18.4 p -93.68 18.29 10.41 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.867 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.433 ' HG2' ' HB3' ' A' ' 64' ' ' CYS . 63.2 mmtt . . . . . 0 C--O 1.261 1.708 0 CA-C-O 117.478 -1.249 . . . . 0.0 110.051 179.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.573 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 88.4 mttt . . . . . 0 N--CA 1.444 -0.726 0 CA-C-O 120.674 0.273 . . . . 0.0 111.327 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.564 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 89.8 m -77.65 153.81 32.78 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 176.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.447 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 46.9 p -91.72 168.06 11.74 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.799 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.0 m -67.91 -20.8 65.13 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.189 0.518 . . . . 0.0 109.768 177.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.49 -38.55 59.46 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.735 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.483 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 52.9 t -70.82 -22.46 62.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.371 0.605 . . . . 0.0 110.016 178.525 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.447 ' HG3' ' O ' ' A' ' 11' ' ' THR . 40.2 mtp180 -89.74 20.29 4.17 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.983 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.5 m -113.47 171.56 7.49 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.564 178.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.423 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 13.4 pt-20 -129.83 112.89 17.54 Favored Pre-proline 0 CA--C 1.54 0.56 0 CA-C-O 120.675 0.274 . . . . 0.0 110.958 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.423 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 6.1 Cg_exo -79.27 -172.8 11.72 Favored 'Cis proline' 0 C--N 1.348 0.535 0 C-N-CA 123.89 -1.296 . . . . 0.0 111.598 -0.211 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.7 t -61.15 137.36 58.24 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.763 0.316 . . . . 0.0 110.158 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -121.35 26.78 8.69 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.429 -175.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.483 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 77.6 m -88.34 17.71 5.02 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.746 0.308 . . . . 0.0 111.622 -178.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.38 107.1 1.33 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 121.296 -0.478 . . . . 0.0 113.145 -178.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.6 m 64.36 18.54 11.37 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.083 0.553 . . . . 0.0 111.768 178.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -146.01 29.51 1.09 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.822 0.82 . . . . 0.0 108.811 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 34.1 t -84.98 149.5 25.56 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.362 -175.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.1 mm-40 -146.41 14.84 1.27 Allowed 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.339 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.573 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 60.0 m -66.44 136.37 55.62 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 121.247 0.546 . . . . 0.0 112.153 -178.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -106.21 -151.44 19.13 Favored Glycine 0 N--CA 1.44 -1.083 0 CA-C-N 115.195 -0.911 . . . . 0.0 112.1 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.481 ' HG2' ' HD2' ' A' ' 9' ' ' LYS . 13.6 pt-20 -65.05 155.12 35.77 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.952 0.406 . . . . 0.0 110.314 178.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.76 -35.46 4.83 Favored Glycine 0 N--CA 1.444 -0.811 0 N-CA-C 110.779 -0.929 . . . . 0.0 110.779 -177.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.8 t -80.96 128.93 34.24 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 121.059 0.457 . . . . 0.0 110.301 178.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.45 ' HA ' ' NZ ' ' A' ' 37' ' ' LYS . 6.4 t -123.56 18.45 9.62 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 121.407 0.622 . . . . 0.0 110.101 177.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 52.7 t -63.85 123.95 20.26 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.568 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.19 -10.46 59.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.991 -177.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.2 -41.47 61.36 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -178.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.6 p -111.37 -13.48 13.9 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -177.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.45 ' NZ ' ' HA ' ' A' ' 32' ' ' THR . 39.5 ttmt -77.89 108.43 11.13 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.576 177.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.9 t -124.91 162.45 24.39 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.78 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.5 t -143.11 156.71 44.86 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 120.678 0.275 . . . . 0.0 110.677 -178.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -107.59 -21.04 13.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.79 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 77.0 m -78.91 136.73 37.36 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 175.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.5 p -119.46 -177.12 3.29 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 -175.064 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.7 p -62.4 -12.48 21.84 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.76 -178.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -67.18 -29.46 69.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.206 0.527 . . . . 0.0 109.892 176.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 148.74 157.6 7.64 Favored Glycine 0 N--CA 1.44 -1.087 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.861 179.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 53.3 t -72.73 134.91 45.22 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -121.33 -3.17 9.46 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.599 -177.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 1.2 p -99.02 -37.74 9.24 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.146 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.82 19.12 5.38 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.696 -0.764 . . . . 0.0 113.037 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -113.61 8.25 17.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 117.035 0.418 . . . . 0.0 111.124 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 64.61 17.42 10.89 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.689 178.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 17.3 p -89.89 153.35 20.7 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.283 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.9 p -139.17 40.3 2.1 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.95 0.405 . . . . 0.0 110.724 -179.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.42 163.88 10.02 Favored Glycine 0 N--CA 1.439 -1.155 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.409 -178.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.3 -28.94 86.36 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.108 2.539 . . . . 0.0 113.918 -176.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -74.3 -36.78 63.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.858 0.361 . . . . 0.0 111.019 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.2 p -93.96 -10.6 33.16 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.091 0.472 . . . . 0.0 111.03 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 45.6 t -69.63 133.48 47.63 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.664 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 59' ' ' LYS . 37.5 ttmt -112.71 -7.2 13.83 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.843 -179.751 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.551 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 9.0 m -64.33 124.79 22.64 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.315 -177.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.25 50.07 3.57 Favored Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.486 -179.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 57.6 m 66.34 -177.31 0.19 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.102 0.561 . . . . 0.0 111.127 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.3 m 66.19 6.85 4.43 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.36 0.6 . . . . 0.0 111.048 -178.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.7 t -100.09 167.5 10.43 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.064 -179.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.2 p -65.97 -30.18 70.69 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -176.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 22.0 p -94.36 -4.49 48.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.77 0.319 . . . . 0.0 111.454 -177.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.551 ' HE3' ' O ' ' A' ' 60' ' ' CYS . 1.8 mmmp? . . . . . 0 C--O 1.27 2.162 0 CA-C-O 118.016 -0.992 . . . . 0.0 111.342 -178.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 12.1 mptt . . . . . 0 CA--C 1.504 -0.8 0 CA-C-O 121.104 0.478 . . . . 0.0 110.314 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.1 m -83.49 168.73 16.2 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 121.841 0.829 . . . . 0.0 112.034 -177.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.458 HG21 ' H ' ' A' ' 26' ' ' GLN . 59.9 p -100.19 168.68 9.65 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-N 114.381 -1.282 . . . . 0.0 109.309 178.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.0 m -67.62 -17.55 64.65 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.349 0.595 . . . . 0.0 109.764 177.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.489 ' HB1' ' C ' ' A' ' 20' ' ' GLN . . . -79.57 -39.48 31.66 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.718 -178.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 50.2 t -69.99 -25.48 63.63 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.183 0.516 . . . . 0.0 110.475 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 -83.43 8.64 13.22 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.828 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.8 t -115.46 148.53 39.32 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 177.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.524 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 16.3 pt-20 -124.82 130.12 24.35 Favored Pre-proline 0 C--N 1.323 -0.551 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.984 179.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.524 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 15.2 Cg_exo -66.97 166.94 59.94 Favored 'Cis proline' 0 C--N 1.35 0.627 0 C-N-CA 123.095 -1.627 . . . . 0.0 111.92 -0.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.2 t -56.35 123.18 13.77 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.186 -178.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.489 ' C ' ' HB1' ' A' ' 13' ' ' ALA . 84.2 mm-40 -100.86 19.69 16.76 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.953 -175.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.404 ' HB3' ' HB2' ' A' ' 25' ' ' CYS . 56.3 m -85.35 8.15 19.82 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.68 -23.93 69.29 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.289 -0.957 . . . . 0.0 110.821 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.2 p -99.05 -56.33 2.46 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.218 -0.491 . . . . 0.0 110.228 178.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -121.99 113.85 20.14 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.966 -178.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.404 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 17.3 t -130.97 129.65 42.39 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-O 121.001 0.429 . . . . 0.0 110.235 176.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.458 ' H ' HG21 ' A' ' 11' ' ' THR . 8.4 tt0 -143.11 14.69 1.87 Allowed 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.308 -178.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 72.6 m -59.61 131.44 50.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.657 -177.04 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.25 -156.15 32.48 Favored Glycine 0 N--CA 1.441 -0.985 0 CA-C-N 115.077 -0.965 . . . . 0.0 113.952 -176.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -67.42 148.27 51.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.249 -0.476 . . . . 0.0 111.016 -179.012 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.9 -26.47 24.34 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.426 -178.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 48.6 t -77.36 116.76 18.22 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-O 121.089 0.471 . . . . 0.0 109.845 179.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.8 t -115.35 17.6 16.44 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.017 -179.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 47.1 t -62.08 110.07 1.48 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.467 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.51 -13.4 13.66 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -176.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.19 -53.19 15.31 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.445 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.9 p -102.75 -9.45 19.99 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -72.14 103.89 3.45 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.444 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 12.7 t -120.24 166.98 12.75 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.194 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.459 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 40.6 t -159.55 143.54 14.8 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.155 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -102.22 -15.7 16.55 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -179.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 76.5 m -77.93 136.37 38.0 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 175.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.1 p -115.08 -178.76 3.45 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -175.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.4 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 5.9 p -61.05 -15.15 29.13 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.101 -179.602 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -66.74 -33.67 76.15 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.209 0.528 . . . . 0.0 109.959 177.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 154.33 160.14 9.64 Favored Glycine 0 N--CA 1.435 -1.393 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.123 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.3 t -76.71 151.09 36.22 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -135.45 7.77 3.34 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 179.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.8 p -116.31 -19.61 10.1 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.855 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.25 14.91 29.36 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.683 -0.77 . . . . 0.0 113.494 178.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.622 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 42.1 mmtm -103.65 4.44 35.52 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 117.046 0.423 . . . . 0.0 111.25 179.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 62.26 21.49 12.52 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.244 178.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.4 p -95.35 146.7 24.19 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.376 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.4 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 47.4 p -133.05 38.91 3.33 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.244 0.545 . . . . 0.0 110.171 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.95 162.5 9.44 Favored Glycine 0 N--CA 1.436 -1.332 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -177.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.459 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 13.8 Cg_endo -56.66 -28.58 75.96 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.937 2.425 . . . . 0.0 112.713 -178.122 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -68.23 -35.61 78.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.724 -178.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.3 p -105.27 8.44 33.87 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.228 0.537 . . . . 0.0 110.841 -179.111 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 42.6 t -92.32 123.36 35.59 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.131 -176.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -90.42 -22.63 21.34 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.996 177.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.622 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.9 m -62.37 146.63 50.77 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.217 -177.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -105.49 -86.66 1.93 Allowed Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 110.954 -0.859 . . . . 0.0 110.954 177.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.1 m -130.16 171.75 12.52 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 178.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 37.8 m 64.61 33.81 10.4 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 177.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 35.3 t -119.73 160.38 22.66 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.68 0.276 . . . . 0.0 110.266 177.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.3 m -65.8 -23.03 66.61 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -178.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.508 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 8.9 p -95.01 13.42 25.12 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.293 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.508 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 47.2 mmtm . . . . . 0 C--O 1.259 1.56 0 CA-C-O 117.112 -1.423 . . . . 0.0 110.912 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 67.8 mttm . . . . . 0 CA--C 1.505 -0.767 0 CA-C-O 120.995 0.426 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 85.9 m -89.15 177.12 6.71 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-O 121.348 0.594 . . . . 0.0 111.663 -177.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.519 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 40.7 p -108.68 171.77 7.23 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.072 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.1 m -70.79 -26.9 63.53 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.47 -38.55 81.14 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.387 178.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 52.7 t -72.11 -34.6 68.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.244 178.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 11' ' ' THR . 70.3 mtp180 -65.87 -29.04 69.42 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.275 178.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 49.1 m -67.77 152.25 45.89 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.142 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -126.26 120.04 23.57 Favored Pre-proline 0 C--N 1.318 -0.77 0 CA-C-O 120.763 0.316 . . . . 0.0 111.048 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -73.77 174.6 50.13 Favored 'Cis proline' 0 C--O 1.237 0.442 0 C-N-CA 123.426 -1.489 . . . . 0.0 112.141 0.27 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.0 t -55.5 136.22 50.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.092 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -111.98 17.6 19.54 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.289 0.566 . . . . 0.0 110.703 -178.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.459 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 93.3 m -81.85 29.54 0.39 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.333 -179.041 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.52 -45.72 95.29 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 176.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.2 m -131.58 4.29 4.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.048 0.451 . . . . 0.0 110.098 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -118.61 31.14 6.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.24 -177.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.557 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 16.7 t -82.97 127.28 33.39 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.13 -0.628 . . . . 0.0 111.18 -178.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.456 ' H ' HG21 ' A' ' 11' ' ' THR . 84.4 mt-30 -142.77 18.83 1.99 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.181 -0.918 . . . . 0.0 108.904 -178.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 86.5 m -67.33 145.66 54.88 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.415 -176.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -96.62 -154.59 30.26 Favored Glycine 0 N--CA 1.438 -1.187 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.312 177.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -78.38 14.46 1.22 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.053 0.454 . . . . 0.0 111.263 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -110.21 34.62 5.31 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 121.102 -0.571 . . . . 0.0 111.865 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.5 t -130.92 148.68 52.71 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.045 0.45 . . . . 0.0 110.346 179.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.9 t -136.53 16.8 3.13 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.35 178.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.6 t -80.63 124.47 29.02 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.362 -178.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -81.18 9.11 7.34 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.439 -178.467 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -93.14 -13.08 28.91 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.976 0.417 . . . . 0.0 110.806 179.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.557 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 7.5 p -139.15 -27.78 0.8 Allowed 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 116.125 -0.488 . . . . 0.0 112.144 -178.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.433 ' HE3' ' O ' ' A' ' 60' ' ' CYS . 88.0 tttt -79.44 126.81 31.32 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 178.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.0 t -132.33 175.26 9.42 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.854 -177.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.406 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 40.6 t -158.92 148.26 18.85 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.346 -179.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -109.46 -12.35 14.72 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 179.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.7 m -81.07 133.63 35.51 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 177.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 75.4 p -113.73 176.6 4.96 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.412 -176.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.453 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 22.7 t -62.66 -18.71 62.85 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.905 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -64.86 -20.6 66.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.482 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.84 146.7 4.38 Favored Glycine 0 N--CA 1.439 -1.145 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.399 178.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 38.1 t -75.32 142.33 43.25 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -120.41 -6.92 9.78 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 11.2 p -99.71 -38.09 8.84 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.833 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.49 -0.98 16.11 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.67 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.631 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 73.4 mmtt -84.96 0.52 51.0 Favored 'General case' 0 C--O 1.239 0.551 0 O-C-N 122.625 -0.338 . . . . 0.0 110.852 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 63.92 35.39 10.9 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.268 178.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 24.1 p -107.85 155.48 20.21 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.901 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.453 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 50.1 p -140.75 50.18 1.67 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 120.971 0.415 . . . . 0.0 110.676 179.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 133.87 154.05 7.21 Favored Glycine 0 C--O 1.225 -0.429 0 C-N-CA 120.449 -0.881 . . . . 0.0 112.368 -179.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.406 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 76.0 Cg_exo -50.25 -41.46 50.27 Favored 'Trans proline' 0 C--N 1.36 1.139 0 C-N-CA 123.687 2.925 . . . . 0.0 114.022 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -64.37 -34.86 79.13 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.779 0.323 . . . . 0.0 111.616 -177.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 41.7 m -107.06 21.94 16.77 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.314 0.578 . . . . 0.0 110.079 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.502 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 49.4 t -98.45 123.88 42.84 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.671 -178.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -91.55 -17.67 25.28 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.865 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.631 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.7 m -71.66 154.05 41.65 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.797 -178.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.491 ' O ' ' HE3' ' A' ' 67' ' ' LYS . . . -92.76 -106.84 1.71 Allowed Glycine 0 N--CA 1.443 -0.871 0 C-N-CA 120.682 -0.77 . . . . 0.0 111.962 178.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.5 p -124.62 -26.0 3.91 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 120.894 0.378 . . . . 0.0 111.198 -179.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.3 m -89.4 50.05 1.86 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.36 -177.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 34.8 t -125.19 168.06 13.97 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 120.963 0.411 . . . . 0.0 111.345 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -70.25 -28.5 65.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.792 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 18.2 p -84.77 16.96 2.99 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.977 0.418 . . . . 0.0 111.122 -179.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.502 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 58.0 mmtt . . . . . 0 C--O 1.26 1.624 0 CA-C-O 117.585 -1.198 . . . . 0.0 110.691 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.514 -0.435 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.544 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 87.7 m -65.94 136.72 56.47 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.18 176.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.624 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 68.7 p -72.76 171.46 12.56 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.07 -178.051 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.8 m -70.18 -11.78 61.14 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.327 0.584 . . . . 0.0 109.904 177.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.402 ' HB1' ' HB2' ' A' ' 20' ' ' GLN . . . -87.76 -39.21 15.11 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.338 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.561 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 54.0 t -73.26 -24.11 60.41 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.005 0.431 . . . . 0.0 111.316 -179.101 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.624 ' HG3' ' O ' ' A' ' 11' ' ' THR . 86.9 mtt180 -73.59 -10.53 59.8 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.093 0.473 . . . . 0.0 110.188 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 30.8 t -88.84 159.99 17.45 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.132 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -131.82 116.96 16.05 Favored Pre-proline 0 C--N 1.317 -0.838 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.985 177.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -73.51 176.01 43.42 Favored 'Cis proline' 0 C--O 1.242 0.704 0 C-N-CA 123.536 -1.444 . . . . 0.0 112.583 1.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.2 t -59.72 141.07 55.9 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.807 -179.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.402 ' HB2' ' HB1' ' A' ' 13' ' ' ALA . 16.3 mm-40 -115.75 11.82 15.76 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.372 -178.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.561 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 58.1 m -81.89 20.46 0.97 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.733 0.301 . . . . 0.0 111.667 -179.057 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.5 108.29 2.13 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.075 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.1 m 63.03 15.09 8.14 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.18 0.592 . . . . 0.0 111.421 -178.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -152.31 81.4 1.25 Allowed 'General case' 0 N--CA 1.438 -1.027 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.455 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 49.5 t -130.38 150.27 51.68 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.172 -176.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.403 ' H ' HG21 ' A' ' 11' ' ' THR . 69.7 mt-30 -148.12 23.19 1.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.256 178.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.544 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 35.2 m -65.59 171.43 4.13 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.227 0.537 . . . . 0.0 112.361 -178.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.21 -165.7 40.08 Favored Glycine 0 N--CA 1.438 -1.173 0 CA-C-N 115.639 -0.71 . . . . 0.0 113.01 -177.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -84.23 -24.2 30.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 120.919 0.39 . . . . 0.0 110.975 -178.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -91.51 48.51 2.86 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.796 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 21.5 t -120.64 126.71 50.93 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.8 t -109.02 7.97 26.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.262 -178.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.2 t -69.17 115.1 8.06 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.299 179.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.86 -5.36 29.9 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -176.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.16 -40.9 51.45 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.805 0.336 . . . . 0.0 111.044 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 7.8 p -111.38 -18.45 12.89 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.934 -178.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -80.48 113.49 18.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.786 0.327 . . . . 0.0 110.347 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.449 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 12.6 t -120.72 167.11 12.82 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.741 -178.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.466 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 41.7 t -156.4 145.12 20.12 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 178.385 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -102.43 -13.52 17.23 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.498 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 70.0 m -88.9 135.63 33.43 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 175.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 81.4 p -127.94 -166.65 1.65 Allowed 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.571 -177.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.3 m -60.61 -15.04 24.04 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 120.91 0.386 . . . . 0.0 110.723 178.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -67.75 -30.22 69.63 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.634 178.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 147.55 157.97 7.67 Favored Glycine 0 N--CA 1.439 -1.152 0 C-N-CA 120.991 -0.623 . . . . 0.0 112.209 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.5 t -87.76 135.12 33.51 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.42 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 8.0 mtpm? -126.75 5.46 6.69 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -179.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.47 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 13.7 p -99.63 -32.05 11.27 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 119.984 -0.686 . . . . 0.0 110.138 178.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.69 5.97 25.35 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.888 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.704 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 74.4 mmtt -93.32 0.43 56.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 117.03 0.415 . . . . 0.0 111.334 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 64.19 30.65 13.59 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.568 0.699 . . . . 0.0 110.624 178.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.0 p -104.17 151.34 23.45 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.243 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 26.7 p -140.25 79.7 1.72 Allowed 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.084 0.469 . . . . 0.0 110.025 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.9 152.38 13.9 Favored Glycine 0 N--CA 1.442 -0.918 0 C-N-CA 121.13 -0.557 . . . . 0.0 111.858 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.466 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 11.4 Cg_endo -54.31 -34.62 80.85 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 123.435 2.757 . . . . 0.0 113.32 -177.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -64.05 -36.35 83.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.968 0.413 . . . . 0.0 111.378 -178.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.3 m -106.86 22.96 15.13 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.691 -177.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 26.6 t -113.54 139.45 48.97 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.127 -178.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -124.72 12.79 8.58 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.851 0.357 . . . . 0.0 110.872 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.704 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 8.1 m -76.85 148.75 36.34 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.77 -179.021 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.682 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -81.79 -170.0 43.66 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 177.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.6 m -86.62 10.37 15.77 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 117.121 0.46 . . . . 0.0 111.616 -177.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.4 t -116.92 31.61 6.65 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.182 0.515 . . . . 0.0 109.866 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . 0.4 ' SG ' ' N ' ' A' ' 65' ' ' SER . 42.4 t -109.11 167.86 9.79 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.227 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.4 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 31.2 t -68.49 -29.27 67.84 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.451 -178.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.49 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 14.1 p -90.5 23.73 2.89 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.199 0.523 . . . . 0.0 110.411 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.682 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 47.3 mmtm . . . . . 0 C--O 1.273 2.29 0 CA-C-O 117.713 -1.137 . . . . 0.0 110.768 -179.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.537 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 25.9 mtmm . . . . . 0 CA--C 1.518 -0.28 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 10.7 m -82.09 162.2 22.61 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 174.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 80.6 p -100.54 -177.62 3.55 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 120.841 0.353 . . . . 0.0 110.616 -178.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.4 m -80.61 -30.26 36.81 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 175.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.66 -30.59 68.31 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.333 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.542 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 52.0 t -71.58 -22.76 61.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.169 0.509 . . . . 0.0 110.578 178.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -87.03 -2.65 58.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.914 0.388 . . . . 0.0 110.684 179.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.4 m -80.14 168.94 18.49 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.799 -179.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.47 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 8.7 pt-20 -136.63 108.84 9.31 Favored Pre-proline 0 C--N 1.32 -0.713 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.736 179.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.47 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 73.0 Cg_endo -74.64 178.77 32.78 Favored 'Cis proline' 0 C--O 1.24 0.62 0 C-N-CA 123.535 -1.444 . . . . 0.0 111.919 -0.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.542 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 16.7 t -58.72 138.91 56.82 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -179.469 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 87.9 mm-40 -114.37 24.33 12.01 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -174.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.615 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 63.9 m -96.67 29.39 3.0 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.831 0.348 . . . . 0.0 110.555 178.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.06 -53.23 47.48 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.875 -0.602 . . . . 0.0 113.068 -179.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -111.51 -6.9 14.36 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.784 0.326 . . . . 0.0 111.339 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -139.07 91.72 2.54 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.863 0.363 . . . . 0.0 110.435 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 44.0 t -118.43 128.23 54.41 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.91 -179.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -127.0 15.92 7.34 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.612 178.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.537 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 93.5 m -70.01 132.41 45.87 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 121.208 0.528 . . . . 0.0 110.513 179.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.75 -166.95 42.29 Favored Glycine 0 N--CA 1.437 -1.275 0 CA-C-N 115.226 -0.897 . . . . 0.0 113.654 -176.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -53.74 -26.44 23.34 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.039 0.936 . . . . 0.0 112.167 -179.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -90.08 47.65 3.15 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 120.642 -0.79 . . . . 0.0 113.447 -177.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 49.8 t -120.44 139.35 52.98 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 117.117 0.459 . . . . 0.0 109.899 177.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.6 t -123.15 18.68 9.96 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 121.417 0.627 . . . . 0.0 109.857 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.401 ' SG ' ' HB3' ' A' ' 35' ' ' ALA . 42.9 t -93.54 113.54 25.68 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.586 -178.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.39 -4.32 29.38 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.673 -179.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.401 ' HB3' ' SG ' ' A' ' 33' ' ' CYS . . . -77.68 -41.04 39.51 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.334 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.615 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 19.8 p -106.95 -15.3 14.74 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.914 0.388 . . . . 0.0 111.979 -178.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -85.64 102.05 13.24 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.564 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.0 t -108.18 178.52 4.48 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.297 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 48.1 t -156.72 149.13 23.34 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -106.78 -17.05 14.32 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 73.9 m -76.62 137.27 39.37 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 176.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 65.6 p -93.39 170.13 9.85 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.852 -173.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.51 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 20.2 m -69.38 -4.17 17.28 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.3 -179.253 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -84.02 -31.78 25.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.814 179.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 172.3 156.76 12.82 Favored Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.378 -179.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 53.8 t -74.84 142.18 44.19 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.704 0.287 . . . . 0.0 110.519 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 7.1 mtpm? -117.42 -18.6 9.79 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.735 -178.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.438 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 7.2 p -93.3 -33.23 14.0 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.857 -178.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.15 4.76 23.78 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.507 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.0 mmmp? -92.16 10.64 28.53 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 122.577 -0.366 . . . . 0.0 111.229 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 63.12 24.19 14.31 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.917 176.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 8.2 p -102.6 143.99 31.57 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.599 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.51 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 68.5 p -132.34 52.47 2.07 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-O 121.195 0.521 . . . . 0.0 110.198 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.87 161.18 9.79 Favored Glycine 0 N--CA 1.445 -0.704 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.52 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.33 -41.12 68.45 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.518 2.812 . . . . 0.0 114.129 -177.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -74.44 -22.96 58.87 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.012 0.434 . . . . 0.0 111.134 -178.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.407 ' HB2' ' H ' ' A' ' 53' ' ' THR . 7.4 m -96.44 -0.46 49.14 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.873 179.305 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 44.1 t -98.26 147.65 24.42 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.082 -176.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -138.16 11.59 2.82 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.935 0.874 . . . . 0.0 108.832 176.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.2 m -81.71 142.49 32.63 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.618 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.435 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -67.53 167.31 41.02 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.453 -0.88 . . . . 0.0 111.332 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 30.7 m -69.18 5.68 1.17 Allowed 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -178.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 33.5 t -108.7 5.7 25.04 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.652 0.263 . . . . 0.0 111.192 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 49.7 t -77.37 169.07 18.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.88 0.371 . . . . 0.0 111.105 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.8 m -64.62 -28.74 69.83 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.697 -178.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.438 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 18.7 p -89.82 25.7 2.0 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.007 0.432 . . . . 0.0 110.763 -179.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 47.9 mmtm . . . . . 0 C--O 1.263 1.773 0 CA-C-O 117.43 -1.272 . . . . 0.0 111.402 -178.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.285 0 N-CA-C 112.039 -0.424 . . . . 0.0 112.039 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.6 m -86.38 150.14 24.52 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.796 0.332 . . . . 0.0 110.662 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 126.33 -18.06 6.52 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -110.32 119.04 37.95 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.906 0.384 . . . . 0.0 110.48 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 134.86 -164.3 24.73 Favored Glycine 0 N--CA 1.438 -1.193 0 N-CA-C 111.296 -0.721 . . . . 0.0 111.296 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.693 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 32.5 mmtp -125.53 171.42 10.53 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 120.838 0.352 . . . . 0.0 110.742 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -95.24 -178.11 37.34 Favored Glycine 0 N--CA 1.44 -1.085 0 C-N-CA 121.005 -0.617 . . . . 0.0 113.01 -177.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -77.53 -24.86 49.88 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.998 0.428 . . . . 0.0 110.81 -178.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 98.5 mttt -92.14 6.34 46.95 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.955 -178.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.693 ' SG ' ' HB3' ' A' ' 6' ' ' LYS . 68.4 m -69.47 156.48 38.8 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.008 0.432 . . . . 0.0 110.344 177.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 65.2 p -92.71 169.24 10.64 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.071 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.8 m -73.99 -11.27 60.29 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.85 -42.96 18.88 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.25 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.43 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 44.8 t -69.84 -23.42 63.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.325 0.583 . . . . 0.0 110.582 178.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 74.6 mtt180 -85.78 5.37 32.75 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.991 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.8 t -110.04 156.88 19.94 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.93 -0.766 . . . . 0.0 108.93 177.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.437 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 6.7 pt-20 -126.17 126.67 24.74 Favored Pre-proline 0 C--N 1.322 -0.604 0 C-N-CA 121.084 -0.246 . . . . 0.0 110.361 177.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.437 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 11.7 Cg_exo -68.8 170.93 51.78 Favored 'Cis proline' 0 C--N 1.346 0.425 0 C-N-CA 123.236 -1.568 . . . . 0.0 111.98 0.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.404 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 5.3 t -60.09 116.74 4.4 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.645 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 82.3 mm-40 -86.23 8.69 20.15 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.433 -176.066 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.456 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 79.7 m -78.5 6.46 8.54 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.663 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.08 -20.62 65.04 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.962 -0.637 . . . . 0.0 111.61 177.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.5 m -143.37 23.55 1.81 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.055 0.455 . . . . 0.0 110.325 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 87.0 tttt -170.89 81.71 0.08 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.161 -178.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.3 t -121.42 138.63 54.19 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.837 0.351 . . . . 0.0 111.15 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -153.48 20.98 0.55 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.659 -0.701 . . . . 0.0 109.967 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.417 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 70.9 m -68.53 146.85 52.74 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.844 0.683 . . . . 0.0 112.844 -175.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.88 -146.42 16.75 Favored Glycine 0 N--CA 1.442 -0.949 0 CA-C-N 114.939 -1.028 . . . . 0.0 113.227 -178.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.498 ' CD ' ' H ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -75.74 -38.63 58.3 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 122.42 0.288 . . . . 0.0 111.65 -177.433 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -75.83 60.19 2.99 Favored Glycine 0 C--O 1.223 -0.561 0 C-N-CA 121.267 -0.492 . . . . 0.0 112.931 -178.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 35.7 t -153.81 111.3 3.48 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.887 0.375 . . . . 0.0 110.194 179.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 t -103.92 17.48 24.0 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.81 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.7 t -74.93 107.09 6.78 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.738 -179.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.9 -10.34 56.62 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.664 -178.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -64.22 -36.36 83.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.91 0.386 . . . . 0.0 110.592 178.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.405 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 6.7 p -116.69 -15.2 10.79 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.792 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp -92.43 132.56 36.68 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-O 121.116 0.484 . . . . 0.0 111.561 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.0 t -136.25 153.61 51.15 Favored 'General case' 0 C--N 1.312 -1.031 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 177.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.9 t -147.43 154.36 40.73 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 120.59 0.233 . . . . 0.0 110.476 -178.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -112.73 -14.8 13.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.619 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 83.9 m -67.77 138.82 56.49 Favored 'General case' 0 N--CA 1.44 -0.951 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 176.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.6 p -97.65 171.15 8.52 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.426 -171.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.404 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 16.5 m -71.49 -17.06 62.37 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -176.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -76.6 -21.67 55.26 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.842 -0.343 . . . . 0.0 110.931 179.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.401 ' O ' ' HE2' ' A' ' 47' ' ' LYS . . . 166.66 156.33 9.54 Favored Glycine 0 N--CA 1.434 -1.465 0 C-N-CA 120.357 -0.925 . . . . 0.0 112.237 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 44.1 t -69.47 145.35 52.81 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.401 ' HE2' ' O ' ' A' ' 45' ' ' GLY . 71.8 mmtt -111.83 -35.92 5.58 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.691 0.282 . . . . 0.0 111.531 -177.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.432 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 2.8 p -76.99 -39.67 49.56 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.97 -177.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.87 4.4 19.05 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.657 -0.782 . . . . 0.0 113.468 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.436 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 11.3 mmpt? -90.39 3.32 54.14 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 117.231 0.516 . . . . 0.0 110.373 178.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 63.95 61.45 0.95 Allowed 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.842 -179.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 9.5 p -136.92 145.26 44.07 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.238 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.404 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 40.5 p -132.04 70.15 1.47 Allowed 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.519 178.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 102.91 164.95 25.94 Favored Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.522 -0.846 . . . . 0.0 112.014 -177.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -61.28 -11.68 20.3 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 C-N-CA 123.555 2.836 . . . . 0.0 113.221 -178.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -69.97 -24.02 63.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.998 0.428 . . . . 0.0 111.321 -179.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 60.6 m -144.79 29.77 1.21 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.058 0.456 . . . . 0.0 110.57 -179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 37.5 t -85.87 109.14 18.51 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.032 -179.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 51.5 mttp -73.04 -25.15 60.83 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 121.659 0.742 . . . . 0.0 109.206 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.9 m -64.52 124.32 21.54 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 114.645 -1.161 . . . . 0.0 111.844 -176.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -97.38 56.38 1.22 Allowed Glycine 0 N--CA 1.443 -0.884 0 N-CA-C 110.88 -0.888 . . . . 0.0 110.88 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 41.2 m 68.07 176.32 0.26 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.108 0.563 . . . . 0.0 111.116 -178.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 32.1 t 65.11 19.48 11.8 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 122.682 0.393 . . . . 0.0 111.658 179.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . 0.437 ' SG ' ' N ' ' A' ' 65' ' ' SER . 50.0 t -108.25 173.35 6.36 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.854 -179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.437 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 9.5 m -61.33 -37.73 84.33 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 122.878 0.471 . . . . 0.0 111.863 -178.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.503 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 31.9 p -84.51 17.41 2.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.995 0.426 . . . . 0.0 111.153 -178.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.503 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 43.0 mmtm . . . . . 0 C--O 1.263 1.763 0 CA-C-O 117.704 -1.141 . . . . 0.0 110.809 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.367 0 N-CA-C 112.227 -0.349 . . . . 0.0 112.227 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.3 t -66.69 120.91 14.28 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 179.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 152.07 -82.99 0.17 Allowed Glycine 0 N--CA 1.436 -1.313 0 C-N-CA 120.248 -0.977 . . . . 0.0 112.534 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -156.25 130.89 8.94 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.653 0.263 . . . . 0.0 111.578 -177.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 80.06 -51.17 4.07 Favored Glycine 0 C--N 1.331 0.291 0 N-CA-C 114.984 0.754 . . . . 0.0 114.984 174.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.459 ' NZ ' ' SG ' ' A' ' 14' ' ' CYS . 24.6 mtpp -75.21 72.95 2.32 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -175.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -113.79 -103.21 2.55 Favored Glycine 0 N--CA 1.437 -1.269 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.38 179.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -82.0 -18.19 44.22 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.913 0.387 . . . . 0.0 111.204 -177.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -71.79 -27.33 62.87 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.844 -178.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.0 m -76.35 153.66 35.63 Favored 'General case' 0 C--N 1.31 -1.126 0 CA-C-O 121.422 0.629 . . . . 0.0 111.831 -179.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.543 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 43.4 p -90.89 174.28 7.53 Favored 'General case' 0 C--N 1.299 -1.599 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.281 -177.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 18.7 m -69.85 -27.87 65.2 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.418 ' HB1' ' C ' ' A' ' 20' ' ' GLN . . . -68.6 -41.11 80.03 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.278 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.459 ' SG ' ' NZ ' ' A' ' 6' ' ' LYS . 44.4 t -70.82 -26.49 63.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.038 0.447 . . . . 0.0 110.255 179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.543 ' HG3' ' O ' ' A' ' 11' ' ' THR . 22.2 mtm180 -82.01 -7.94 59.64 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.191 0.519 . . . . 0.0 110.126 178.202 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 49.0 m -91.87 156.22 17.65 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.371 178.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.447 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 7.5 pt-20 -132.04 125.75 20.26 Favored Pre-proline 0 C--N 1.311 -1.074 0 CA-C-O 120.689 0.28 . . . . 0.0 111.219 -178.472 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.447 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 55.3 Cg_endo -69.3 168.66 64.95 Favored 'Cis proline' 0 C--N 1.349 0.574 0 C-N-CA 123.159 -1.6 . . . . 0.0 112.001 -0.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.2 t -53.61 128.59 29.8 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.418 ' C ' ' HB1' ' A' ' 13' ' ' ALA . 31.0 mm-40 -108.14 19.74 19.56 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.189 -0.46 . . . . 0.0 112.031 -175.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 58.7 m -82.5 9.7 8.74 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -177.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -69.57 123.19 13.22 Favored Glycine 0 N--CA 1.442 -0.908 0 C-N-CA 120.63 -0.795 . . . . 0.0 111.376 177.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 43.1 m 72.74 1.83 4.14 Favored 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 123.439 0.696 . . . . 0.0 111.91 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -162.95 80.45 0.48 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-O 121.182 0.515 . . . . 0.0 110.471 177.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 47.4 t -112.62 137.22 51.18 Favored 'General case' 0 C--N 1.308 -1.196 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.365 177.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -136.95 17.95 3.02 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.973 -177.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 96.4 m -67.31 152.89 44.91 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.385 179.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.2 -144.55 5.64 Favored Glycine 0 N--CA 1.44 -1.035 0 C-N-CA 120.566 -0.826 . . . . 0.0 112.708 -178.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.12 -18.44 23.54 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-O 121.007 0.432 . . . . 0.0 111.194 -179.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -94.57 74.18 1.02 Allowed Glycine 0 N--CA 1.44 -1.088 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.04 178.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.423 ' O ' ' HD2' ' A' ' 37' ' ' LYS . 45.0 t -146.04 119.48 9.04 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.045 0.45 . . . . 0.0 109.917 177.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.8 t -102.66 14.74 31.2 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.057 -179.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.3 t -76.56 118.88 19.66 Favored 'General case' 0 N--CA 1.461 0.122 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -69.97 -14.91 62.93 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -177.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.8 -52.43 30.21 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -178.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 6.1 p -99.0 -17.57 18.22 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -177.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.423 ' HD2' ' O ' ' A' ' 31' ' ' CYS . 87.9 tttt -87.49 116.06 25.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.073 0.463 . . . . 0.0 111.095 179.237 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.8 t -125.95 -176.68 3.7 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.42 178.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.2 t -160.24 139.29 10.69 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.8 m-80 -89.53 -18.51 26.51 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.558 -179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 71.9 m -70.67 153.86 42.41 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.358 0.599 . . . . 0.0 111.464 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.7 p -127.5 -169.56 2.07 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.749 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 47.5 m -76.47 7.95 3.96 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.215 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.65 -34.14 77.19 Favored 'General case' 0 CA--C 1.51 -0.558 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 175.184 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 123.06 52.42 0.21 Allowed Glycine 0 N--CA 1.438 -1.228 0 CA-C-N 114.964 -1.016 . . . . 0.0 111.775 179.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 47.8 t 70.45 151.68 0.1 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.377 0.608 . . . . 0.0 111.27 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.2 tmtp? -123.25 -50.45 1.9 Allowed 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.767 -177.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 28.6 p -73.91 -35.34 64.62 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.911 -178.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.41 18.69 6.52 Favored Glycine 0 CA--C 1.522 0.481 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.914 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -101.49 9.46 41.34 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 122.648 -0.324 . . . . 0.0 111.58 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 66.84 34.99 5.14 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.409 0.684 . . . . 0.0 111.457 177.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 3.5 p -111.74 148.3 33.79 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.312 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.5 p -136.04 37.72 2.78 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-O 121.243 0.544 . . . . 0.0 111.509 -177.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.01 157.44 7.23 Favored Glycine 0 C--O 1.219 -0.807 0 C-N-CA 120.516 -0.849 . . . . 0.0 111.998 -178.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -45.31 -55.81 3.21 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 123.985 3.123 . . . . 0.0 114.971 -178.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -67.18 -35.37 79.51 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.906 0.384 . . . . 0.0 111.094 -177.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 33.2 m -89.45 9.92 24.63 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.01 -178.716 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 43.7 t -89.8 134.02 34.4 Favored 'General case' 0 N--CA 1.435 -1.202 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.136 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 47.8 mttt -101.19 -4.97 26.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.32 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.3 m -87.63 152.69 21.97 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.815 -174.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -81.84 -165.34 35.29 Favored Glycine 0 N--CA 1.44 -1.069 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.7 p -82.02 -17.01 48.26 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 117.1 0.45 . . . . 0.0 110.782 -178.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 9.1 t -99.47 69.05 1.63 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-O 121.269 0.557 . . . . 0.0 110.307 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 14.4 t -138.99 166.78 23.6 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.984 178.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -69.11 -26.33 64.86 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.321 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.731 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 11.8 p -84.09 6.53 21.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.008 0.432 . . . . 0.0 110.353 179.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.731 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 30.1 mmtp . . . . . 0 C--O 1.263 1.779 0 CA-C-O 117.601 -1.19 . . . . 0.0 110.355 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.477 0 N-CA-C 112.186 -0.366 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.1 p -154.26 162.21 41.32 Favored 'General case' 0 C--N 1.319 -0.745 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -83.63 61.55 4.73 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.817 -0.706 . . . . 0.0 111.893 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -119.16 -168.65 1.6 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 120.56 0.219 . . . . 0.0 110.538 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.97 -45.49 3.43 Favored Glycine 0 N--CA 1.45 -0.377 0 N-CA-C 111.345 -0.702 . . . . 0.0 111.345 -178.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.758 ' HG2' ' SG ' ' A' ' 10' ' ' CYS . 35.2 ttpt -148.87 122.49 9.19 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 178.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 172.39 -152.44 16.82 Favored Glycine 0 N--CA 1.444 -0.792 0 C-N-CA 119.441 -1.361 . . . . 0.0 113.299 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 70.94 -68.01 0.23 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.022 0.929 . . . . 0.0 111.56 -179.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.554 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 5.6 mptt -107.07 4.62 27.15 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 116.695 -0.229 . . . . 0.0 111.164 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.758 ' SG ' ' HG2' ' A' ' 6' ' ' LYS . 37.8 m -62.8 143.42 57.55 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-O 121.174 0.511 . . . . 0.0 111.38 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.438 HG22 ' HB2' ' A' ' 26' ' ' GLN . 40.8 p -90.12 168.67 11.79 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 115.287 -0.869 . . . . 0.0 110.341 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.7 m -72.35 -14.84 61.83 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.384 0.611 . . . . 0.0 109.499 175.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.14 -35.43 42.06 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.492 177.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.3 t -76.2 -16.47 59.83 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.682 177.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -86.17 4.72 37.32 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.228 176.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.2 t -114.08 153.54 29.28 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.714 -179.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.492 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -130.82 127.01 22.07 Favored Pre-proline 0 C--N 1.315 -0.893 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.264 -178.701 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.492 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 36.6 Cg_endo -66.24 164.51 65.51 Favored 'Cis proline' 0 C--O 1.242 0.69 0 C-N-CA 123.341 -1.524 . . . . 0.0 111.996 -1.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.462 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 33.9 t -53.73 128.08 28.22 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.091 -178.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -98.6 22.77 9.45 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.573 -179.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.566 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 89.9 m -96.67 22.33 8.25 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.59 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.26 -40.95 77.7 Favored Glycine 0 CA--C 1.52 0.363 0 C-N-CA 121.282 -0.485 . . . . 0.0 113.162 -178.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.9 t -144.36 2.07 1.1 Allowed 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.956 0.408 . . . . 0.0 110.803 179.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -114.82 21.24 14.54 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.061 -179.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.414 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 49.8 t -65.41 144.74 56.87 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.34 0.59 . . . . 0.0 112.042 -176.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.438 ' HB2' HG22 ' A' ' 11' ' ' THR . 34.2 mt-30 -147.34 16.17 1.16 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.378 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 79.9 m -68.82 171.3 8.1 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 121.435 0.636 . . . . 0.0 112.364 -177.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -115.78 -151.51 9.83 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.874 -179.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -83.82 -18.18 38.51 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 117.022 0.411 . . . . 0.0 110.614 179.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.23 42.34 2.74 Favored Glycine 0 CA--C 1.518 0.227 0 C-N-CA 121.091 -0.576 . . . . 0.0 111.926 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.4 t -127.58 126.55 42.31 Favored 'General case' 0 N--CA 1.439 -1.022 0 CA-C-O 121.085 0.469 . . . . 0.0 109.969 -179.141 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 t -102.57 4.4 38.4 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.501 0.667 . . . . 0.0 110.029 179.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 35.1 t -82.24 116.0 21.57 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.601 -178.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.86 -0.77 49.73 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.309 -179.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.26 -42.26 69.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.996 0.427 . . . . 0.0 110.697 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.566 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 5.7 p -101.33 -39.93 7.36 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.126 179.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -73.15 99.99 2.95 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.105 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.1 t -114.5 -179.13 3.54 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.276 179.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.441 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 34.1 t -163.34 136.2 5.45 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 122.835 0.454 . . . . 0.0 109.803 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 44.3 m-80 -92.58 -15.99 26.23 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.485 ' SG ' ' HB2' ' A' ' 47' ' ' LYS . 88.8 m -69.15 147.4 51.43 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.205 0.526 . . . . 0.0 111.215 178.344 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 16.5 p -123.32 179.43 4.72 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.474 -175.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.4 m -66.27 -5.25 9.8 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.897 -179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -58.79 -35.23 72.47 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-O 120.87 0.367 . . . . 0.0 110.213 177.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 136.99 50.62 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.24 -0.981 . . . . 0.0 113.152 177.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 44.4 t 66.4 166.69 0.21 Allowed 'General case' 0 N--CA 1.474 0.734 0 CA-C-O 120.944 0.402 . . . . 0.0 111.165 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.485 ' HB2' ' SG ' ' A' ' 41' ' ' CYS . 98.1 mttt -139.92 -46.62 0.44 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.849 179.602 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.548 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 20.8 p -73.7 -34.61 64.92 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.458 -177.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 115.73 21.95 4.86 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.502 -0.856 . . . . 0.0 113.136 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.548 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 75.1 mmtt -107.19 6.5 28.77 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.921 0.361 . . . . 0.0 110.463 178.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 62.5 26.42 15.72 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.979 0.912 . . . . 0.0 111.368 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 11.6 p -95.91 151.77 19.11 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.441 179.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 61.9 p -138.19 80.95 1.83 Allowed 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.196 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 88.79 160.26 36.11 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.545 -0.835 . . . . 0.0 111.703 -179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.441 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 18.1 Cg_endo -59.3 -21.4 60.28 Favored 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.87 2.38 . . . . 0.0 112.788 -178.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -63.21 -30.11 71.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.87 178.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.3 t -139.54 63.96 1.48 Allowed 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 121.505 0.669 . . . . 0.0 109.314 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.408 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 48.8 t -133.3 132.09 40.96 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.257 -179.469 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -110.72 -3.25 15.89 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.168 0.509 . . . . 0.0 110.004 178.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.4 m -74.29 137.91 43.22 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.389 -176.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -74.24 169.77 53.77 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.306 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.3 m -64.94 -12.94 55.29 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -177.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 67.1 m -101.58 17.65 22.28 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.629 0.252 . . . . 0.0 111.627 179.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . 0.415 ' SG ' ' N ' ' A' ' 65' ' ' SER . 37.5 t -83.49 172.43 12.42 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 111.357 -179.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.415 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 14.7 m -72.72 -20.37 61.22 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.232 -177.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.491 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 23.4 p -89.93 11.45 20.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.876 0.37 . . . . 0.0 111.002 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.408 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 57.9 mmtt . . . . . 0 C--O 1.269 2.117 0 CA-C-O 117.744 -1.122 . . . . 0.0 110.515 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.428 0 N-CA-C 112.344 -0.302 . . . . 0.0 112.344 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.3 m -133.69 146.83 51.19 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -77.12 -34.54 41.32 Favored Glycine 0 N--CA 1.444 -0.832 0 N-CA-C 110.491 -1.044 . . . . 0.0 110.491 176.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 67.7 mmtt -101.87 -164.53 1.1 Allowed 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.407 -0.396 . . . . 0.0 110.221 177.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -177.35 172.9 45.74 Favored Glycine 0 N--CA 1.439 -1.109 0 N-CA-C 110.892 -0.883 . . . . 0.0 110.892 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.819 ' HA ' ' SG ' ' A' ' 10' ' ' CYS . 24.0 pttm -71.22 112.5 7.41 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.149 0.5 . . . . 0.0 111.222 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -175.32 -95.44 0.1 OUTLIER Glycine 0 N--CA 1.439 -1.136 0 C-N-CA 120.383 -0.913 . . . . 0.0 113.525 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -47.04 -51.49 17.31 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.956 1.095 . . . . 0.0 113.956 -175.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.609 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 29.8 mmtp -95.91 -6.67 38.64 Favored 'General case' 0 C--N 1.308 -1.196 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -176.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.819 ' SG ' ' HA ' ' A' ' 6' ' ' LYS . 61.3 m -87.07 157.36 19.43 Favored 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 121.368 0.604 . . . . 0.0 111.692 -177.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.59 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 61.7 p -95.31 175.47 6.58 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.694 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 22.6 m -70.53 -17.43 62.94 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.007 0.432 . . . . 0.0 110.858 179.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.17 -40.07 53.38 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.024 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 53.1 t -74.72 -23.22 58.55 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.171 0.51 . . . . 0.0 110.229 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.59 ' HG3' ' O ' ' A' ' 11' ' ' THR . 86.5 mtt180 -77.41 0.23 23.31 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.76 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 t -102.21 158.58 16.07 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -128.87 123.03 21.74 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-O 120.679 0.276 . . . . 0.0 110.707 178.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_exo -71.33 178.61 28.46 Favored 'Cis proline' 0 C--O 1.235 0.375 0 C-N-CA 123.412 -1.495 . . . . 0.0 111.868 -0.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 9.8 t -61.66 134.66 57.06 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.639 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -115.17 20.62 14.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.742 -176.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.505 ' HB3' ' HB2' ' A' ' 25' ' ' CYS . 81.3 m -81.13 59.76 4.01 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -178.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.69 -57.67 4.44 Favored Glycine 0 C--N 1.302 -1.335 0 N-CA-C 111.014 -0.834 . . . . 0.0 111.014 176.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 16.5 m -125.66 5.74 7.49 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.125 0.488 . . . . 0.0 110.378 178.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -113.8 34.33 4.67 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.341 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.505 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 13.8 t -92.95 115.93 28.58 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 120.059 -0.657 . . . . 0.0 111.328 -179.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.526 ' HB2' ' CG2' ' A' ' 11' ' ' THR . 15.2 mm100 -131.23 14.87 5.11 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.203 -0.908 . . . . 0.0 108.905 177.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.609 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 73.9 m -61.61 140.33 58.16 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.976 -177.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.528 ' H ' ' HB3' ' A' ' 9' ' ' LYS . . . -113.98 -164.23 15.2 Favored Glycine 0 C--N 1.312 -0.789 0 CA-C-N 115.325 -0.852 . . . . 0.0 112.105 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.493 ' CD ' ' H ' ' A' ' 29' ' ' GLU . 1.0 OUTLIER -65.72 134.56 53.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.998 0.428 . . . . 0.0 110.209 179.033 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 117.46 -10.52 14.51 Favored Glycine 0 N--CA 1.438 -1.207 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -175.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 47.5 t -80.0 123.94 28.27 Favored 'General case' 0 N--CA 1.433 -1.29 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 177.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.9 t -106.78 12.14 29.39 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-O 121.337 0.589 . . . . 0.0 110.914 -176.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.8 t -82.44 141.12 33.0 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.098 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -100.17 0.86 41.33 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.061 0.458 . . . . 0.0 110.765 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.48 -51.52 9.86 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.507 -179.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 5.1 p -100.04 -19.4 16.55 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -175.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt -75.95 131.55 39.67 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.484 -179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.559 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 10.8 t -133.26 -176.92 4.3 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.44 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 37.4 t -162.12 153.85 18.69 Favored 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 122.793 0.437 . . . . 0.0 109.913 -179.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -112.1 -12.5 13.67 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.4 m -78.25 130.03 35.77 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 38.2 p -103.91 175.8 5.36 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.479 -174.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.4 t -65.39 -7.2 12.68 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.038 -179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -71.55 -27.44 63.17 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 177.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 153.31 155.09 7.0 Favored Glycine 0 N--CA 1.437 -1.243 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.675 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.6 t -74.77 137.72 42.17 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 48.7 mtmt -118.75 -3.58 10.79 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.369 -0.532 . . . . 0.0 112.332 -177.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.633 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 8.0 p -102.53 -35.72 8.64 Favored 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.035 -0.666 . . . . 0.0 110.495 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.98 13.83 7.55 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.182 178.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.642 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 32.5 mmtp -101.1 -1.67 33.45 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 117.077 0.438 . . . . 0.0 110.61 178.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 67.47 27.93 7.84 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.993 -179.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 25.0 p -99.3 150.94 21.61 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.707 178.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.2 p -142.71 62.03 1.41 Allowed 'General case' 0 C--N 1.312 -1.051 0 CA-C-O 121.146 0.498 . . . . 0.0 110.364 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 124.44 156.05 9.32 Favored Glycine 0 N--CA 1.448 -0.519 0 N-CA-C 111.362 -0.695 . . . . 0.0 111.362 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.21 -38.66 81.69 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 123.054 2.503 . . . . 0.0 113.435 -177.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.38 -38.54 87.38 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 120.955 0.407 . . . . 0.0 111.494 -178.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.9 t -98.37 2.75 48.27 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.598 -178.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 54.0 t -92.48 133.53 35.83 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.138 0.495 . . . . 0.0 111.709 -177.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -116.87 11.02 14.3 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.091 179.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.642 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 18.8 m -83.28 157.61 22.56 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.922 -178.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.481 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -88.4 -166.16 42.01 Favored Glycine 0 N--CA 1.437 -1.3 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 175.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.6 m -79.82 -15.38 57.53 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 117.467 0.634 . . . . 0.0 111.774 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.8 m -99.96 73.68 1.76 Allowed 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.887 0.375 . . . . 0.0 110.99 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.2 t -144.71 165.96 26.57 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.929 177.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 10.0 m -63.38 -28.97 70.35 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.712 -179.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 16.3 p -92.83 19.29 7.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.076 0.465 . . . . 0.0 110.564 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.559 ' HE3' ' O ' ' A' ' 38' ' ' THR . 48.7 mmtm . . . . . 0 C--O 1.262 1.748 0 CA-C-O 117.681 -1.152 . . . . 0.0 111.041 -179.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.337 0 N-CA-C 112.54 -0.224 . . . . 0.0 112.54 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.4 m 60.17 30.93 20.3 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 122.886 0.474 . . . . 0.0 111.818 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 177.28 -119.95 0.71 Allowed Glycine 0 N--CA 1.44 -1.091 0 C-N-CA 119.878 -1.153 . . . . 0.0 113.173 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.2 mtmt -102.67 6.75 39.77 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.815 0.34 . . . . 0.0 111.498 -177.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.39 166.6 19.39 Favored Glycine 0 N--CA 1.442 -0.911 0 C-N-CA 120.486 -0.864 . . . . 0.0 112.553 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -76.8 -28.47 55.63 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.923 0.392 . . . . 0.0 110.903 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 155.47 179.19 30.41 Favored Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 111.149 -0.781 . . . . 0.0 111.149 -179.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -115.29 -22.09 9.57 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.05 0.452 . . . . 0.0 110.976 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -82.71 2.03 35.69 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-O 121.355 0.597 . . . . 0.0 110.02 176.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.626 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 38.0 m -74.13 149.44 41.03 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.254 177.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.594 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 61.6 p -77.2 164.26 25.78 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.018 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.0 m -63.15 -24.9 68.1 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.2 -46.47 70.55 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.355 177.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.615 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 47.9 t -70.22 -29.83 66.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.101 179.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.594 ' HG3' ' O ' ' A' ' 11' ' ' THR . 85.6 mtt180 -70.72 -8.9 55.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.042 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.8 m -90.93 166.41 13.06 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.842 178.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -132.25 120.47 17.09 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-O 120.47 0.176 . . . . 0.0 110.985 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -73.53 -177.31 19.01 Favored 'Cis proline' 0 C--N 1.351 0.669 0 C-N-CA 123.589 -1.421 . . . . 0.0 112.038 0.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.8 t -60.76 139.68 57.83 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.128 -178.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 81.3 mm-40 -111.55 12.11 21.3 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.223 -179.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.615 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 78.9 m -82.89 26.89 0.57 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.86 0.362 . . . . 0.0 110.749 178.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.03 -47.29 88.62 Favored Glycine 0 C--O 1.224 -0.499 0 CA-C-N 116.067 -0.515 . . . . 0.0 112.854 -178.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 41.3 m -128.64 25.28 5.71 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 120.791 0.329 . . . . 0.0 110.649 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -164.89 95.87 0.71 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.746 -179.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 49.1 t -122.84 145.85 48.07 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.574 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.405 ' HB3' HG22 ' A' ' 11' ' ' THR . 13.7 tt0 -149.75 14.84 0.85 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.011 -0.54 . . . . 0.0 109.851 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.626 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 95.1 m -61.7 142.85 56.96 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -177.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.54 -157.79 29.14 Favored Glycine 0 N--CA 1.438 -1.224 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.718 177.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.14 -5.12 50.68 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 117.242 0.521 . . . . 0.0 110.971 178.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -95.26 54.01 1.81 Allowed Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.264 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.5 t -128.99 146.05 51.08 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 178.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.2 t -123.89 14.7 9.27 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.178 0.513 . . . . 0.0 110.08 179.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 8.6 t -92.0 136.76 32.91 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.502 -177.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -96.3 -3.65 43.56 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.129 0.49 . . . . 0.0 110.616 179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.1 -31.39 58.67 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.309 -179.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.431 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 7.6 p -114.88 -16.02 11.76 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -177.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.411 ' HE2' ' O ' ' A' ' 55' ' ' PRO . 85.2 tttt -84.77 109.51 18.11 Favored 'General case' 0 C--N 1.329 -0.309 0 C-N-CA 120.949 -0.3 . . . . 0.0 110.755 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 t -121.38 176.2 5.77 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.881 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.466 ' HB3' ' N ' ' A' ' 55' ' ' PRO . 42.6 t -162.85 148.32 12.04 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 122.554 0.342 . . . . 0.0 110.342 -178.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -107.29 -14.88 14.78 Favored 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 83.5 m -77.78 144.36 37.2 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 177.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 49.5 p -127.78 -179.78 5.13 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.548 0.213 . . . . 0.0 111.435 -175.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 40.3 m -62.83 -16.08 56.91 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -177.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -66.09 -34.42 78.02 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.167 0.508 . . . . 0.0 110.11 177.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 160.93 151.29 6.18 Favored Glycine 0 N--CA 1.435 -1.407 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.741 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 39.6 t -73.99 139.08 44.55 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -108.74 -15.21 14.45 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -177.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.632 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 15.2 p -102.17 -33.21 9.74 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 120.186 -0.605 . . . . 0.0 110.867 -179.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.36 10.46 17.44 Favored Glycine 0 CA--C 1.523 0.564 0 C-N-CA 120.762 -0.732 . . . . 0.0 113.53 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.728 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 31.7 mmtp -90.81 1.64 56.76 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 117.12 0.46 . . . . 0.0 111.519 -179.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.412 ' HB2' ' O ' ' A' ' 50' ' ' LYS . 37.5 mm-40 70.17 21.41 5.96 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.58 0.55 . . . . 0.0 111.163 -179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 16.0 p -96.86 146.74 24.65 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.137 179.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.1 p -135.09 35.74 3.04 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-O 120.929 0.395 . . . . 0.0 110.874 179.287 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 158.83 157.28 8.42 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.429 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.466 ' N ' ' HB3' ' A' ' 39' ' ' CYS . 10.8 Cg_endo -52.22 -51.26 11.54 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 124.078 3.185 . . . . 0.0 115.104 -177.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -71.22 -35.04 71.35 Favored 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 120.547 -0.461 . . . . 0.0 110.938 -176.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.2 m -84.9 -0.91 55.74 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.754 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.488 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 44.2 t -74.68 146.15 42.57 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.909 -179.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -108.98 -4.88 16.34 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.64 -179.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.728 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 11.0 m -81.44 151.35 27.92 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.474 -177.003 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -109.34 62.24 0.29 Allowed Glycine 0 N--CA 1.442 -0.907 0 CA-C-N 115.956 -0.565 . . . . 0.0 112.306 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.488 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 49.2 m 69.79 -37.95 0.39 Allowed 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.01 1.115 . . . . 0.0 114.01 177.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.3 p -84.37 67.69 9.95 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -177.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 35.8 t -146.13 169.97 17.65 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.723 176.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.1 t -75.09 -21.53 58.88 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.384 -179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.49 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 9.3 p -82.15 22.49 0.8 Allowed 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 121.246 0.546 . . . . 0.0 110.574 179.729 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.488 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 66.8 mmtt . . . . . 0 C--O 1.271 2.208 0 CA-C-O 117.338 -1.315 . . . . 0.0 110.109 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.35 0 N-CA-C 112.188 -0.365 . . . . 0.0 112.188 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.0 m -78.51 110.23 13.41 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 110.199 -0.297 . . . . 0.0 110.199 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -66.45 104.91 1.14 Allowed Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -69.54 96.43 0.92 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.365 0.602 . . . . 0.0 111.732 -177.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -132.71 125.6 4.2 Favored Glycine 0 N--CA 1.429 -1.808 0 N-CA-C 110.538 -1.025 . . . . 0.0 110.538 177.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.675 ' HA ' ' SG ' ' A' ' 10' ' ' CYS . 38.4 ttmt 77.37 95.18 0.06 Allowed 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 123.812 0.845 . . . . 0.0 111.417 -178.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 167.35 168.74 29.96 Favored Glycine 0 N--CA 1.436 -1.327 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.628 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 66.9 -70.35 0.11 Allowed 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.469 0.708 . . . . 0.0 112.474 178.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.481 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 27.8 mtpp -101.01 4.74 42.68 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 120.662 0.268 . . . . 0.0 111.359 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.675 ' SG ' ' HA ' ' A' ' 6' ' ' LYS . 6.9 m -77.73 163.95 25.69 Favored 'General case' 0 CA--C 1.505 -0.775 0 CA-C-O 121.031 0.443 . . . . 0.0 110.119 175.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 65.6 p -104.23 162.78 12.9 Favored 'General case' 0 C--N 1.297 -1.684 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.838 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.2 m -70.19 -13.75 62.32 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.285 0.564 . . . . 0.0 110.313 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.09 -34.38 32.67 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.899 176.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.607 ' SG ' ' HE2' ' A' ' 6' ' ' LYS . 43.1 t -75.53 -29.0 59.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.573 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.4 mtt180 -77.67 8.94 3.82 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.261 0.553 . . . . 0.0 111.018 177.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 39.2 t -108.08 150.14 27.55 Favored 'General case' 0 N--CA 1.435 -1.186 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.415 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 11.2 pt-20 -127.85 124.37 23.24 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-O 120.601 0.239 . . . . 0.0 110.526 178.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.415 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 7.9 Cg_exo -70.15 169.83 63.1 Favored 'Cis proline' 0 C--O 1.239 0.565 0 C-N-CA 123.069 -1.638 . . . . 0.0 112.007 0.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 13.4 t -56.89 138.18 54.13 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.31 -177.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -112.37 16.25 20.0 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.167 -178.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 56.6 m -89.32 14.25 11.57 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.293 179.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.59 -49.1 76.52 Favored Glycine 0 CA--C 1.521 0.432 0 C-N-CA 121.293 -0.48 . . . . 0.0 113.103 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.7 m -113.0 13.13 19.42 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.898 0.38 . . . . 0.0 111.265 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.508 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 57.3 tttm -164.93 101.5 0.77 Allowed 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.391 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.428 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 45.1 t -132.18 149.7 52.33 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.196 -179.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -153.38 22.25 0.55 Allowed 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.901 178.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 91.0 m -68.44 144.97 54.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.095 0.474 . . . . 0.0 111.271 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.47 ' HA3' ' HE3' ' A' ' 9' ' ' LYS . . . -81.19 -156.78 15.81 Favored Glycine 0 N--CA 1.441 -0.972 0 CA-C-N 115.48 -0.782 . . . . 0.0 112.816 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.519 ' CD ' ' H ' ' A' ' 29' ' ' GLU . 0.2 OUTLIER -78.55 -31.49 47.46 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.793 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -78.87 60.69 4.13 Favored Glycine 0 N--CA 1.444 -0.803 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.209 178.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 48.4 t -129.11 142.33 50.92 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 177.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.8 t -120.43 12.61 11.67 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.13 0.49 . . . . 0.0 110.753 -178.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.437 ' SG ' ' HB3' ' A' ' 35' ' ' ALA . 48.9 t -90.27 115.88 27.82 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.042 0.448 . . . . 0.0 110.172 179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -79.96 4.73 16.0 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.454 -178.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.437 ' HB3' ' SG ' ' A' ' 33' ' ' CYS . . . -80.77 -42.83 21.13 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.812 179.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 8.9 p -106.34 -36.13 6.93 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.375 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -80.61 116.42 20.62 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.207 0.527 . . . . 0.0 110.424 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.417 ' HA ' ' HG3' ' A' ' 55' ' ' PRO . 12.0 t -123.31 -176.2 3.38 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.471 -179.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 41.8 t -154.24 140.35 18.41 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.33 -17.26 27.66 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.299 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 99.6 m -73.81 154.53 39.48 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.126 0.489 . . . . 0.0 111.305 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 40.2 p -115.44 -173.63 2.37 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.477 -175.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 18.0 m -71.56 -6.01 37.55 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.599 -179.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -60.03 -37.91 81.16 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.054 0.454 . . . . 0.0 110.817 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 129.03 56.4 0.1 Allowed Glycine 0 N--CA 1.443 -0.852 0 C-N-CA 119.997 -1.096 . . . . 0.0 112.784 178.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.435 ' SG ' ' N ' ' A' ' 51' ' ' GLU . 44.8 t 72.34 142.04 0.06 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.444 0.64 . . . . 0.0 112.353 178.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 35.9 mmtp -122.88 -40.58 2.41 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.801 179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.45 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 13.5 p -72.64 -38.13 67.81 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.771 0.32 . . . . 0.0 110.89 -178.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 122.97 0.29 9.78 Favored Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.134 179.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -92.87 14.63 16.89 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 117.078 0.439 . . . . 0.0 111.893 -179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.435 ' N ' ' SG ' ' A' ' 46' ' ' CYS . 34.6 mt-10 60.24 36.46 20.8 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.538 -0.755 . . . . 0.0 112.627 175.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 3.5 p -111.13 151.55 28.01 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 120.879 0.371 . . . . 0.0 111.182 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.6 p -137.76 77.79 1.65 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.928 0.394 . . . . 0.0 110.893 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 99.37 155.48 28.6 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.27 -0.967 . . . . 0.0 112.246 179.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.417 ' HG3' ' HA ' ' A' ' 38' ' ' THR . 83.3 Cg_exo -43.34 -51.72 5.62 Favored 'Trans proline' 0 N--CA 1.478 0.612 0 C-N-CA 124.1 3.2 . . . . 0.0 114.712 -177.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -62.33 -35.8 80.21 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 121.012 0.434 . . . . 0.0 111.555 -177.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.3 m -99.27 19.85 14.67 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.188 -178.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 53.4 t -103.62 129.61 50.93 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-O 121.143 0.496 . . . . 0.0 110.997 179.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -109.8 4.31 21.61 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.471 0.653 . . . . 0.0 109.79 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 5.0 m -82.14 156.72 24.34 Favored 'General case' 0 C--O 1.241 0.638 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.373 -178.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.416 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -83.64 -178.7 51.99 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.01 178.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.1 p -79.63 -6.97 58.21 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -177.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.3 m -100.79 10.52 41.04 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.783 0.325 . . . . 0.0 110.937 -179.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 30.8 t -84.64 164.86 18.39 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 120.944 0.402 . . . . 0.0 111.69 -177.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.6 m -64.16 -34.31 77.78 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.321 0.649 . . . . 0.0 112.185 -177.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.473 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 19.7 p -82.26 20.13 1.1 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.946 0.403 . . . . 0.0 111.033 -179.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.473 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 48.1 mmtm . . . . . 0 C--O 1.263 1.773 0 CA-C-O 117.863 -1.065 . . . . 0.0 110.47 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.219 0 N-CA-C 112.114 -0.394 . . . . 0.0 112.114 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.2 t -109.61 88.26 2.7 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -134.53 30.31 2.9 Favored Glycine 0 N--CA 1.446 -0.686 0 N-CA-C 111.187 -0.765 . . . . 0.0 111.187 178.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -102.82 9.01 39.2 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.636 0.255 . . . . 0.0 111.42 -177.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.91 -136.52 12.89 Favored Glycine 0 N--CA 1.44 -1.079 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.261 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.535 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 23.2 pttm -91.39 135.69 33.64 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.783 0.325 . . . . 0.0 110.743 -179.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 175.76 152.04 9.17 Favored Glycine 0 N--CA 1.444 -0.82 0 C-N-CA 120.37 -0.919 . . . . 0.0 112.476 179.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 66.76 -71.93 0.09 Allowed 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.636 0.774 . . . . 0.0 112.7 178.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 14.0 mptt -69.89 -32.96 71.58 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.326 -178.129 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.693 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 73.8 m -65.28 137.11 57.34 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.162 0.506 . . . . 0.0 111.138 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.665 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 44.5 p -78.0 175.13 10.37 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.017 -177.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.6 m -70.21 -25.44 63.41 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 175.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.558 ' HB1' ' HB2' ' A' ' 20' ' ' GLN . . . -69.95 -40.55 75.4 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.033 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.529 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 40.5 t -69.35 -25.13 64.04 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.339 0.59 . . . . 0.0 110.773 179.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.665 ' HG3' ' O ' ' A' ' 11' ' ' THR . 60.0 mtt180 -81.21 -2.66 49.59 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.016 -178.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.1 m -104.68 156.34 18.07 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 177.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.506 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 8.8 pt-20 -128.12 129.92 23.63 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-O 120.779 0.323 . . . . 0.0 111.179 179.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.506 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 44.4 Cg_endo -67.61 169.3 52.94 Favored 'Cis proline' 0 C--N 1.351 0.706 0 C-N-CA 123.143 -1.607 . . . . 0.0 111.15 -0.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.529 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 26.3 t -59.07 133.84 56.46 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-O 121.159 0.504 . . . . 0.0 110.636 -177.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.558 ' HB2' ' HB1' ' A' ' 13' ' ' ALA . 27.4 mm-40 -97.01 12.1 33.73 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.858 -177.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.606 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 91.6 m -96.23 23.66 6.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.314 176.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -46.77 -52.44 11.45 Favored Glycine 0 C--N 1.338 0.667 0 O-C-N 123.438 0.461 . . . . 0.0 113.595 -177.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 26.1 p -120.97 -20.48 6.86 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-O 120.857 0.36 . . . . 0.0 110.989 179.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -114.88 81.35 1.55 Allowed 'General case' 0 CA--C 1.507 -0.696 0 CA-C-O 121.122 0.487 . . . . 0.0 110.585 -178.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.595 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 53.6 t -95.57 143.95 26.44 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.31 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.406 ' HB2' HG21 ' A' ' 11' ' ' THR . 55.0 mt-30 -140.68 19.46 2.34 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.245 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.693 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 85.5 m -77.8 179.17 6.84 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.875 179.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -129.93 -135.2 3.83 Favored Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.318 -179.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.477 ' HA ' ' HA3' ' A' ' 61' ' ' GLY . 0.5 OUTLIER -89.7 -10.44 45.73 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.122 0.487 . . . . 0.0 110.639 179.461 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -94.09 36.94 3.55 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.774 178.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.423 ' HA ' ' SG ' ' A' ' 10' ' ' CYS . 43.0 t -112.8 135.65 53.3 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.8 t -118.89 12.59 12.92 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-O 121.012 0.434 . . . . 0.0 110.111 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.2 t -81.43 166.26 20.53 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.064 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.06 -7.74 11.29 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 120.936 0.398 . . . . 0.0 110.935 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.24 -54.79 5.41 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.411 -178.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.606 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 3.5 p -82.9 -15.99 49.25 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.797 -178.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.505 ' HE2' ' O ' ' A' ' 55' ' ' PRO . 87.8 tttt -75.0 100.5 4.18 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.073 0.464 . . . . 0.0 110.865 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 t -108.32 -178.77 3.69 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.047 179.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 47.1 t -161.48 150.35 15.98 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.412 HD22 ' C ' ' A' ' 66' ' ' CYS . 23.9 m-80 -108.3 -18.71 13.69 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -179.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.1 m -75.36 133.88 41.12 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 25.0 p -103.53 176.34 5.18 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 120.886 0.374 . . . . 0.0 111.685 -175.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.505 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.6 m -70.04 0.8 5.4 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.847 -178.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -86.96 -22.88 25.32 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.218 0.532 . . . . 0.0 110.095 178.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 158.59 153.59 6.84 Favored Glycine 0 N--CA 1.436 -1.354 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.006 -179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 54.1 t -74.05 136.95 43.09 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -107.74 -27.31 10.36 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -177.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.439 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 9.4 p -86.35 -31.82 21.33 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.966 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.19 2.58 33.62 Favored Glycine 0 CA--C 1.522 0.473 0 C-N-CA 120.563 -0.827 . . . . 0.0 113.599 177.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.428 ' O ' ' HE2' ' A' ' 59' ' ' LYS . 45.4 mmtm -88.64 0.25 56.59 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.061 0.458 . . . . 0.0 110.28 178.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 64.51 65.2 0.65 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.053 -179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.6 p -136.34 144.19 44.5 Favored 'General case' 0 N--CA 1.432 -1.337 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.028 176.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.505 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 22.6 p -131.79 63.71 1.61 Allowed 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.205 0.526 . . . . 0.0 111.097 -179.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 125.52 159.63 10.39 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 120.831 -0.699 . . . . 0.0 111.705 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.505 ' O ' ' HE2' ' A' ' 37' ' ' LYS . 10.9 Cg_endo -54.01 -40.04 82.81 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 123.212 2.608 . . . . 0.0 113.332 -177.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -67.72 -37.7 82.59 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.898 0.38 . . . . 0.0 110.99 -178.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.2 t -91.49 3.31 55.28 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.948 -178.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 53.1 t -84.77 143.18 29.29 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 121.109 0.481 . . . . 0.0 110.979 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.428 ' HE2' ' O ' ' A' ' 50' ' ' LYS . 63.3 pttt -122.77 14.05 10.02 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.338 178.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 12.2 m -96.04 162.26 13.63 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.577 -178.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.481 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -96.1 -178.38 36.03 Favored Glycine 0 N--CA 1.427 -1.916 0 N-CA-C 109.946 -1.261 . . . . 0.0 109.946 175.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 14.1 m -75.86 25.05 0.12 Allowed 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 117.21 0.505 . . . . 0.0 111.421 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.41 ' H ' ' C ' ' A' ' 61' ' ' GLY . 17.4 m -125.76 19.22 7.91 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.521 -178.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.0 t -102.76 171.4 7.43 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 178.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 47.3 m -72.13 -22.0 61.39 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.764 0.316 . . . . 0.0 111.397 -178.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.472 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 15.1 p -91.12 26.96 2.0 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.178 0.513 . . . . 0.0 110.279 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.481 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 43.5 mmtm . . . . . 0 C--O 1.263 1.799 0 CA-C-O 117.888 -1.053 . . . . 0.0 111.17 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.512 0 N-CA-C 112.378 -0.289 . . . . 0.0 112.378 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.5 m -104.41 -30.69 9.91 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.052 0.453 . . . . 0.0 110.66 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -157.73 133.14 3.41 Favored Glycine 0 N--CA 1.439 -1.149 0 N-CA-C 111.289 -0.724 . . . . 0.0 111.289 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 48.4 mtmt -90.89 105.2 17.66 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 120.554 0.216 . . . . 0.0 111.013 -179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -91.57 10.06 75.61 Favored Glycine 0 C--N 1.318 -0.455 0 C-N-CA 120.597 -0.811 . . . . 0.0 111.411 177.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.705 ' HD2' ' SG ' ' A' ' 10' ' ' CYS . 39.1 pttt -142.69 -168.13 2.68 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 122.639 0.376 . . . . 0.0 110.048 -179.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -135.49 -145.48 5.13 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 119.801 -1.19 . . . . 0.0 113.794 -176.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -86.83 13.57 8.69 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.132 0.419 . . . . 0.0 112.132 -177.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.561 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 31.2 mmtp -87.94 -6.18 58.17 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.0 0.428 . . . . 0.0 110.172 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.705 ' SG ' ' HD2' ' A' ' 6' ' ' LYS . 64.2 m -78.46 157.01 29.06 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.151 178.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 36.4 p -96.1 168.4 10.63 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 115.184 -0.916 . . . . 0.0 109.777 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.6 m -71.24 -16.89 62.51 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 121.443 0.64 . . . . 0.0 109.537 175.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -77.67 -38.36 47.82 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.259 178.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.524 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 50.5 t -71.85 -28.42 63.54 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.715 179.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 48.2 mtp180 -82.39 9.19 9.55 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.032 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.5 m -108.06 157.57 18.14 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -127.83 121.95 22.22 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.651 0.263 . . . . 0.0 110.996 179.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.35 175.31 44.19 Favored 'Cis proline' 0 C--N 1.351 0.663 0 C-N-CA 123.246 -1.564 . . . . 0.0 112.048 0.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 20.0 t -61.85 129.91 43.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.082 0.468 . . . . 0.0 110.526 -178.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.0 mm-40 -102.83 11.02 38.07 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.958 -177.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.524 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 87.0 m -76.72 2.97 12.77 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -56.65 103.38 0.26 Allowed Glycine 0 CA--C 1.518 0.223 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.385 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.5 t 64.33 24.0 13.17 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.481 0.657 . . . . 0.0 110.68 -179.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -144.9 14.55 1.52 Allowed 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.514 -179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.489 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 46.4 t -70.11 141.26 52.76 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.07 -175.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -138.65 11.75 2.71 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.172 178.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 64.3 m -63.9 139.86 58.81 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.381 -178.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -81.67 -171.85 46.21 Favored Glycine 0 N--CA 1.44 -1.08 0 CA-C-N 115.498 -0.774 . . . . 0.0 111.89 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.93 17.28 0.34 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.223 0.535 . . . . 0.0 112.214 -178.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -116.04 37.0 3.58 Favored Glycine 0 N--CA 1.439 -1.106 0 N-CA-C 111.508 -0.637 . . . . 0.0 111.508 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.7 t -123.12 156.77 34.33 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 110.198 -0.297 . . . . 0.0 110.198 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.0 t -131.06 7.23 4.64 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.331 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 16.5 t -76.81 116.02 17.11 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 109.549 -0.537 . . . . 0.0 109.549 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.07 -3.91 25.77 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.295 -179.043 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -81.68 -13.48 57.82 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.643 -179.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.516 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 6.3 p -134.38 -31.35 1.09 Allowed 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -177.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt -91.51 115.3 27.92 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 120.441 -0.503 . . . . 0.0 109.781 -177.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.57 164.93 12.06 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.381 -176.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 39.2 t -160.21 159.03 31.06 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 116.097 -0.501 . . . . 0.0 109.773 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.4 m-80 -123.81 -6.91 7.92 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 95.0 m -73.12 157.78 36.59 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.835 178.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 23.8 p -126.47 -177.36 3.96 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 115.679 -0.692 . . . . 0.0 111.728 -174.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.1 m -70.88 -1.47 11.88 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.002 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -59.04 -26.48 64.63 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.08 176.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 125.18 42.65 0.32 Allowed Glycine 0 CA--C 1.501 -0.843 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.232 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 48.3 t 69.1 138.96 0.04 OUTLIER 'General case' 0 C--N 1.341 0.207 0 C-N-CA 123.051 0.541 . . . . 0.0 110.395 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 40.4 mtpt -123.19 1.76 9.15 Favored 'General case' 0 C--N 1.31 -1.15 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.375 -177.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.538 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 2.8 p -111.65 -40.92 4.19 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.023 0.44 . . . . 0.0 110.015 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 119.96 14.63 5.52 Favored Glycine 0 CA--C 1.525 0.681 0 C-N-CA 120.811 -0.709 . . . . 0.0 113.228 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.697 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.3 mmtt -102.18 5.14 40.08 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 117.198 0.499 . . . . 0.0 110.778 178.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.445 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 17.7 tt0 70.93 16.82 6.45 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.387 0.675 . . . . 0.0 110.793 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.492 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 25.9 p -93.59 143.55 26.2 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 120.975 0.417 . . . . 0.0 110.514 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 31.3 p -124.2 31.78 5.7 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-O 121.283 0.563 . . . . 0.0 110.749 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 140.86 171.88 12.74 Favored Glycine 0 N--CA 1.441 -0.972 0 N-CA-C 111.009 -0.836 . . . . 0.0 111.009 -177.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -57.55 -29.61 85.54 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 122.893 2.395 . . . . 0.0 112.628 -177.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -62.57 -37.5 86.43 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.854 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 12.1 m -113.04 3.66 16.27 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -176.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.492 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 48.5 t -74.82 135.22 41.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.787 0.327 . . . . 0.0 110.629 -179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 17.1 ttpp -136.22 33.48 2.82 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.671 -177.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.697 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 2.7 m -96.32 -179.05 4.51 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.015 0.436 . . . . 0.0 110.05 176.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -99.55 -143.41 14.51 Favored Glycine 0 N--CA 1.432 -1.57 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 174.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 12.9 p -91.62 -28.77 17.29 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 116.923 0.361 . . . . 0.0 111.205 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.8 m -87.71 67.5 9.22 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.158 0.429 . . . . 0.0 112.158 -176.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 7.1 t -142.76 155.06 44.79 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.207 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.0 m -70.1 -24.35 63.19 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -175.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.462 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 17.5 p -86.03 7.84 22.95 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.939 0.4 . . . . 0.0 111.191 -178.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.462 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 47.3 mmtm . . . . . 0 C--O 1.262 1.741 0 CA-C-O 117.56 -1.209 . . . . 0.0 111.144 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.293 0 N-CA-C 112.289 -0.324 . . . . 0.0 112.289 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.6 m -128.57 149.32 50.67 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -85.66 -31.35 21.63 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.28 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.507 ' HB2' ' HB ' ' A' ' 32' ' ' THR . 66.3 mttm -89.19 152.02 21.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.94 0.4 . . . . 0.0 111.411 -179.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -105.63 109.87 3.31 Favored Glycine 0 N--CA 1.442 -0.96 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 177.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.741 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 21.2 ptmt -102.09 169.51 8.7 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 120.507 0.194 . . . . 0.0 110.668 -178.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 132.07 -47.26 1.02 Allowed Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 120.313 -0.946 . . . . 0.0 113.754 177.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.403 ' H ' ' CD ' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -88.0 -42.62 12.32 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.057 0.456 . . . . 0.0 111.71 -176.28 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 31.4 mmtp -83.41 -17.48 42.05 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 121.066 0.46 . . . . 0.0 110.165 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.741 ' SG ' ' HB2' ' A' ' 6' ' ' LYS . 66.3 m -73.43 150.95 41.32 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.041 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 46.9 p -87.11 167.28 14.32 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.744 -179.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.9 m -63.93 -27.26 69.02 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 177.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.68 -43.08 76.89 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.458 178.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.494 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 44.0 t -69.83 -34.9 74.29 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.921 0.391 . . . . 0.0 110.301 178.163 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.1 mtp180 -70.31 -14.37 62.56 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.199 179.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.5 m -81.72 151.1 27.66 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 175.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.404 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 7.9 pt-20 -129.64 123.22 21.1 Favored Pre-proline 0 C--N 1.313 -1.012 0 CA-C-O 120.726 0.298 . . . . 0.0 111.508 -177.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.404 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 55.4 Cg_endo -69.2 167.56 68.95 Favored 'Cis proline' 0 C--O 1.242 0.687 0 C-N-CA 123.314 -1.536 . . . . 0.0 111.805 -1.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.494 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 49.7 t -52.77 147.08 9.39 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-O 121.06 0.457 . . . . 0.0 111.947 -177.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 30.0 mm-40 -124.33 15.8 9.01 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.942 -178.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 67.5 m -69.0 -77.34 0.08 Allowed 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.751 0.31 . . . . 0.0 111.625 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 63.7 -106.9 1.52 Allowed Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.501 -177.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.3 m -97.92 -1.18 43.44 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 120.976 0.417 . . . . 0.0 110.847 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -106.37 27.22 8.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.621 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 47.6 t -73.98 142.77 45.82 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 121.233 0.539 . . . . 0.0 112.224 -177.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -148.79 25.0 0.95 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.164 -0.926 . . . . 0.0 109.964 178.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.621 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 67.7 m -72.27 -175.33 1.52 Allowed 'General case' 0 C--O 1.238 0.475 0 CA-C-O 121.109 0.48 . . . . 0.0 111.909 -178.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -117.61 -172.75 16.06 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.757 -179.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -70.86 -12.28 61.45 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 122.858 0.463 . . . . 0.0 111.576 -178.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -96.34 20.06 51.92 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.628 -178.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.0 t -93.49 140.7 29.29 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.075 0.464 . . . . 0.0 110.327 179.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.507 ' HB ' ' HB2' ' A' ' 4' ' ' LYS . 11.0 t -122.3 17.9 10.64 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.129 -178.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.457 ' SG ' ' HB3' ' A' ' 35' ' ' ALA . 45.0 t -87.67 117.61 26.61 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.78 -11.72 60.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.341 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.457 ' HB3' ' SG ' ' A' ' 33' ' ' CYS . . . -66.15 -45.37 81.23 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.019 179.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.463 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 6.1 p -106.34 -17.96 14.13 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -178.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.419 ' HD3' ' O ' ' A' ' 55' ' ' PRO . 21.4 ttmm -63.49 107.02 1.03 Allowed 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 178.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.2 t -127.08 152.62 47.04 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 120.819 0.342 . . . . 0.0 110.997 -178.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.438 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 19.8 t -154.26 144.9 22.38 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.591 178.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -98.18 -26.29 14.61 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -178.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 74.7 m -67.96 144.17 55.31 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 177.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 26.8 p -123.09 -172.2 2.45 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.847 -176.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 9.0 m -70.4 -8.14 48.49 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.169 0.509 . . . . 0.0 110.575 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -67.09 -28.7 68.39 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.654 175.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.75 157.67 7.27 Favored Glycine 0 N--CA 1.439 -1.165 0 CA-C-N 115.509 -0.769 . . . . 0.0 111.989 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.4 ' SG ' ' N ' ' A' ' 51' ' ' GLU . 42.9 t -74.26 139.13 44.09 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -127.15 -3.82 6.28 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -178.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.432 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 12.3 p -97.6 -29.67 13.3 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.49 -179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.44 9.01 18.24 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 120.4 -0.905 . . . . 0.0 113.584 179.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.732 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 47.0 mmtm -98.55 -1.08 41.93 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-N 117.352 0.576 . . . . 0.0 111.264 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.4 ' N ' ' SG ' ' A' ' 46' ' ' CYS . 48.5 mt-10 66.43 22.67 10.68 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.153 0.581 . . . . 0.0 111.1 -177.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 27.2 p -95.2 142.16 27.96 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.95 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 24.1 p -121.91 33.93 5.34 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-O 121.282 0.563 . . . . 0.0 110.593 -179.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 144.07 170.61 13.63 Favored Glycine 0 N--CA 1.435 -1.395 0 C-N-CA 120.762 -0.733 . . . . 0.0 111.33 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.438 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 28.6 Cg_endo -62.93 -15.69 49.18 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.834 2.356 . . . . 0.0 112.728 -178.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -66.78 -45.32 78.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.862 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.7 m -113.01 16.7 19.27 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.057 0.456 . . . . 0.0 110.769 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.47 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 38.9 t -77.82 122.44 25.44 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -124.43 18.03 8.94 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.478 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.732 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 8.3 m -68.58 147.19 52.3 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.218 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -82.29 43.15 2.98 Favored Glycine 0 CA--C 1.521 0.463 0 C-N-CA 120.818 -0.706 . . . . 0.0 113.231 -178.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.6 m 69.09 -48.89 0.59 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.957 0.903 . . . . 0.0 113.033 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.1 t -76.01 76.39 2.88 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.081 0.467 . . . . 0.0 110.18 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.9 t -140.01 170.53 15.69 Favored 'General case' 0 N--CA 1.436 -1.17 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.056 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 38.2 t -76.3 -30.52 57.78 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.322 -179.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.51 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 7.8 p -84.26 17.62 2.48 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 120.96 0.409 . . . . 0.0 111.323 -178.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.51 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 48.6 mmtm . . . . . 0 C--O 1.256 1.409 0 CA-C-O 117.735 -1.126 . . . . 0.0 110.921 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.443 0 N-CA-C 112.317 -0.313 . . . . 0.0 112.317 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.0 m -95.34 -2.86 48.35 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.852 0.358 . . . . 0.0 111.19 -178.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -85.36 76.98 2.13 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.949 -0.644 . . . . 0.0 111.852 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -94.27 -28.96 15.31 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 120.987 0.423 . . . . 0.0 110.374 -179.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.96 165.27 18.71 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.105 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.662 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 21.6 ptmt -66.82 143.75 56.7 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.883 0.373 . . . . 0.0 111.147 -179.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 159.97 -76.81 0.19 Allowed Glycine 0 N--CA 1.442 -0.944 0 C-N-CA 120.251 -0.976 . . . . 0.0 112.923 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -58.76 -30.9 67.88 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.316 0.487 . . . . 0.0 112.316 -176.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.452 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 71.2 mmtt -102.98 -0.95 30.16 Favored 'General case' 0 C--N 1.31 -1.121 0 C-N-CA 120.956 -0.298 . . . . 0.0 111.621 179.328 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.662 ' SG ' ' HB2' ' A' ' 6' ' ' LYS . 94.2 m -97.23 159.24 15.03 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-O 121.298 0.57 . . . . 0.0 111.539 -178.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.487 HG21 ' H ' ' A' ' 26' ' ' GLN . 41.9 p -93.55 -178.67 4.79 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.498 -176.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.0 m -80.44 -20.84 42.92 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.308 0.575 . . . . 0.0 109.676 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.2 -35.83 48.04 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.859 179.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.463 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 43.9 t -71.67 -13.67 61.81 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.712 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.473 ' HG2' ' O ' ' A' ' 11' ' ' THR . 12.5 mmt180 -72.24 -20.59 61.52 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.812 179.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.437 ' HB2' ' HG2' ' A' ' 20' ' ' GLN . 37.2 m -91.72 164.78 13.6 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -175.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.431 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 14.1 pt-20 -140.84 118.04 7.83 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.506 177.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.431 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 13.1 Cg_exo -66.69 171.45 39.7 Favored 'Cis proline' 0 C--N 1.352 0.732 0 C-N-CA 123.1 -1.625 . . . . 0.0 112.033 0.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.463 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 13.7 t -66.28 150.07 49.38 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.854 -175.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.437 ' HG2' ' HB2' ' A' ' 16' ' ' SER . 29.1 mm-40 -113.89 7.06 16.85 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.489 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.425 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 78.4 m -68.12 -75.61 0.1 Allowed 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.699 0.285 . . . . 0.0 111.22 179.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 65.91 -109.23 2.77 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.586 -0.816 . . . . 0.0 111.418 -177.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.5 t -95.19 -17.96 21.3 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.456 0.646 . . . . 0.0 109.28 178.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 63.6 mttm -92.71 55.93 2.55 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.571 -0.741 . . . . 0.0 109.94 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 48.1 t -103.06 143.86 32.04 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.701 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.487 ' H ' HG21 ' A' ' 11' ' ' THR . 28.8 mm-40 -139.41 17.45 2.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.084 179.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 76.3 m -70.61 148.21 48.37 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.144 0.497 . . . . 0.0 111.928 -177.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -98.98 -160.63 29.55 Favored Glycine 0 N--CA 1.441 -1.019 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.552 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -73.28 -4.89 36.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.851 0.358 . . . . 0.0 111.781 -178.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -93.37 22.89 32.6 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.99 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.0 t -115.69 149.48 38.33 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.901 0.382 . . . . 0.0 110.919 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.2 t -133.62 12.58 4.08 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.138 178.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 37.8 t -72.51 119.96 17.45 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.222 0.534 . . . . 0.0 110.436 -178.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -76.11 -0.54 22.31 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.607 -178.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.78 -29.26 23.97 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.503 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.425 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 7.6 p -119.88 -26.12 5.69 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -83.29 107.05 15.56 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.987 0.422 . . . . 0.0 110.361 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.0 t -114.82 175.73 5.36 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.237 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 45.0 t -156.64 154.26 29.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.287 -178.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 26.8 m-80 -114.6 -12.91 12.18 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 81.6 m -77.38 127.66 32.93 Favored 'General case' 0 N--CA 1.439 -1.007 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 174.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 70.6 p -93.36 173.67 7.59 Favored 'General case' 0 C--N 1.297 -1.698 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.711 -172.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.537 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.7 m -66.94 -2.6 5.47 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.099 179.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -80.69 -36.45 32.3 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.987 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 168.09 151.58 7.14 Favored Glycine 0 N--CA 1.442 -0.945 0 C-N-CA 120.564 -0.827 . . . . 0.0 112.669 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.7 t -78.59 138.87 38.57 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 122.48 0.312 . . . . 0.0 110.421 179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 89.7 mttt -129.06 2.16 5.26 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.415 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 4.3 p -93.94 -37.68 11.57 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.006 -0.678 . . . . 0.0 109.737 177.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 124.32 -4.35 8.86 Favored Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.831 -0.699 . . . . 0.0 113.294 179.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.811 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 43.0 mmtm -87.62 -1.54 58.02 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 117.384 0.592 . . . . 0.0 111.527 -178.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 63.96 36.93 9.72 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.992 0.901 . . . . 0.0 109.865 -178.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 28.6 p -108.84 141.26 41.13 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.443 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.537 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 36.1 p -131.13 79.98 1.92 Allowed 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 177.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 105.72 159.9 22.83 Favored Glycine 0 N--CA 1.437 -1.263 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.468 -177.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -52.21 -31.15 44.64 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 123.437 2.758 . . . . 0.0 113.806 -178.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -63.95 -44.44 92.82 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 120.988 0.423 . . . . 0.0 111.602 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.534 ' HB2' ' H ' ' A' ' 53' ' ' THR . 19.5 m -89.62 -12.66 39.06 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.691 -178.251 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 49.0 t -68.05 131.56 45.67 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.948 -177.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -118.13 14.96 14.09 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.592 -179.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.811 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.8 m -103.34 164.41 11.66 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.278 -176.019 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -96.85 -166.3 33.11 Favored Glycine 0 N--CA 1.439 -1.121 0 N-CA-C 110.695 -0.962 . . . . 0.0 110.695 177.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.6 m -85.1 25.24 0.99 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 117.106 0.453 . . . . 0.0 111.312 -178.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.5 m -131.48 20.08 4.75 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 120.739 0.304 . . . . 0.0 111.638 -178.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . 0.423 ' SG ' ' N ' ' A' ' 65' ' ' SER . 46.0 t -99.68 171.26 8.01 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.79 0.329 . . . . 0.0 110.953 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.423 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 51.0 m -60.89 -34.51 74.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.556 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.448 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 31.9 p -82.89 21.84 0.99 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 120.969 0.414 . . . . 0.0 111.104 -179.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.448 ' HD3' ' O ' ' A' ' 66' ' ' CYS . 54.8 mmtt . . . . . 0 C--O 1.261 1.672 0 CA-C-O 117.494 -1.241 . . . . 0.0 110.061 178.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.432 0 N-CA-C 112.211 -0.355 . . . . 0.0 112.211 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.7 m -63.01 142.67 58.29 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 178.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -61.4 121.47 26.29 Favored Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 120.657 -0.782 . . . . 0.0 111.323 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.9 ttpm? 63.14 46.45 4.62 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.356 0.598 . . . . 0.0 110.522 -179.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -71.2 -38.8 63.06 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 177.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.648 ' HD2' ' SG ' ' A' ' 14' ' ' CYS . 48.7 mtmt -139.68 105.98 5.27 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 175.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -81.75 -161.77 28.63 Favored Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 115.925 -0.58 . . . . 0.0 114.269 -174.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.2 mp0 -80.39 -12.42 59.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.093 0.473 . . . . 0.0 110.575 -178.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -83.01 0.81 43.03 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.465 -177.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.6 m -72.85 160.53 32.0 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.402 0.62 . . . . 0.0 111.494 179.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.501 HG21 ' HB2' ' A' ' 26' ' ' GLN . 77.6 p -97.47 170.13 9.26 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.906 -179.657 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.8 m -64.77 -26.22 68.26 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.11 0.481 . . . . 0.0 109.971 177.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.82 -48.21 72.47 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.597 177.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.648 ' SG ' ' HD2' ' A' ' 6' ' ' LYS . 42.1 t -73.56 -24.66 60.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.044 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.9 mtm180 -79.57 -1.81 39.57 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.011 0.434 . . . . 0.0 111.424 179.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.3 m -105.35 150.0 25.59 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 176.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.406 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 10.7 pt-20 -119.09 129.8 25.19 Favored Pre-proline 0 C--N 1.322 -0.594 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.926 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.406 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 4.9 Cg_exo -72.45 175.04 45.57 Favored 'Cis proline' 0 C--O 1.236 0.395 0 C-N-CA 123.231 -1.571 . . . . 0.0 111.482 -0.195 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 48.9 t -55.39 135.33 50.35 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.009 0.433 . . . . 0.0 111.06 -178.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -110.55 20.11 18.03 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.694 -177.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.441 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 81.8 m -87.7 27.45 1.13 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.859 0.362 . . . . 0.0 110.695 178.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.98 -42.08 99.64 Favored Glycine 0 CA--C 1.52 0.389 0 CA-C-N 116.1 -0.5 . . . . 0.0 113.224 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 7.3 p -128.96 15.76 6.29 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.969 0.414 . . . . 0.0 111.125 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -162.16 101.28 1.1 Allowed 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.91 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 53.7 t -120.75 121.16 37.62 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-O 120.926 0.394 . . . . 0.0 109.952 177.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.501 ' HB2' HG21 ' A' ' 11' ' ' THR . 82.9 mt-30 -129.63 19.22 5.68 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.104 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.542 ' O ' ' HB2' ' A' ' 62' ' ' SER . 70.8 m -64.93 134.11 53.26 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 178.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.97 -91.42 0.37 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.822 -177.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -139.25 159.53 41.94 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 84.11 26.07 42.1 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 110.761 -0.936 . . . . 0.0 110.761 -177.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.8 t -124.08 132.85 53.71 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.207 -0.497 . . . . 0.0 110.263 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.2 t -165.55 71.87 0.16 Allowed 'General case' 0 N--CA 1.44 -0.961 0 CA-C-O 121.492 0.663 . . . . 0.0 111.171 178.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.42 ' SG ' ' HB3' ' A' ' 35' ' ' ALA . 10.4 p -101.23 8.82 42.37 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 121.241 0.543 . . . . 0.0 110.318 178.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . 69.4 -16.87 0.24 Allowed 'General case' 0 N--CA 1.479 0.998 0 CA-C-N 114.797 -1.092 . . . . 0.0 113.43 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.42 ' HB3' ' SG ' ' A' ' 33' ' ' CYS . . . -76.78 -54.07 7.1 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -178.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.441 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 26.9 p -92.74 -25.2 18.3 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.885 0.374 . . . . 0.0 110.925 -179.499 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -49.09 113.17 0.74 Allowed 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.424 -178.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.5 t -124.68 165.12 18.48 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.448 -178.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.7 t -162.58 139.47 7.84 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.9 m-80 -98.8 -10.05 23.55 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.725 0.297 . . . . 0.0 111.478 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 70.8 m -74.33 139.41 44.14 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 110.064 -0.347 . . . . 0.0 110.064 177.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 76.8 p -112.07 -174.09 2.39 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.578 -176.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.1 m -70.5 3.73 2.84 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.127 178.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -58.63 -36.71 74.51 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.148 0.499 . . . . 0.0 109.71 176.007 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 132.04 40.61 0.21 Allowed Glycine 0 N--CA 1.445 -0.721 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.257 178.516 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 43.2 t 71.47 148.01 0.08 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.98 0.512 . . . . 0.0 111.37 -178.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 42.9 mtmt -126.59 -16.36 5.32 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.852 -0.339 . . . . 0.0 111.887 -179.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.5 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 14.4 p -95.45 -36.06 11.47 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.464 -0.494 . . . . 0.0 111.503 -177.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.31 -3.86 20.18 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.215 -0.993 . . . . 0.0 112.908 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.482 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 76.0 mmtt -82.67 -4.5 57.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.911 0.386 . . . . 0.0 110.042 178.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 67.08 67.91 0.41 Allowed 'General case' 0 C--O 1.233 0.221 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.298 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 4.4 p -139.34 154.76 47.94 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.265 178.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.3 p -139.59 81.47 1.83 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.819 0.342 . . . . 0.0 111.18 -179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 98.58 160.46 29.97 Favored Glycine 0 C--N 1.315 -0.637 0 C-N-CA 120.548 -0.834 . . . . 0.0 112.03 178.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.5 Cg_endo -56.98 -36.79 99.41 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.047 2.498 . . . . 0.0 112.655 -178.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 22.8 m-20 -75.45 -11.5 60.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.198 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.6 m -129.05 25.93 5.52 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.121 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.488 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 47.1 t -103.34 150.91 23.33 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.857 -0.611 . . . . 0.0 110.423 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 52.1 tttp -121.15 -9.22 9.18 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-O 121.886 0.85 . . . . 0.0 108.726 178.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.9 m -86.32 144.17 27.51 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 114.645 -1.161 . . . . 0.0 111.511 -174.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -80.97 176.86 54.57 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 111.195 -0.762 . . . . 0.0 111.195 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.542 ' HB2' ' O ' ' A' ' 27' ' ' CYS . 18.2 m -66.4 -7.14 17.3 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 117.016 0.408 . . . . 0.0 111.778 -178.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 24.3 m -100.56 35.98 2.01 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.333 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 22.7 t -112.53 174.27 5.97 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 120.761 0.315 . . . . 0.0 111.081 179.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 13.0 m -71.43 -25.19 62.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.69 -178.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.5 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 32.1 p -87.02 16.91 4.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.822 0.344 . . . . 0.0 111.043 -179.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.488 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 53.8 mmtt . . . . . 0 C--O 1.257 1.452 0 CA-C-O 117.525 -1.226 . . . . 0.0 110.763 -179.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.243 0 N-CA-C 112.042 -0.423 . . . . 0.0 112.042 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 70.4 m -105.03 102.35 11.85 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 120.991 0.424 . . . . 0.0 110.624 179.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 83.16 -12.28 50.95 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.023 -0.608 . . . . 0.0 113.035 178.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -92.02 117.66 30.04 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 122.662 -0.316 . . . . 0.0 111.224 -179.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -108.7 -135.23 7.39 Favored Glycine 0 N--CA 1.442 -0.96 0 N-CA-C 110.734 -0.947 . . . . 0.0 110.734 177.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 92.0 mttt 62.34 90.7 0.07 Allowed 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 122.861 0.464 . . . . 0.0 111.442 178.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -91.55 60.32 2.89 Favored Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 121.197 -0.525 . . . . 0.0 112.623 -179.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 69.52 -65.83 0.29 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.767 0.827 . . . . 0.0 111.904 178.086 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 63.4 mttp -109.66 77.69 1.08 Allowed 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 121.52 0.676 . . . . 0.0 110.642 -177.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 94.3 m -117.6 156.32 28.33 Favored 'General case' 0 C--N 1.273 -2.751 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.198 177.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.607 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 82.2 p -83.46 175.1 10.06 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.054 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.2 m -76.91 -16.39 59.4 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 176.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.58 -42.91 40.87 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.558 178.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 50.0 t -69.37 -27.72 65.57 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.186 0.517 . . . . 0.0 110.223 178.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.607 ' HG3' ' O ' ' A' ' 11' ' ' THR . 37.6 mtt180 -85.46 1.86 47.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.392 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.7 t -94.33 161.68 14.14 Favored 'General case' 0 N--CA 1.442 -0.836 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.416 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 8.0 pt-20 -122.28 115.94 29.9 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-O 120.537 0.208 . . . . 0.0 110.646 179.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 3.8 Cg_exo -79.14 -178.09 22.74 Favored 'Cis proline' 0 C--N 1.351 0.664 0 C-N-CA 124.068 -1.222 . . . . 0.0 111.717 -0.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.7 t -58.81 123.43 16.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.017 0.436 . . . . 0.0 110.001 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 32.7 mm-40 -101.07 18.76 18.93 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.655 -176.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.422 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 72.7 m -83.33 9.4 11.0 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 -178.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.83 -36.95 93.96 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.507 -0.854 . . . . 0.0 111.224 178.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.7 m -97.85 -32.84 11.49 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 120.592 0.234 . . . . 0.0 111.324 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 24' ' ' LYS . 9.5 ptpp? -139.04 103.75 4.86 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.14 0.495 . . . . 0.0 111.673 -178.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 44.5 t -112.39 114.88 27.83 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-O 121.2 0.524 . . . . 0.0 109.801 176.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.417 ' H ' HG21 ' A' ' 11' ' ' THR . 97.5 mt-30 -127.39 22.97 6.44 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.461 -177.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 98.2 m -61.31 157.62 16.14 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.666 178.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.33 -101.92 1.29 Allowed Glycine 0 N--CA 1.437 -1.269 0 C-N-CA 120.587 -0.816 . . . . 0.0 115.115 -174.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.576 ' HG3' ' H ' ' A' ' 30' ' ' GLY . 5.4 pt-20 -105.71 -84.34 0.5 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 113.937 1.088 . . . . 0.0 113.937 -172.212 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.576 ' H ' ' HG3' ' A' ' 29' ' ' GLU . . . -83.99 66.76 3.84 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 121.003 -0.617 . . . . 0.0 113.909 -175.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.1 t -74.43 139.49 44.02 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 176.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.7 t -112.39 14.75 20.4 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 121.298 0.57 . . . . 0.0 110.93 -176.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 43.7 t -96.16 148.83 22.3 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.697 178.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -107.9 5.94 26.84 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.869 0.366 . . . . 0.0 110.815 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -84.86 -44.91 12.79 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.035 -179.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.422 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 6.0 p -101.47 -5.02 25.79 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.867 -178.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -81.85 115.63 21.15 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.868 0.366 . . . . 0.0 110.32 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.8 t -126.46 171.67 10.84 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.836 -179.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.402 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 48.0 t -155.95 148.5 23.85 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -179.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -109.65 -12.47 14.65 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 112.151 0.426 . . . . 0.0 112.151 -178.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 73.9 m -79.17 133.99 36.71 Favored 'General case' 0 N--CA 1.445 -0.691 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 175.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.8 p -100.34 176.31 5.41 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-O 120.838 0.351 . . . . 0.0 111.514 -175.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.585 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 50.2 m -74.33 6.56 3.52 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.259 0.552 . . . . 0.0 110.899 178.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -85.84 -30.02 23.28 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.519 176.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 161.2 151.5 6.27 Favored Glycine 0 N--CA 1.437 -1.285 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.74 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.3 t -72.38 143.38 48.6 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -121.63 -25.72 5.05 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -178.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.471 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 8.1 p -77.97 -34.68 50.85 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.923 -177.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.76 -0.49 27.43 Favored Glycine 0 CA--C 1.523 0.565 0 C-N-CA 120.535 -0.84 . . . . 0.0 113.023 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -90.2 0.08 57.36 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.917 0.358 . . . . 0.0 110.729 179.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 64.38 62.72 0.8 Allowed 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.966 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 10.9 p -134.43 154.97 51.11 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 115.828 -0.624 . . . . 0.0 109.412 176.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.585 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 19.3 p -137.7 51.13 1.92 Allowed 'General case' 0 C--N 1.308 -1.208 0 CA-C-O 121.396 0.617 . . . . 0.0 110.78 -178.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 128.12 164.9 11.7 Favored Glycine 0 N--CA 1.439 -1.114 0 C-N-CA 120.838 -0.696 . . . . 0.0 111.363 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.402 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 16.8 Cg_endo -57.77 -20.85 45.17 Favored 'Trans proline' 0 CA--C 1.534 0.5 0 C-N-CA 122.968 2.445 . . . . 0.0 113.632 -178.022 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -74.42 -41.85 60.18 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.902 0.382 . . . . 0.0 111.168 -179.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.7 p -98.29 1.08 46.79 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.173 0.511 . . . . 0.0 111.104 -178.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 43.4 t -86.03 129.9 34.7 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.943 -179.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp -117.96 7.18 12.25 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.799 178.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 5.6 m -75.14 154.7 37.62 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.813 -178.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -84.07 -156.05 22.88 Favored Glycine 0 N--CA 1.441 -1.0 0 C-N-CA 120.81 -0.709 . . . . 0.0 111.838 178.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 37.4 p -86.89 -8.81 56.92 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 120.745 0.307 . . . . 0.0 111.704 -178.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.7 m -115.37 60.34 0.7 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.133 0.492 . . . . 0.0 111.533 -177.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . 0.443 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 39.6 t -126.19 167.65 15.14 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.815 177.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 31.8 t -61.76 -32.77 73.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.824 -0.626 . . . . 0.0 111.388 -178.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.471 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 27.3 p -88.56 22.27 2.64 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 120.799 0.333 . . . . 0.0 111.404 -178.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.443 ' HG2' ' HB3' ' A' ' 64' ' ' CYS . 52.4 mmtt . . . . . 0 C--O 1.257 1.493 0 CA-C-O 117.458 -1.258 . . . . 0.0 110.778 178.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.472 0 N-CA-C 112.089 -0.404 . . . . 0.0 112.089 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.7 m -116.1 25.35 10.74 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.393 0.615 . . . . 0.0 109.693 179.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 135.54 155.72 7.37 Favored Glycine 0 N--CA 1.44 -1.086 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.21 -178.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -107.93 99.76 9.18 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-O 121.004 0.43 . . . . 0.0 110.944 -179.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.406 ' O ' ' HB2' ' A' ' 6' ' ' LYS . . . -90.91 -14.89 57.29 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 111.406 -0.678 . . . . 0.0 111.406 179.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.411 ' NZ ' ' SG ' ' A' ' 14' ' ' CYS . 31.6 mtmt 74.04 -71.57 0.13 Allowed 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.586 0.754 . . . . 0.0 112.287 178.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -153.71 168.08 32.18 Favored Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.375 -0.917 . . . . 0.0 112.527 -179.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -78.44 -21.07 49.69 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.099 0.476 . . . . 0.0 110.173 179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.486 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 5.9 tmtt? -74.24 -17.49 60.87 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.734 177.133 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.485 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 62.8 m -65.39 147.31 53.65 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.676 178.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.594 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 68.4 p -88.86 171.07 10.19 Favored 'General case' 0 C--N 1.298 -1.669 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.851 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.0 m -67.21 -26.87 66.82 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 121.393 0.616 . . . . 0.0 109.604 176.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.421 ' HB3' ' SG ' ' A' ' 21' ' ' CYS . . . -69.82 -40.2 76.05 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.352 -179.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.411 ' SG ' ' NZ ' ' A' ' 6' ' ' LYS . 50.4 t -74.36 -20.63 60.02 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.361 0.601 . . . . 0.0 110.518 179.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.594 ' HG3' ' O ' ' A' ' 11' ' ' THR . 62.4 mtt180 -84.29 0.92 47.21 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.206 0.526 . . . . 0.0 109.948 178.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.2 m -102.78 159.06 15.81 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.493 178.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -128.8 124.38 22.51 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-O 120.7 0.286 . . . . 0.0 111.317 -179.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -72.22 -178.65 21.11 Favored 'Cis proline' 0 C--N 1.351 0.679 0 C-N-CA 123.283 -1.549 . . . . 0.0 111.618 -1.04 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 7.9 t -61.72 135.31 57.56 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-O 120.887 0.375 . . . . 0.0 110.697 -178.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.3 mm-40 -112.08 16.96 19.99 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.802 -177.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.439 ' HB3' ' HB2' ' A' ' 25' ' ' CYS . 93.2 m -86.51 26.08 1.13 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -177.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.46 -42.99 99.23 Favored Glycine 0 CA--C 1.52 0.392 0 C-N-CA 120.527 -0.844 . . . . 0.0 111.602 178.264 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 5.5 p -139.39 20.04 2.57 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.308 0.575 . . . . 0.0 110.321 178.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 57.3 mttm -131.67 31.13 4.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.815 -177.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.439 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 18.1 t -91.82 145.63 24.41 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 113.076 0.769 . . . . 0.0 113.076 -174.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -156.81 16.72 0.3 Allowed 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.192 178.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.486 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 99.6 m -64.99 164.15 13.28 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -176.322 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -146.3 -145.0 4.16 Favored Glycine 0 N--CA 1.446 -0.637 0 CA-C-N 114.965 -1.016 . . . . 0.0 111.346 -179.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -68.02 154.14 42.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.12 0.46 . . . . 0.0 110.324 177.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.55 -33.8 5.6 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 -174.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 24.0 t -74.24 147.78 42.13 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 109.303 -0.628 . . . . 0.0 109.303 176.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.6 t -145.12 27.19 1.29 Allowed 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 121.5 0.667 . . . . 0.0 109.762 -178.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 47.6 t -94.86 119.47 33.48 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.26 -176.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -71.24 -7.72 48.8 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.709 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.18 -27.46 60.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.663 -0.244 . . . . 0.0 111.456 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 10.1 p -134.64 11.47 3.72 Favored 'General case' 0 CA--C 1.537 0.481 0 N-CA-C 112.33 0.492 . . . . 0.0 112.33 -177.392 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.0 mmtp -91.09 138.71 31.39 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -135.83 133.32 37.7 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 120.738 -0.385 . . . . 0.0 110.97 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 27.3 t -150.88 145.51 25.7 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.198 179.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 21.1 m-80 -101.63 -19.75 15.31 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 121.018 -0.273 . . . . 0.0 111.732 179.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 74.0 m -74.39 133.3 42.48 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.8 p -109.89 -173.77 2.33 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.048 -175.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.4 m -69.66 -14.69 62.94 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.438 179.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.68 -40.06 95.9 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.916 177.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 164.07 155.2 8.17 Favored Glycine 0 N--CA 1.43 -1.759 0 C-N-CA 120.643 -0.789 . . . . 0.0 112.42 179.477 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 47.0 t -77.49 130.43 36.98 Favored 'General case' 0 C--N 1.313 -0.988 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 178.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -105.68 -26.52 11.78 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.552 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 8.3 p -78.89 -40.99 30.8 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.47 -0.492 . . . . 0.0 110.744 -177.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.91 12.82 10.79 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.679 -0.772 . . . . 0.0 113.045 178.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.476 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 74.8 mmtt -95.67 3.75 53.66 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.989 0.394 . . . . 0.0 110.549 178.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 51' ' ' GLU . 34.0 tt0 66.12 29.64 9.78 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.929 178.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.5 p -102.19 150.99 22.73 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.951 -0.568 . . . . 0.0 109.564 178.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 11.8 p -141.11 66.05 1.38 Allowed 'General case' 0 C--N 1.306 -1.319 0 CA-C-O 121.425 0.631 . . . . 0.0 110.255 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 121.24 154.52 9.27 Favored Glycine 0 N--CA 1.442 -0.939 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.563 179.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -53.65 -31.66 61.21 Favored 'Trans proline' 0 N--CA 1.48 0.728 0 C-N-CA 124.146 3.231 . . . . 0.0 115.039 -176.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -69.13 -41.89 76.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 120.866 0.365 . . . . 0.0 111.191 -178.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.6 m -96.69 0.02 49.03 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.804 -177.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.462 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 14.9 t -92.24 126.15 37.2 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.082 -179.255 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 64.2 mttp -119.41 14.23 12.82 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.557 177.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 20.7 m -69.61 150.23 47.28 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.261 -0.882 . . . . 0.0 110.36 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -69.59 164.88 50.68 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.389 -179.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.8 p -72.93 -3.3 25.0 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.202 0.525 . . . . 0.0 111.606 -178.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.2 t -111.94 13.01 20.81 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.294 0.568 . . . . 0.0 109.78 178.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 65' ' ' SER . 47.1 t -73.85 169.72 16.81 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.828 -177.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.401 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 8.6 m -63.89 -34.49 78.08 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.789 -178.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.552 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 21.6 p -87.43 25.11 1.48 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.713 0.292 . . . . 0.0 111.324 -178.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.462 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 61.1 mmtt . . . . . 0 C--O 1.271 2.195 0 CA-C-O 118.087 -0.959 . . . . 0.0 110.866 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.19 0 CA-C-O 120.894 0.163 . . . . 0.0 112.811 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.6 p -78.34 119.83 22.23 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.907 0.384 . . . . 0.0 111.107 -179.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 122.13 4.47 9.28 Favored Glycine 0 N--CA 1.442 -0.933 0 C-N-CA 120.216 -0.992 . . . . 0.0 112.678 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -79.03 104.18 9.48 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 177.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 126.42 132.85 3.76 Favored Glycine 0 N--CA 1.436 -1.359 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.034 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.84 -23.03 20.68 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 120.801 0.334 . . . . 0.0 110.242 178.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.901 ' HA2' ' SG ' ' A' ' 10' ' ' CYS . . . -94.75 85.45 0.99 Allowed Glycine 0 N--CA 1.441 -0.983 0 C-N-CA 120.943 -0.646 . . . . 0.0 114.032 -175.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -86.29 -46.83 9.95 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 176.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -138.49 24.65 2.67 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.748 177.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.901 ' SG ' ' HA2' ' A' ' 7' ' ' GLY . 35.7 m -73.75 166.07 23.97 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.466 -176.36 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.55 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 72.5 p -90.61 173.32 8.11 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.231 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.1 m -71.81 -20.44 61.84 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 120.956 0.408 . . . . 0.0 109.997 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.89 -38.67 37.01 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.829 179.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.7 t -67.07 -20.72 65.87 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.225 0.536 . . . . 0.0 110.04 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.55 ' HG2' ' O ' ' A' ' 11' ' ' THR . 27.9 mmt180 -67.36 -25.94 66.22 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.048 177.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.2 m -85.75 147.08 26.5 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.035 -179.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.542 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 10.2 pt-20 -132.15 126.91 20.75 Favored Pre-proline 0 C--N 1.32 -0.699 0 CA-C-O 120.678 0.275 . . . . 0.0 111.052 -179.619 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.542 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 30.6 Cg_endo -63.25 160.53 60.41 Favored 'Cis proline' 0 C--O 1.241 0.662 0 C-N-CA 123.27 -1.554 . . . . 0.0 112.302 -0.694 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 32.3 t -52.96 149.15 6.78 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.888 0.743 . . . . 0.0 112.167 -176.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 16.3 mm-40 -122.7 14.18 10.09 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -176.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 63.8 m -61.31 -67.97 0.36 Allowed 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.027 178.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 60.04 -96.34 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 121.084 -0.579 . . . . 0.0 112.31 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 42.3 t -91.35 -29.24 17.22 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.747 0.308 . . . . 0.0 110.698 179.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -103.18 73.86 1.25 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -177.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 42.4 t -103.02 136.42 42.88 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 174.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.432 ' HB2' HG22 ' A' ' 11' ' ' THR . 53.1 mt-30 -142.93 22.49 1.93 Allowed 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.507 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 91.3 m -69.48 143.52 53.48 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.605 -178.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.98 -171.27 47.16 Favored Glycine 0 N--CA 1.433 -1.557 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 176.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -63.75 -21.79 66.58 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.092 0.473 . . . . 0.0 110.633 178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.68 63.27 4.48 Favored Glycine 0 N--CA 1.444 -0.786 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.301 178.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 50.4 t -133.02 128.64 36.77 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 178.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.8 t -106.35 9.27 31.91 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 121.082 0.468 . . . . 0.0 110.61 -179.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 36.9 t -91.64 129.17 37.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.129 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -96.91 7.06 47.46 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 120.961 0.41 . . . . 0.0 111.132 -179.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -82.46 -37.62 25.13 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.135 0.493 . . . . 0.0 111.006 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 9.9 p -103.04 -41.43 6.11 Favored 'General case' 0 C--N 1.309 -1.169 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.989 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.5 ttpt -69.38 103.16 1.93 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.161 0.505 . . . . 0.0 110.535 -179.045 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.8 t -106.15 169.01 8.75 Favored 'General case' 0 N--CA 1.436 -1.142 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.375 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.9 t -149.91 145.0 26.26 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -178.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -99.43 -24.16 14.88 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -179.34 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.2 m -66.41 140.21 58.04 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 75.0 p -113.66 177.64 4.56 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 120.88 0.371 . . . . 0.0 111.507 -175.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.528 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 17.6 m -70.32 -9.66 56.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.869 179.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -69.44 -40.71 77.03 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 176.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 170.28 149.27 6.3 Favored Glycine 0 N--CA 1.44 -1.073 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.885 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.1 t -69.95 146.64 51.01 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 178.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -115.34 -38.71 3.74 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.66 -177.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.544 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 11.7 p -75.37 -35.47 61.1 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.359 -176.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.8 -0.15 30.41 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.601 -0.809 . . . . 0.0 113.014 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.435 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.1 mmtt -82.8 0.23 44.8 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.863 0.363 . . . . 0.0 110.393 179.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 67.34 50.32 0.97 Allowed 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.705 178.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 17.7 p -124.74 152.85 43.27 Favored 'General case' 0 C--N 1.309 -1.191 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.238 177.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.528 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 23.7 p -134.03 38.34 3.18 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-O 121.199 0.523 . . . . 0.0 110.966 -178.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 142.78 161.95 9.04 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -177.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -50.04 -42.92 44.31 Favored 'Trans proline' 0 N--CA 1.481 0.739 0 C-N-CA 123.411 2.741 . . . . 0.0 113.918 -177.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -65.4 -38.29 89.52 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.911 0.386 . . . . 0.0 111.5 -178.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 46.6 t -92.64 8.95 36.85 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.96 0.409 . . . . 0.0 110.126 -179.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 50.3 t -100.4 136.19 40.66 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.764 -178.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -126.43 16.71 7.66 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.653 0.74 . . . . 0.0 109.376 178.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.435 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 11.8 m -83.26 149.54 26.72 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.072 -178.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -83.12 -155.69 19.64 Favored Glycine 0 N--CA 1.443 -0.882 0 N-CA-C 111.201 -0.76 . . . . 0.0 111.201 176.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 28.6 m -78.64 -33.5 47.19 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 120.849 0.357 . . . . 0.0 111.139 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.1 m -83.75 67.85 9.67 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.991 -177.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 11.2 t -142.45 161.99 36.62 Favored 'General case' 0 N--CA 1.439 -0.986 0 CA-C-O 120.933 0.397 . . . . 0.0 111.028 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 5.9 m -68.17 -33.25 74.11 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.998 -177.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.544 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 16.0 p -84.18 11.42 8.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.696 0.284 . . . . 0.0 111.443 -177.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm . . . . . 0 C--O 1.259 1.587 0 CA-C-O 117.246 -1.359 . . . . 0.0 111.341 -179.296 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.413 0 N-CA-C 112.303 -0.319 . . . . 0.0 112.303 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.3 t 62.79 83.83 0.15 Allowed 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 121.234 0.54 . . . . 0.0 110.751 -178.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -79.03 79.31 1.61 Allowed Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.985 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.3 mtmt -96.25 136.2 37.05 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.806 0.336 . . . . 0.0 110.584 -179.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 126.11 -130.63 7.18 Favored Glycine 0 N--CA 1.438 -1.221 0 C-N-CA 120.701 -0.762 . . . . 0.0 111.673 -179.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.414 ' HD2' ' HA ' ' A' ' 6' ' ' LYS . 11.6 tptm -151.48 153.65 35.03 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 109.531 -0.544 . . . . 0.0 109.531 179.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -105.05 164.21 14.31 Favored Glycine 0 N--CA 1.442 -0.911 0 C-N-CA 120.355 -0.926 . . . . 0.0 112.389 -178.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -85.0 -9.78 57.69 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.196 0.522 . . . . 0.0 110.351 178.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -81.8 -7.69 59.62 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.347 177.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.406 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 86.7 m -70.68 165.88 21.98 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.427 178.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.569 HG21 ' H ' ' A' ' 26' ' ' GLN . 55.2 p -100.96 174.32 6.07 Favored 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.372 -179.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.1 m -74.87 -20.2 59.84 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 176.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.49 ' HB1' ' C ' ' A' ' 20' ' ' GLN . . . -74.72 -33.04 62.31 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.374 178.262 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.519 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 42.7 t -74.38 -12.38 60.5 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 121.596 0.712 . . . . 0.0 109.325 177.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.0 mmt180 -86.15 -1.0 57.02 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.953 176.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.3 m -96.54 154.4 17.3 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 120.847 0.356 . . . . 0.0 111.1 -178.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -136.26 112.46 10.21 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.755 178.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -66.82 165.28 66.54 Favored 'Cis proline' 0 C--N 1.356 0.927 0 C-N-CA 123.607 -1.414 . . . . 0.0 112.417 -0.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.519 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 5.1 t -57.81 151.84 16.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.494 -176.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.49 ' C ' ' HB1' ' A' ' 13' ' ' ALA . 27.8 mm-40 -129.52 17.51 5.88 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -174.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 78.0 m -66.74 -76.6 0.08 Allowed 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -178.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 57.47 -114.36 5.46 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 121.036 -0.602 . . . . 0.0 112.66 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.4 p -76.53 -17.99 58.95 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 120.84 0.352 . . . . 0.0 111.351 -178.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -101.13 20.87 14.84 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.348 -177.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.0 t -72.93 119.24 16.89 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-O 121.442 0.639 . . . . 0.0 111.122 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.569 ' H ' HG21 ' A' ' 11' ' ' THR . 76.4 mt-30 -121.42 6.75 10.1 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.833 179.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.406 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 93.8 m -55.87 117.52 3.76 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.368 -178.185 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -87.76 -170.52 46.27 Favored Glycine 0 N--CA 1.44 -1.088 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.009 -179.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -63.84 115.01 4.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.411 0.624 . . . . 0.0 110.349 179.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 143.16 -14.1 2.33 Favored Glycine 0 N--CA 1.442 -0.937 0 N-CA-C 110.934 -0.866 . . . . 0.0 110.934 -177.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.3 t -75.27 151.39 38.37 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 177.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.6 t -136.72 15.7 3.12 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 121.537 0.685 . . . . 0.0 109.921 -178.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.5 t -93.28 122.97 36.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.269 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -84.67 5.98 25.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -177.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.99 -34.62 32.85 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.141 0.496 . . . . 0.0 110.781 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 2.6 p -108.72 -33.2 7.06 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.197 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -63.2 110.5 1.88 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.656 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.3 t -111.29 170.0 8.41 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.518 -179.346 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 41.7 t -157.06 149.23 22.92 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -116.5 -7.67 11.63 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 72.4 m -81.64 132.15 35.29 Favored 'General case' 0 N--CA 1.441 -0.899 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 175.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 32.7 p -112.98 177.84 4.49 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-O 120.622 0.248 . . . . 0.0 111.596 -174.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.4 p -60.09 -16.99 36.53 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.386 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -57.59 -37.77 73.77 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 176.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 154.85 152.66 6.21 Favored Glycine 0 N--CA 1.43 -1.766 0 N-CA-C 110.534 -1.027 . . . . 0.0 110.534 -179.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 43.3 t -67.87 144.89 55.08 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 179.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -117.35 -21.48 8.68 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 -178.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.572 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 12.2 p -89.76 -32.42 16.97 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.13 -177.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.8 -5.31 14.17 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.469 -0.872 . . . . 0.0 113.252 178.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.681 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 67.2 mmtt -79.99 -5.23 55.34 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.932 0.366 . . . . 0.0 111.05 -179.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 68.6 23.89 7.08 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.775 -178.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 25.5 p -93.18 151.29 19.92 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.266 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 45.3 p -139.46 81.85 1.85 Allowed 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.078 177.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.23 153.48 15.28 Favored Glycine 0 C--O 1.223 -0.539 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.03 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -53.43 -40.75 77.33 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 123.324 2.683 . . . . 0.0 113.755 -177.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -73.24 -23.13 60.31 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.017 0.437 . . . . 0.0 111.501 -178.406 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 47.1 t -105.0 12.11 32.66 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.222 0.534 . . . . 0.0 109.974 179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.424 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 37.1 t -101.63 150.72 22.81 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.713 -177.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -110.43 -27.54 8.97 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.166 0.508 . . . . 0.0 109.818 176.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.681 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.0 OUTLIER -63.4 126.7 28.34 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.746 -178.504 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -86.95 -60.61 1.66 Allowed Glycine 0 N--CA 1.442 -0.943 0 C-N-CA 120.683 -0.77 . . . . 0.0 111.917 -179.299 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.7 t -157.12 171.35 20.6 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.8 m 64.85 23.77 12.69 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.446 0.698 . . . . 0.0 111.969 178.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . 0.433 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 46.3 t -106.58 169.76 8.34 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 120.884 -0.327 . . . . 0.0 110.798 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.402 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 36.2 m -71.36 -22.14 61.94 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.075 -178.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.572 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 18.4 p -93.68 18.29 10.41 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.867 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.433 ' HG2' ' HB3' ' A' ' 64' ' ' CYS . 63.2 mmtt . . . . . 0 C--O 1.261 1.708 0 CA-C-O 117.478 -1.249 . . . . 0.0 110.051 179.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.475 ' N ' ' HB2' ' A' ' 4' ' ' LYS . . . . . . . . 0 N--CA 1.487 2.04 0 N-CA-C 112.423 -0.271 . . . . 0.0 112.423 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.6 t -83.23 91.73 7.33 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 120.757 0.313 . . . . 0.0 110.428 -179.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 59.37 36.47 89.18 Favored Glycine 0 C--N 1.337 0.594 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.215 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.478 ' HB3' ' O ' ' A' ' 6' ' ' LYS . 45.0 mmtm -108.82 116.09 31.33 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -176.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -91.32 -3.91 69.0 Favored Glycine 0 N--CA 1.449 -0.46 0 N-CA-C 109.604 -1.399 . . . . 0.0 109.604 174.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.497 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 9.0 ptpp? -138.17 178.71 6.92 Favored 'General case' 0 N--CA 1.442 -0.864 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.054 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -154.27 -169.96 19.64 Favored Glycine 0 N--CA 1.44 -1.054 0 C-N-CA 119.722 -1.227 . . . . 0.0 112.553 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -74.86 -11.06 60.05 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.22 0.533 . . . . 0.0 110.343 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.573 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 88.4 mttt -86.3 0.39 53.98 Favored 'General case' 0 N--CA 1.444 -0.726 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.327 178.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.564 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 89.8 m -77.65 153.81 32.78 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 176.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.447 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 46.9 p -91.72 168.06 11.74 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 116.18 -0.464 . . . . 0.0 109.799 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.0 m -67.91 -20.8 65.13 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.189 0.518 . . . . 0.0 109.768 177.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.49 -38.55 59.46 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.735 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.483 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 52.9 t -70.82 -22.46 62.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.371 0.605 . . . . 0.0 110.016 178.525 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.447 ' HG3' ' O ' ' A' ' 11' ' ' THR . 40.2 mtp180 -89.74 20.29 4.17 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.983 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.5 m -113.47 171.56 7.49 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.99 -0.55 . . . . 0.0 109.564 178.034 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.423 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 13.4 pt-20 -129.83 112.89 17.54 Favored Pre-proline 0 CA--C 1.54 0.56 0 CA-C-O 120.675 0.274 . . . . 0.0 110.958 -179.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.423 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 6.1 Cg_exo -79.27 -172.8 11.72 Favored 'Cis proline' 0 C--N 1.348 0.535 0 C-N-CA 123.89 -1.296 . . . . 0.0 111.598 -0.211 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.7 t -61.15 137.36 58.24 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.763 0.316 . . . . 0.0 110.158 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -121.35 26.78 8.69 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.429 -175.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.483 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 77.6 m -88.34 17.71 5.02 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.746 0.308 . . . . 0.0 111.622 -178.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.38 107.1 1.33 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 121.296 -0.478 . . . . 0.0 113.145 -178.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.6 m 64.36 18.54 11.37 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.083 0.553 . . . . 0.0 111.768 178.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.3 tttt -146.01 29.51 1.09 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.822 0.82 . . . . 0.0 108.811 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 34.1 t -84.98 149.5 25.56 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 115.495 -0.775 . . . . 0.0 112.362 -175.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.1 mm-40 -146.41 14.84 1.27 Allowed 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.339 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.573 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 60.0 m -66.44 136.37 55.62 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-O 121.247 0.546 . . . . 0.0 112.153 -178.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -106.21 -151.44 19.13 Favored Glycine 0 N--CA 1.44 -1.083 0 CA-C-N 115.195 -0.911 . . . . 0.0 112.1 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.481 ' HG2' ' HD2' ' A' ' 9' ' ' LYS . 13.6 pt-20 -65.05 155.12 35.77 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.952 0.406 . . . . 0.0 110.314 178.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 100.76 -35.46 4.83 Favored Glycine 0 N--CA 1.444 -0.811 0 N-CA-C 110.779 -0.929 . . . . 0.0 110.779 -177.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 20.8 t -80.96 128.93 34.24 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 121.059 0.457 . . . . 0.0 110.301 178.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.45 ' HA ' ' NZ ' ' A' ' 37' ' ' LYS . 6.4 t -123.56 18.45 9.62 Favored 'General case' 0 N--CA 1.43 -1.441 0 CA-C-O 121.407 0.622 . . . . 0.0 110.101 177.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 52.7 t -63.85 123.95 20.26 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.568 179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.19 -10.46 59.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.991 -177.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.2 -41.47 61.36 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -178.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.6 p -111.37 -13.48 13.9 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -177.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.45 ' NZ ' ' HA ' ' A' ' 32' ' ' THR . 39.5 ttmt -77.89 108.43 11.13 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.576 177.301 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.9 t -124.91 162.45 24.39 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.172 -0.467 . . . . 0.0 109.78 178.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.5 t -143.11 156.71 44.86 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-O 120.678 0.275 . . . . 0.0 110.677 -178.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -107.59 -21.04 13.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.79 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 77.0 m -78.91 136.73 37.36 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 175.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.5 p -119.46 -177.12 3.29 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 -175.064 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.7 p -62.4 -12.48 21.84 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.76 -178.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -67.18 -29.46 69.15 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.206 0.527 . . . . 0.0 109.892 176.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 148.74 157.6 7.64 Favored Glycine 0 N--CA 1.44 -1.087 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.861 179.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 53.3 t -72.73 134.91 45.22 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -121.33 -3.17 9.46 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.599 -177.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 1.2 p -99.02 -37.74 9.24 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.146 179.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.82 19.12 5.38 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.696 -0.764 . . . . 0.0 113.037 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -113.61 8.25 17.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 117.035 0.418 . . . . 0.0 111.124 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 64.61 17.42 10.89 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.689 178.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 17.3 p -89.89 153.35 20.7 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.283 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.9 p -139.17 40.3 2.1 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.95 0.405 . . . . 0.0 110.724 -179.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.42 163.88 10.02 Favored Glycine 0 N--CA 1.439 -1.155 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.409 -178.497 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -58.3 -28.94 86.36 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.108 2.539 . . . . 0.0 113.918 -176.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -74.3 -36.78 63.76 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.858 0.361 . . . . 0.0 111.019 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 34.2 p -93.96 -10.6 33.16 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.091 0.472 . . . . 0.0 111.03 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 45.6 t -69.63 133.48 47.63 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.664 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 59' ' ' LYS . 37.5 ttmt -112.71 -7.2 13.83 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.843 -179.751 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.551 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 9.0 m -64.33 124.79 22.64 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.315 -177.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.25 50.07 3.57 Favored Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.486 -179.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 57.6 m 66.34 -177.31 0.19 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.102 0.561 . . . . 0.0 111.127 -179.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 11.3 m 66.19 6.85 4.43 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.36 0.6 . . . . 0.0 111.048 -178.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 42.7 t -100.09 167.5 10.43 Favored 'General case' 0 N--CA 1.443 -0.803 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.064 -179.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.2 p -65.97 -30.18 70.69 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -176.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 22.0 p -94.36 -4.49 48.44 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.77 0.319 . . . . 0.0 111.454 -177.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.551 ' HE3' ' O ' ' A' ' 60' ' ' CYS . 1.8 mmmp? . . . . . 0 C--O 1.27 2.162 0 CA-C-O 118.016 -0.992 . . . . 0.0 111.342 -178.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.508 0 N-CA-C 112.324 -0.31 . . . . 0.0 112.324 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.5 m -159.6 109.38 1.88 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 142.69 -57.39 0.56 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.161 -1.019 . . . . 0.0 112.767 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -63.42 -51.62 64.99 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.943 0.401 . . . . 0.0 111.519 -178.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 179.18 49.09 0.08 OUTLIER Glycine 0 CA--C 1.491 -1.417 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 -179.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.455 ' NZ ' ' SG ' ' A' ' 14' ' ' CYS . 40.3 tptt -138.69 114.9 10.29 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 121.029 -0.268 . . . . 0.0 110.808 -174.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 149.38 -58.92 0.45 Allowed Glycine 0 N--CA 1.441 -1.004 0 C-N-CA 119.846 -1.169 . . . . 0.0 114.156 177.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -87.31 -33.43 19.22 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -174.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 12.1 mptt -84.97 -13.97 49.0 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.314 178.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.1 m -83.49 168.73 16.2 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-O 121.841 0.829 . . . . 0.0 112.034 -177.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.458 HG21 ' H ' ' A' ' 26' ' ' GLN . 59.9 p -100.19 168.68 9.65 Favored 'General case' 0 C--N 1.29 -1.984 0 CA-C-N 114.381 -1.282 . . . . 0.0 109.309 178.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.0 m -67.62 -17.55 64.65 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.349 0.595 . . . . 0.0 109.764 177.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.489 ' HB1' ' C ' ' A' ' 20' ' ' GLN . . . -79.57 -39.48 31.66 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.718 -178.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.455 ' SG ' ' NZ ' ' A' ' 6' ' ' LYS . 50.2 t -69.99 -25.48 63.63 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.183 0.516 . . . . 0.0 110.475 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 72.2 mtp180 -83.43 8.64 13.22 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.828 179.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.8 t -115.46 148.53 39.32 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 177.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.524 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 16.3 pt-20 -124.82 130.12 24.35 Favored Pre-proline 0 C--N 1.323 -0.551 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.984 179.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.524 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 15.2 Cg_exo -66.97 166.94 59.94 Favored 'Cis proline' 0 C--N 1.35 0.627 0 C-N-CA 123.095 -1.627 . . . . 0.0 111.92 -0.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.2 t -56.35 123.18 13.77 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.186 -178.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.489 ' C ' ' HB1' ' A' ' 13' ' ' ALA . 84.2 mm-40 -100.86 19.69 16.76 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.953 -175.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.404 ' HB3' ' HB2' ' A' ' 25' ' ' CYS . 56.3 m -85.35 8.15 19.82 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.68 -23.93 69.29 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.289 -0.957 . . . . 0.0 110.821 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.2 p -99.05 -56.33 2.46 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.218 -0.491 . . . . 0.0 110.228 178.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -121.99 113.85 20.14 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.966 -178.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.404 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 17.3 t -130.97 129.65 42.39 Favored 'General case' 0 N--CA 1.438 -1.055 0 CA-C-O 121.001 0.429 . . . . 0.0 110.235 176.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.458 ' H ' HG21 ' A' ' 11' ' ' THR . 8.4 tt0 -143.11 14.69 1.87 Allowed 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.308 -178.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 72.6 m -59.61 131.44 50.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.657 -177.04 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.25 -156.15 32.48 Favored Glycine 0 N--CA 1.441 -0.985 0 CA-C-N 115.077 -0.965 . . . . 0.0 113.952 -176.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -67.42 148.27 51.79 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.249 -0.476 . . . . 0.0 111.016 -179.012 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.9 -26.47 24.34 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.426 -178.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.42 ' SG ' ' NZ ' ' A' ' 6' ' ' LYS . 48.6 t -77.36 116.76 18.22 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-O 121.089 0.471 . . . . 0.0 109.845 179.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.8 t -115.35 17.6 16.44 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.017 -179.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 47.1 t -62.08 110.07 1.48 Allowed 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.467 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.51 -13.4 13.66 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -176.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.19 -53.19 15.31 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.445 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.9 p -102.75 -9.45 19.99 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -178.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.6 tptt -72.14 103.89 3.45 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.444 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 12.7 t -120.24 166.98 12.75 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.194 179.727 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.459 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 40.6 t -159.55 143.54 14.8 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.155 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -102.22 -15.7 16.55 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -179.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 76.5 m -77.93 136.37 38.0 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 175.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.1 p -115.08 -178.76 3.45 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -175.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.4 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 5.9 p -61.05 -15.15 29.13 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.101 -179.602 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -66.74 -33.67 76.15 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.209 0.528 . . . . 0.0 109.959 177.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 154.33 160.14 9.64 Favored Glycine 0 N--CA 1.435 -1.393 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.123 179.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 52.3 t -76.71 151.09 36.22 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -135.45 7.77 3.34 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 179.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.8 p -116.31 -19.61 10.1 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.855 179.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 101.25 14.91 29.36 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.683 -0.77 . . . . 0.0 113.494 178.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.622 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 42.1 mmtm -103.65 4.44 35.52 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 117.046 0.423 . . . . 0.0 111.25 179.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 62.26 21.49 12.52 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.244 178.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 14.4 p -95.35 146.7 24.19 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.376 -179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.4 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 47.4 p -133.05 38.91 3.33 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.244 0.545 . . . . 0.0 110.171 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.95 162.5 9.44 Favored Glycine 0 N--CA 1.436 -1.332 0 N-CA-C 110.963 -0.855 . . . . 0.0 110.963 -177.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.459 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 13.8 Cg_endo -56.66 -28.58 75.96 Favored 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.937 2.425 . . . . 0.0 112.713 -178.122 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -68.23 -35.61 78.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.724 -178.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.3 p -105.27 8.44 33.87 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.228 0.537 . . . . 0.0 110.841 -179.111 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 42.6 t -92.32 123.36 35.59 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.131 -176.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -90.42 -22.63 21.34 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.996 177.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.622 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.9 m -62.37 146.63 50.77 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.217 -177.598 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -105.49 -86.66 1.93 Allowed Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 110.954 -0.859 . . . . 0.0 110.954 177.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.1 m -130.16 171.75 12.52 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 178.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 37.8 m 64.61 33.81 10.4 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 177.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 35.3 t -119.73 160.38 22.66 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.68 0.276 . . . . 0.0 110.266 177.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.3 m -65.8 -23.03 66.61 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -178.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.508 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 8.9 p -95.01 13.42 25.12 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.293 179.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.508 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 47.2 mmtm . . . . . 0 C--O 1.259 1.56 0 CA-C-O 117.112 -1.423 . . . . 0.0 110.912 -179.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 112.382 -0.287 . . . . 0.0 112.382 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.4 p -155.46 19.43 0.41 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.057 0.456 . . . . 0.0 110.999 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -117.73 93.57 0.58 Allowed Glycine 0 N--CA 1.442 -0.916 0 C-N-CA 120.568 -0.825 . . . . 0.0 113.034 -177.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -117.35 57.41 0.8 Allowed 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 176.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -81.31 75.53 2.29 Favored Glycine 0 N--CA 1.442 -0.945 0 CA-C-N 115.669 -0.696 . . . . 0.0 113.098 -177.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -139.16 131.56 28.5 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 177.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.567 ' HA2' ' SG ' ' A' ' 10' ' ' CYS . . . 90.29 19.83 44.29 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.34 -0.933 . . . . 0.0 112.455 179.299 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -87.86 -27.79 22.0 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.036 0.446 . . . . 0.0 110.398 179.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -140.65 30.27 1.89 Allowed 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.023 -178.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.567 ' SG ' ' HA2' ' A' ' 7' ' ' GLY . 85.9 m -89.15 177.12 6.71 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-O 121.348 0.594 . . . . 0.0 111.663 -177.17 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.519 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 40.7 p -108.68 171.77 7.23 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.072 -179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.1 m -70.79 -26.9 63.53 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 176.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.47 -38.55 81.14 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.387 178.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 52.7 t -72.11 -34.6 68.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.244 178.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 11' ' ' THR . 70.3 mtp180 -65.87 -29.04 69.42 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.275 178.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 49.1 m -67.77 152.25 45.89 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.142 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -126.26 120.04 23.57 Favored Pre-proline 0 C--N 1.318 -0.77 0 CA-C-O 120.763 0.316 . . . . 0.0 111.048 -179.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -73.77 174.6 50.13 Favored 'Cis proline' 0 C--O 1.237 0.442 0 C-N-CA 123.426 -1.489 . . . . 0.0 112.141 0.27 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 35.0 t -55.5 136.22 50.08 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.092 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 84.9 mm-40 -111.98 17.6 19.54 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.289 0.566 . . . . 0.0 110.703 -178.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.459 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 93.3 m -81.85 29.54 0.39 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.333 -179.041 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.52 -45.72 95.29 Favored Glycine 0 N--CA 1.447 -0.575 0 N-CA-C 110.879 -0.888 . . . . 0.0 110.879 176.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 2.2 m -131.58 4.29 4.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.048 0.451 . . . . 0.0 110.098 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -118.61 31.14 6.82 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.24 -177.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.54 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 16.7 t -82.97 127.28 33.39 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.13 -0.628 . . . . 0.0 111.18 -178.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.456 ' H ' HG21 ' A' ' 11' ' ' THR . 84.4 mt-30 -142.77 18.83 1.99 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.181 -0.918 . . . . 0.0 108.904 -178.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 86.5 m -67.33 145.66 54.88 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.415 -176.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -96.62 -154.59 30.26 Favored Glycine 0 N--CA 1.438 -1.187 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.312 177.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -78.38 14.46 1.22 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.053 0.454 . . . . 0.0 111.263 179.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -110.21 34.62 5.31 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 121.102 -0.571 . . . . 0.0 111.865 -179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.5 t -130.92 148.68 52.71 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 121.045 0.45 . . . . 0.0 110.346 179.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.9 t -136.53 16.8 3.13 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.35 178.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.6 t -80.63 124.47 29.02 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.362 -178.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -81.18 9.11 7.34 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.439 -178.467 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -93.14 -13.08 28.91 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.976 0.417 . . . . 0.0 110.806 179.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.54 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 7.5 p -139.15 -27.78 0.8 Allowed 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 116.125 -0.488 . . . . 0.0 112.144 -178.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.433 ' HE3' ' O ' ' A' ' 60' ' ' CYS . 88.0 tttt -79.44 126.81 31.32 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 178.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.0 t -132.33 175.26 9.42 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.854 -177.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.406 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 40.6 t -158.92 148.26 18.85 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.346 -179.005 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -109.46 -12.35 14.72 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 179.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 80.7 m -81.07 133.63 35.51 Favored 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 177.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 75.4 p -113.73 176.6 4.96 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.412 -176.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.453 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 22.7 t -62.66 -18.71 62.85 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.905 -179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -64.86 -20.6 66.5 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.482 176.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.84 146.7 4.38 Favored Glycine 0 N--CA 1.439 -1.145 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.399 178.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 38.1 t -75.32 142.33 43.25 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 50.5 mtmt -120.41 -6.92 9.78 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -177.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 11.2 p -99.71 -38.09 8.84 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.833 -179.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.49 -0.98 16.11 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.67 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.631 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 73.4 mmtt -84.96 0.52 51.0 Favored 'General case' 0 C--O 1.239 0.551 0 O-C-N 122.625 -0.338 . . . . 0.0 110.852 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 63.92 35.39 10.9 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.268 178.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 24.1 p -107.85 155.48 20.21 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.901 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.453 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 50.1 p -140.75 50.18 1.67 Allowed 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 120.971 0.415 . . . . 0.0 110.676 179.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 133.87 154.05 7.21 Favored Glycine 0 C--O 1.225 -0.429 0 C-N-CA 120.449 -0.881 . . . . 0.0 112.368 -179.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.406 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 76.0 Cg_exo -50.25 -41.46 50.27 Favored 'Trans proline' 0 C--N 1.36 1.139 0 C-N-CA 123.687 2.925 . . . . 0.0 114.022 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -64.37 -34.86 79.13 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.779 0.323 . . . . 0.0 111.616 -177.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 41.7 m -107.06 21.94 16.77 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 121.314 0.578 . . . . 0.0 110.079 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.502 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 49.4 t -98.45 123.88 42.84 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.671 -178.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -91.55 -17.67 25.28 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.865 179.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.631 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.7 m -71.66 154.05 41.65 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.797 -178.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.491 ' O ' ' HE3' ' A' ' 67' ' ' LYS . . . -92.76 -106.84 1.71 Allowed Glycine 0 N--CA 1.443 -0.871 0 C-N-CA 120.682 -0.77 . . . . 0.0 111.962 178.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 66.5 p -124.62 -26.0 3.91 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 120.894 0.378 . . . . 0.0 111.198 -179.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.3 m -89.4 50.05 1.86 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.36 -177.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 34.8 t -125.19 168.06 13.97 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-O 120.963 0.411 . . . . 0.0 111.345 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.9 m -70.25 -28.5 65.29 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.792 -178.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 18.2 p -84.77 16.96 2.99 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.977 0.418 . . . . 0.0 111.122 -179.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.502 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 58.0 mmtt . . . . . 0 C--O 1.26 1.624 0 CA-C-O 117.585 -1.198 . . . . 0.0 110.691 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.221 0 N-CA-C 112.294 -0.322 . . . . 0.0 112.294 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.0 t -130.25 -170.74 2.38 Favored 'General case' 0 N--CA 1.443 -0.782 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 118.26 -42.12 1.88 Allowed Glycine 0 N--CA 1.444 -0.831 0 C-N-CA 121.0 -0.619 . . . . 0.0 111.656 -179.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -103.44 103.01 12.94 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.918 0.39 . . . . 0.0 110.177 178.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 159.78 179.85 34.86 Favored Glycine 0 N--CA 1.44 -1.091 0 C-N-CA 120.726 -0.75 . . . . 0.0 111.982 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.442 ' NZ ' ' SG ' ' A' ' 14' ' ' CYS . 61.9 mttm 70.99 142.64 0.05 Allowed 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.622 0.769 . . . . 0.0 112.149 -179.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -116.94 -146.13 8.32 Favored Glycine 0 N--CA 1.436 -1.323 0 CA-C-N 115.533 -0.758 . . . . 0.0 111.874 -179.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -95.34 3.14 54.73 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -79.92 -24.11 41.31 Favored 'General case' 0 CA--C 1.514 -0.435 0 C-N-CA 120.171 -0.612 . . . . 0.0 109.368 176.202 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.544 ' HA ' ' SG ' ' A' ' 27' ' ' CYS . 87.7 m -65.94 136.72 56.47 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.18 176.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.624 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 68.7 p -72.76 171.46 12.56 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.07 -178.051 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.8 m -70.18 -11.78 61.14 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-O 121.327 0.584 . . . . 0.0 109.904 177.692 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.402 ' HB1' ' HB2' ' A' ' 20' ' ' GLN . . . -87.76 -39.21 15.11 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.338 -179.229 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.561 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 54.0 t -73.26 -24.11 60.41 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.005 0.431 . . . . 0.0 111.316 -179.101 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.624 ' HG3' ' O ' ' A' ' 11' ' ' THR . 86.9 mtt180 -73.59 -10.53 59.8 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.093 0.473 . . . . 0.0 110.188 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 30.8 t -88.84 159.99 17.45 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.132 179.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -131.82 116.96 16.05 Favored Pre-proline 0 C--N 1.317 -0.838 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.985 177.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -73.51 176.01 43.42 Favored 'Cis proline' 0 C--O 1.242 0.704 0 C-N-CA 123.536 -1.444 . . . . 0.0 112.583 1.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 49.2 t -59.72 141.07 55.9 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.807 -179.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.402 ' HB2' ' HB1' ' A' ' 13' ' ' ALA . 16.3 mm-40 -115.75 11.82 15.76 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.372 -178.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.561 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 58.1 m -81.89 20.46 0.97 Allowed 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.733 0.301 . . . . 0.0 111.667 -179.057 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.5 108.29 2.13 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.075 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.1 m 63.03 15.09 8.14 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 123.18 0.592 . . . . 0.0 111.421 -178.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -152.31 81.4 1.25 Allowed 'General case' 0 N--CA 1.438 -1.027 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.455 ' HB2' ' HB3' ' A' ' 21' ' ' CYS . 49.5 t -130.38 150.27 51.68 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.864 -0.607 . . . . 0.0 112.172 -176.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.403 ' H ' HG21 ' A' ' 11' ' ' THR . 69.7 mt-30 -148.12 23.19 1.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.256 178.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.544 ' SG ' ' HA ' ' A' ' 10' ' ' CYS . 35.2 m -65.59 171.43 4.13 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.227 0.537 . . . . 0.0 112.361 -178.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.21 -165.7 40.08 Favored Glycine 0 N--CA 1.438 -1.173 0 CA-C-N 115.639 -0.71 . . . . 0.0 113.01 -177.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -84.23 -24.2 30.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 120.919 0.39 . . . . 0.0 110.975 -178.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -91.51 48.51 2.86 Favored Glycine 0 N--CA 1.444 -0.773 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.796 -179.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 21.5 t -120.64 126.71 50.93 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.8 t -109.02 7.97 26.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.262 -178.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.2 t -69.17 115.1 8.06 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.299 179.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.86 -5.36 29.9 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -176.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.16 -40.9 51.45 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.805 0.336 . . . . 0.0 111.044 179.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.469 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 7.8 p -111.38 -18.45 12.89 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.934 -178.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 47.5 tttp -80.48 113.49 18.71 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.786 0.327 . . . . 0.0 110.347 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.449 ' O ' ' HE3' ' A' ' 67' ' ' LYS . 12.6 t -120.72 167.11 12.82 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.741 -178.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.466 ' HB3' ' HD3' ' A' ' 55' ' ' PRO . 41.7 t -156.4 145.12 20.12 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 110.092 -0.336 . . . . 0.0 110.092 178.385 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -102.43 -13.52 17.23 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.498 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 70.0 m -88.9 135.63 33.43 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 175.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 81.4 p -127.94 -166.65 1.65 Allowed 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.571 -177.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.3 m -60.61 -15.04 24.04 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 120.91 0.386 . . . . 0.0 110.723 178.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -67.75 -30.22 69.63 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.634 178.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 147.55 157.97 7.67 Favored Glycine 0 N--CA 1.439 -1.152 0 C-N-CA 120.991 -0.623 . . . . 0.0 112.209 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 42.5 t -87.76 135.12 33.51 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 178.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.42 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 8.0 mtpm? -126.75 5.46 6.69 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -179.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.47 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 13.7 p -99.63 -32.05 11.27 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 119.984 -0.686 . . . . 0.0 110.138 178.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.69 5.97 25.35 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 120.981 -0.628 . . . . 0.0 112.888 179.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.704 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 74.4 mmtt -93.32 0.43 56.95 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 117.03 0.415 . . . . 0.0 111.334 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 64.19 30.65 13.59 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 121.568 0.699 . . . . 0.0 110.624 178.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 26.0 p -104.17 151.34 23.45 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.243 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 26.7 p -140.25 79.7 1.72 Allowed 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.084 0.469 . . . . 0.0 110.025 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 109.9 152.38 13.9 Favored Glycine 0 N--CA 1.442 -0.918 0 C-N-CA 121.13 -0.557 . . . . 0.0 111.858 -179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.466 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 11.4 Cg_endo -54.31 -34.62 80.85 Favored 'Trans proline' 0 C--N 1.351 0.663 0 C-N-CA 123.435 2.757 . . . . 0.0 113.32 -177.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -64.05 -36.35 83.71 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.968 0.413 . . . . 0.0 111.378 -178.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.3 m -106.86 22.96 15.13 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.691 -177.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 26.6 t -113.54 139.45 48.97 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.127 -178.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -124.72 12.79 8.58 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.851 0.357 . . . . 0.0 110.872 178.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.704 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 8.1 m -76.85 148.75 36.34 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.77 -179.021 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.682 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -81.79 -170.0 43.66 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.052 -0.819 . . . . 0.0 111.052 177.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.6 m -86.62 10.37 15.77 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 117.121 0.46 . . . . 0.0 111.616 -177.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.4 t -116.92 31.61 6.65 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.182 0.515 . . . . 0.0 109.866 -179.544 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . 0.4 ' SG ' ' N ' ' A' ' 65' ' ' SER . 42.4 t -109.11 167.86 9.79 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.227 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.4 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 31.2 t -68.49 -29.27 67.84 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.451 -178.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.49 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 14.1 p -90.5 23.73 2.89 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.199 0.523 . . . . 0.0 110.411 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.682 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 47.3 mmtm . . . . . 0 C--O 1.273 2.29 0 CA-C-O 117.713 -1.137 . . . . 0.0 110.768 -179.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.426 0 N-CA-C 112.413 -0.275 . . . . 0.0 112.413 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.2 m -76.01 113.96 14.12 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.795 0.331 . . . . 0.0 110.391 179.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 95.92 159.93 32.68 Favored Glycine 0 N--CA 1.443 -0.86 0 C-N-CA 120.936 -0.65 . . . . 0.0 111.753 -178.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.438 ' H ' ' HD3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -105.91 15.83 26.04 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.053 0.454 . . . . 0.0 110.849 179.987 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -78.44 161.85 48.85 Favored Glycine 0 CA--C 1.495 -1.188 0 C-N-CA 120.699 -0.763 . . . . 0.0 111.994 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? 63.97 75.24 0.39 Allowed 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 121.551 0.691 . . . . 0.0 109.927 179.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -96.09 -140.96 11.44 Favored Glycine 0 N--CA 1.437 -1.29 0 CA-C-N 115.134 -0.939 . . . . 0.0 112.287 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -96.65 8.76 43.45 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 120.607 0.241 . . . . 0.0 111.56 -177.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.537 ' O ' ' HA ' ' A' ' 27' ' ' CYS . 25.9 mtmm -111.45 18.86 18.76 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.223 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 10.7 m -82.09 162.2 22.61 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 174.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 80.6 p -100.54 -177.62 3.55 Favored 'General case' 0 C--N 1.306 -1.302 0 CA-C-O 120.841 0.353 . . . . 0.0 110.616 -178.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.4 m -80.61 -30.26 36.81 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 175.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.66 -30.59 68.31 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.333 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.542 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 52.0 t -71.58 -22.76 61.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.169 0.509 . . . . 0.0 110.578 178.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -87.03 -2.65 58.79 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.914 0.388 . . . . 0.0 110.684 179.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 25.4 m -80.14 168.94 18.49 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.799 -179.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.47 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 8.7 pt-20 -136.63 108.84 9.31 Favored Pre-proline 0 C--N 1.32 -0.713 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.736 179.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.47 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 73.0 Cg_endo -74.64 178.77 32.78 Favored 'Cis proline' 0 C--O 1.24 0.62 0 C-N-CA 123.535 -1.444 . . . . 0.0 111.919 -0.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.542 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 16.7 t -58.72 138.91 56.82 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 -179.469 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 87.9 mm-40 -114.37 24.33 12.01 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -174.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.615 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 63.9 m -96.67 29.39 3.0 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.831 0.348 . . . . 0.0 110.555 178.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.06 -53.23 47.48 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.875 -0.602 . . . . 0.0 113.068 -179.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -111.51 -6.9 14.36 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.784 0.326 . . . . 0.0 111.339 -179.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -139.07 91.72 2.54 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.863 0.363 . . . . 0.0 110.435 -179.197 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 44.0 t -118.43 128.23 54.41 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.91 -179.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -127.0 15.92 7.34 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.612 178.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.537 ' HA ' ' O ' ' A' ' 9' ' ' LYS . 93.5 m -70.01 132.41 45.87 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-O 121.208 0.528 . . . . 0.0 110.513 179.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.75 -166.95 42.29 Favored Glycine 0 N--CA 1.437 -1.275 0 CA-C-N 115.226 -0.897 . . . . 0.0 113.654 -176.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -53.74 -26.44 23.34 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.039 0.936 . . . . 0.0 112.167 -179.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -90.08 47.65 3.15 Favored Glycine 0 N--CA 1.443 -0.889 0 C-N-CA 120.642 -0.79 . . . . 0.0 113.447 -177.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 49.8 t -120.44 139.35 52.98 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 117.117 0.459 . . . . 0.0 109.899 177.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.6 t -123.15 18.68 9.96 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-O 121.417 0.627 . . . . 0.0 109.857 -178.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.401 ' SG ' ' HB3' ' A' ' 35' ' ' ALA . 42.9 t -93.54 113.54 25.68 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.586 -178.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -72.39 -4.32 29.38 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.673 -179.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.401 ' HB3' ' SG ' ' A' ' 33' ' ' CYS . . . -77.68 -41.04 39.51 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.334 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.615 ' HB3' ' HB2' ' A' ' 21' ' ' CYS . 19.8 p -106.95 -15.3 14.74 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 120.914 0.388 . . . . 0.0 111.979 -178.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -85.64 102.05 13.24 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.564 -179.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.0 t -108.18 178.52 4.48 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.297 179.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 48.1 t -156.72 149.13 23.34 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 110.078 -0.342 . . . . 0.0 110.078 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -106.78 -17.05 14.32 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 73.9 m -76.62 137.27 39.37 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 176.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 65.6 p -93.39 170.13 9.85 Favored 'General case' 0 C--N 1.308 -1.205 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.852 -173.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.51 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 20.2 m -69.38 -4.17 17.28 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.3 -179.253 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -84.02 -31.78 25.26 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.814 179.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 172.3 156.76 12.82 Favored Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 120.602 -0.809 . . . . 0.0 112.378 -179.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 53.8 t -74.84 142.18 44.19 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.704 0.287 . . . . 0.0 110.519 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 7.1 mtpm? -117.42 -18.6 9.79 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.735 -178.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.438 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 7.2 p -93.3 -33.23 14.0 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.857 -178.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.15 4.76 23.78 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.905 -0.664 . . . . 0.0 112.507 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.0 mmmp? -92.16 10.64 28.53 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 122.577 -0.366 . . . . 0.0 111.229 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 63.12 24.19 14.31 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.917 176.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 8.2 p -102.6 143.99 31.57 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.599 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.51 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 68.5 p -132.34 52.47 2.07 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-O 121.195 0.521 . . . . 0.0 110.198 179.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 132.87 161.18 9.79 Favored Glycine 0 N--CA 1.445 -0.704 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.52 -178.434 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -52.33 -41.12 68.45 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.518 2.812 . . . . 0.0 114.129 -177.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -74.44 -22.96 58.87 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.012 0.434 . . . . 0.0 111.134 -178.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.407 ' HB2' ' H ' ' A' ' 53' ' ' THR . 7.4 m -96.44 -0.46 49.14 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.873 179.305 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 44.1 t -98.26 147.65 24.42 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.082 -176.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -138.16 11.59 2.82 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.935 0.874 . . . . 0.0 108.832 176.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.2 m -81.71 142.49 32.63 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.618 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.435 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -67.53 167.31 41.02 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.453 -0.88 . . . . 0.0 111.332 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 30.7 m -69.18 5.68 1.17 Allowed 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -178.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 33.5 t -108.7 5.7 25.04 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 120.652 0.263 . . . . 0.0 111.192 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 49.7 t -77.37 169.07 18.96 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.88 0.371 . . . . 0.0 111.105 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.8 m -64.62 -28.74 69.83 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.697 -178.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.438 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 18.7 p -89.82 25.7 2.0 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.007 0.432 . . . . 0.0 110.763 -179.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.435 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 47.9 mmtm . . . . . 0 C--O 1.263 1.773 0 CA-C-O 117.43 -1.272 . . . . 0.0 111.402 -178.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ' CD' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_