data_2jve_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2jve _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.54 HD23 HG21 ' A' ' 40' ' ' THR . 2.3 mm? . . . . . 0 CA--C 1.519 -0.239 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 33' ' ' THR . 30.5 mtmm -115.02 98.61 6.9 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 119.552 -0.859 . . . . 0.0 111.323 -178.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 27.9 m -123.1 165.98 15.93 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.12 175.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.446 ' HA ' ' O ' ' A' ' 31' ' ' THR . 76.8 m-85 -72.01 131.55 43.06 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.145 -176.65 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.1 m -116.82 128.02 54.88 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 167.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.487 ' NH1' ' HG2' ' A' ' 51' ' ' GLU . 18.6 ttt180 . . . . . 0 C--N 1.319 -0.756 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.441 -173.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 51.2 mtp85 . . . . . 0 N--CA 1.45 -0.453 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.446 ' O ' ' HA ' ' A' ' 23' ' ' PHE . 97.1 m -130.88 133.41 45.87 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.324 -175.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 59.3 t -73.9 106.5 3.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.868 175.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.556 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 38.4 p -106.46 148.16 28.49 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.607 178.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.502 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -107.3 112.51 25.39 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.458 -179.526 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.453 ' HB2' ' HB2' ' A' ' 39' ' ' GLN . 2.5 p -95.1 166.11 12.09 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.037 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.27 174.77 9.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.511 -176.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.08 -28.27 66.33 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.368 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.591 ' O ' HG21 ' A' ' 57' ' ' THR . 3.3 pt-20 -54.91 -56.78 15.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.645 175.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.74 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 54.9 mt-30 -86.96 53.6 2.89 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.774 -172.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.54 HG21 HD23 ' A' ' 20' ' ' LEU . 0.1 OUTLIER -73.67 -0.36 15.25 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -173.283 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.637 ' CG ' ' HA ' ' A' ' 58' ' ' VAL . 3.7 mmp_? -110.75 178.84 4.23 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 119.943 -0.703 . . . . 0.0 109.91 173.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.639 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 61.2 m -135.73 131.93 36.22 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.066 -177.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.493 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.5 OUTLIER -93.12 128.72 39.16 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.288 -176.815 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.577 ' HB2' ' HB2' ' A' ' 84' ' ' ASN . 80.7 t80 -140.16 117.3 11.21 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.147 172.334 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.569 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 40.5 t -115.11 136.05 53.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 178.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.812 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 8.2 mm100 -74.22 139.73 44.57 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.141 177.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.555 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.8 mm? -132.19 147.86 67.47 Favored Pre-proline 0 C--N 1.316 -0.862 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 172.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 11.6 Cg_exo -72.84 8.98 1.44 Allowed 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.682 2.255 . . . . 0.0 112.479 177.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -139.02 -59.35 0.59 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.394 0.616 . . . . 0.0 109.566 -177.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.555 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 13.1 m -121.62 -150.08 0.44 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.436 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.487 ' HG2' ' NH1' ' A' ' 25' ' ' ARG . 2.7 pt-20 -151.21 147.8 27.45 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 177.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.569 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 22.5 mm -91.44 129.42 42.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.259 176.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.447 ' HB3' ' ND2' ' A' ' 84' ' ' ASN . 45.7 mt-30 -139.09 130.22 26.66 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.102 -178.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -173.6 160.56 3.81 Favored 'General case' 0 N--CA 1.463 0.21 0 O-C-N 123.403 0.439 . . . . 0.0 111.146 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.53 ' O ' ' HE2' ' A' ' 56' ' ' LYS . 1.3 m -79.27 147.25 32.6 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 168.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.53 ' HE2' ' O ' ' A' ' 55' ' ' CYS . 7.1 tppt? -156.96 132.5 9.31 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.154 -179.062 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.74 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 38.1 m -54.28 143.17 23.97 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.753 178.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.637 ' HA ' ' CG ' ' A' ' 41' ' ' ARG . 20.1 t -44.84 -61.46 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 123.796 0.685 . . . . 0.0 111.511 -173.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -57.51 -52.36 65.71 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.161 178.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.66 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -54.56 -47.48 73.19 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.86 -176.625 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.559 ' HA ' HG21 ' A' ' 64' ' ' VAL . 4.2 t -65.9 -32.8 74.52 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.382 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.36 -41.35 85.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.217 0.532 . . . . 0.0 110.835 176.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.66 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 9.1 pt-20 -74.52 -38.07 62.9 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.552 -176.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.617 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 13.5 m -72.23 -26.32 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-O 121.428 0.632 . . . . 0.0 110.414 174.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.654 HD22 ' SG ' ' A' ' 77' ' ' CYS . 0.2 OUTLIER -56.02 -47.64 77.42 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 174.059 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -72.7 -36.56 67.87 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.054 -174.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.617 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.5 pt-20 -59.6 -43.68 93.64 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.236 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.53 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 35.0 m -79.17 -34.42 16.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.951 0.405 . . . . 0.0 111.552 -178.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.494 ' HG1' HD11 ' A' ' 65' ' ' LEU . 97.8 m -78.42 -15.67 58.42 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.165 0.507 . . . . 0.0 110.861 -176.052 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.64 -19.56 45.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.082 173.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.511 HG13 ' O ' ' A' ' 67' ' ' GLU . 29.9 mt -81.0 -27.11 10.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.864 177.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 119.76 4.18 11.84 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 119.891 -1.147 . . . . 0.0 112.306 -178.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -97.82 112.4 61.52 Favored Pre-proline 0 N--CA 1.449 -0.499 0 CA-C-O 120.536 0.208 . . . . 0.0 110.797 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.812 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 54.4 Cg_exo -58.29 134.98 65.13 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.11 2.54 . . . . 0.0 112.306 177.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -143.29 160.92 39.6 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 119.983 -0.687 . . . . 0.0 111.427 178.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.412 ' HE3' ' HB3' ' A' ' 76' ' ' LYS . 7.6 ptpp? -142.19 147.58 36.82 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.917 175.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.654 ' SG ' HD22 ' A' ' 65' ' ' LEU . 76.6 m -130.24 87.08 2.46 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.151 173.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 15.4 p -106.95 171.02 7.6 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 119.943 -0.703 . . . . 0.0 111.475 -175.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.493 ' HB3' ' CZ ' ' A' ' 41' ' ' ARG . 10.0 p -115.35 107.08 14.77 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.085 0.469 . . . . 0.0 111.486 -174.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.551 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 23.7 tt0 177.63 153.17 0.27 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.552 ' C ' HD22 ' A' ' 82' ' ' LEU . 62.2 m-20 -64.43 137.31 57.81 Favored 'General case' 0 CA--C 1.505 -0.765 0 C-N-CA 117.563 -1.655 . . . . 0.0 108.66 173.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.552 HD22 ' C ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.99 15.8 10.19 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.607 175.12 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . 0.551 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.2 t -64.83 -23.42 67.23 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.654 -172.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.577 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 19.5 p-10 . . . . . 0 N--CA 1.45 -0.429 0 CA-C-O 122.03 0.919 . . . . 0.0 110.606 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.475 HD23 ' HG ' ' A' ' 79' ' ' CYS . 46.2 tp . . . . . 0 C--O 1.235 0.303 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.502 ' HA ' ' O ' ' A' ' 33' ' ' THR . 9.9 mtmp? -91.44 102.9 15.58 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 120.449 -0.5 . . . . 0.0 111.306 178.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 30.4 m -111.26 139.34 46.73 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 178.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.633 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 19.0 m-85 -54.24 123.86 14.07 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.893 175.248 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -100.61 167.36 10.39 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 171.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.562 ' HG3' ' HB2' ' A' ' 53' ' ' GLN . 7.2 mtp180 . . . . . 0 C--N 1.324 -0.528 0 C-N-CA 120.062 -0.655 . . . . 0.0 112.241 178.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.427 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . 3.2 mmt85 . . . . . 0 N--CA 1.446 -0.666 0 CA-C-O 121.351 0.596 . . . . 0.0 109.491 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.3 m -114.28 114.9 26.58 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.53 -169.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 48.6 t -80.01 106.37 11.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 174.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.502 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 47.2 p -128.48 142.74 50.99 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.313 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 t -85.43 121.73 28.56 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 165.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.4 t -87.66 -163.39 0.93 Allowed 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.536 -172.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.27 168.67 12.52 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.65 -0.42 . . . . 0.0 111.04 -176.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -60.21 -18.68 50.05 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.042 178.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.683 ' HG2' HG22 ' A' ' 57' ' ' THR . 19.1 tt0 -63.63 -40.94 98.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.44 176.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.0 mp0 -96.98 120.88 38.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.656 0.741 . . . . 0.0 112.741 -169.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.419 ' OG1' HG22 ' A' ' 58' ' ' VAL . 1.1 p -124.92 12.53 8.43 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.552 -1.204 . . . . 0.0 110.582 177.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.634 ' HG3' ' H ' ' A' ' 42' ' ' CYS . 8.2 tpp85 -138.18 173.4 11.66 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.489 177.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.643 ' HB3' ' OD1' ' A' ' 84' ' ' ASN . 18.1 m -126.36 149.31 49.28 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.544 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.3 OUTLIER -110.1 122.03 46.64 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 123.147 0.279 . . . . 0.0 110.298 -176.231 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.612 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 50.2 t80 -133.12 104.06 6.32 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.487 173.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.513 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 61.8 t -101.48 134.36 42.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.772 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 1.6 mm100 -76.78 138.07 39.66 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 119.777 -0.769 . . . . 0.0 109.637 177.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.478 HD23 ' C ' ' A' ' 46' ' ' GLN . 2.9 mm? -138.51 152.38 70.96 Favored Pre-proline 0 C--N 1.314 -0.978 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.762 176.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -86.32 9.42 4.04 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 122.438 2.092 . . . . 0.0 111.424 172.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -125.0 -65.39 1.03 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.842 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.3 m -151.85 132.24 13.75 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.13 149.85 37.29 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.79 0.329 . . . . 0.0 110.542 -172.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.612 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 65.8 mt -90.95 124.91 43.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.377 178.172 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.562 ' HB2' ' HG3' ' A' ' 25' ' ' ARG . 48.5 mt-30 -135.85 129.96 33.16 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -176.25 163.69 2.6 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 123.419 0.449 . . . . 0.0 110.979 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 2.0 p -85.88 135.87 33.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.724 0.297 . . . . 0.0 110.585 177.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.544 ' HB2' ' HB2' ' A' ' 61' ' ' CYS . 68.1 mmtt -138.71 158.76 43.64 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 176.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.683 HG22 ' HG2' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -69.54 155.2 40.85 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.605 -1.258 . . . . 0.0 107.605 171.722 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.466 ' HA ' ' HB2' ' A' ' 41' ' ' ARG . 85.3 t -52.76 -46.09 50.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.254 -0.579 . . . . 0.0 109.92 179.077 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.573 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 37.5 tt0 -66.87 -55.56 14.2 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.117 178.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.808 ' O ' HG13 ' A' ' 64' ' ' VAL . 7.8 tt0 -54.84 -40.23 69.4 Favored 'General case' 0 C--O 1.212 -0.887 0 O-C-N 123.331 0.394 . . . . 0.0 110.594 -175.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.544 ' HB2' ' HB2' ' A' ' 56' ' ' LYS . 3.8 t -69.93 -32.19 70.35 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.711 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.37 -38.75 85.24 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.059 171.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.573 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 11.5 mm-40 -57.61 -52.71 64.3 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 122.114 0.959 . . . . 0.0 110.202 175.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.808 HG13 ' O ' ' A' ' 60' ' ' GLN . 4.2 m -71.06 -26.06 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.79 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.84 -178.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.511 HD12 ' HB2' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -56.09 -49.33 74.13 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 175.23 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -72.88 -37.11 67.43 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 120.562 -0.455 . . . . 0.0 112.011 -174.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.589 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 12.1 pt-20 -59.25 -42.95 92.33 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.109 -0.637 . . . . 0.0 110.355 -179.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 64' ' ' VAL . 34.8 m -79.3 -36.37 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-O 120.827 0.346 . . . . 0.0 111.691 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 98.3 m -74.75 -20.74 59.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.994 -175.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.61 -23.7 58.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.152 0.501 . . . . 0.0 110.149 174.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 67' ' ' GLU . 12.1 mt -81.03 -23.85 10.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.666 177.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.444 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 112.87 5.82 23.41 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.979 -178.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -98.66 107.94 45.61 Favored Pre-proline 0 N--CA 1.449 -0.475 0 CA-C-O 120.777 0.322 . . . . 0.0 111.081 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.772 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 74.9 Cg_exo -55.38 130.75 42.26 Favored 'Trans proline' 0 C--N 1.34 0.118 0 C-N-CA 123.478 2.785 . . . . 0.0 113.262 177.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.511 ' HB2' HD12 ' A' ' 65' ' ' LEU . . . -128.38 154.51 45.92 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.889 174.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -134.61 118.81 17.62 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.885 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 45.9 m -114.34 93.85 4.53 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.187 173.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 17.8 p -109.33 155.1 21.6 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.944 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.475 ' HG ' HD23 ' A' ' 20' ' ' LEU . 49.6 t -109.48 103.44 12.34 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 119.991 -0.684 . . . . 0.0 110.469 -174.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.523 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 14.4 tt0 -173.87 152.67 2.01 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 -179.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.547 ' CB ' HD21 ' A' ' 82' ' ' LEU . 28.7 m-20 -63.48 136.43 57.58 Favored 'General case' 0 CA--C 1.504 -0.812 0 C-N-CA 117.878 -1.529 . . . . 0.0 109.389 176.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.633 ' HB3' ' CE2' ' A' ' 23' ' ' PHE . 0.2 OUTLIER 62.38 21.53 12.61 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.114 174.654 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . 0.523 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.1 t -68.43 -37.03 79.91 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.559 -172.166 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.643 ' OD1' ' HB3' ' A' ' 42' ' ' CYS . 0.3 OUTLIER . . . . . 0 N--CA 1.453 -0.324 0 C-N-CA 119.085 -1.046 . . . . 0.0 109.528 175.454 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.569 HD21 HG22 ' A' ' 40' ' ' THR . 2.6 mm? . . . . . 0 N--CA 1.453 -0.297 0 CA-C-O 120.758 0.313 . . . . 0.0 110.829 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.754 ' HE3' ' N ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -83.92 124.49 31.05 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 171.689 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.608 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 12.3 t -147.47 153.54 39.67 Favored 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 119.399 -0.921 . . . . 0.0 109.972 -177.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.521 ' O ' ' HB3' ' A' ' 53' ' ' GLN . 92.1 m-85 -84.55 123.13 29.96 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 119.179 -1.009 . . . . 0.0 109.354 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.5 m -113.78 131.42 56.22 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 175.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 25' ' ' ARG . 1.8 tpp180 . . . . . 0 C--N 1.322 -0.594 0 CA-C-O 121.059 0.457 . . . . 0.0 110.379 -178.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 30' ' ' ARG . 27.4 mtp-105 . . . . . 0 N--CA 1.452 -0.365 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.501 ' O ' ' HA ' ' A' ' 23' ' ' PHE . 9.1 t -140.15 163.97 31.3 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.753 -173.094 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.424 HG12 ' HB3' ' A' ' 21' ' ' LYS . 94.8 t -79.12 120.78 30.98 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.236 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.396 178.194 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.3 p -113.21 141.49 46.9 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.171 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.7 t -87.11 111.93 21.42 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 174.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.1 m -107.2 157.54 17.8 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.924 -171.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.12 170.99 10.39 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -167.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -52.68 -39.06 61.54 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.449 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 39' ' ' GLN . 4.5 pt-20 -56.85 -40.81 76.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.828 177.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.603 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 70.5 mt-30 -97.21 64.96 1.96 Allowed 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.797 -174.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.569 HG22 HD21 ' A' ' 20' ' ' LEU . 0.7 OUTLIER -89.71 27.28 1.56 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.433 0.635 . . . . 0.0 110.427 177.461 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.59 ' HD3' HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -136.23 177.78 7.57 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.979 178.253 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.786 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.0 m -137.21 131.28 32.22 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.809 179.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.421 ' HG ' ' SG ' ' A' ' 61' ' ' CYS . 0.5 OUTLIER -94.01 118.43 31.5 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 176.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.55 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 91.5 t80 -134.76 118.83 17.49 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.226 175.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.55 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 58.8 t -125.29 141.59 44.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.982 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.934 HE21 ' HA ' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -83.52 137.1 34.02 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.138 0.494 . . . . 0.0 110.901 177.934 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.572 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.7 mm? -131.9 154.02 81.6 Favored Pre-proline 0 C--N 1.319 -0.744 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 175.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.91 18.72 1.43 Allowed 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.28 1.986 . . . . 0.0 112.267 177.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -138.35 -44.43 0.5 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.461 0.648 . . . . 0.0 109.747 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.572 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 48.1 m -150.77 -151.39 0.39 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 178.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.29 153.78 42.37 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.264 175.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.55 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 14.3 mm -87.65 127.01 41.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.491 177.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.521 ' HB3' ' O ' ' A' ' 23' ' ' PHE . 83.5 mt-30 -140.69 129.11 22.57 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 123.556 0.535 . . . . 0.0 110.232 176.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.647 ' HB2' ' HZ2' ' A' ' 56' ' ' LYS . 0.5 OUTLIER -174.03 146.1 1.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.936 -177.314 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.608 ' SG ' ' HB3' ' A' ' 22' ' ' CYS . 88.2 m -79.91 118.67 21.87 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 119.984 -0.687 . . . . 0.0 109.223 169.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.647 ' HZ2' ' HB2' ' A' ' 54' ' ' GLU . 10.0 mptt -124.0 156.18 36.92 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 174.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.603 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 15.6 p -67.34 153.8 42.84 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 119.405 -0.918 . . . . 0.0 109.435 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.59 HG23 ' HD3' ' A' ' 41' ' ' ARG . 58.7 t -53.31 -46.67 57.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 121.221 -0.192 . . . . 0.0 111.105 -175.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -62.3 -55.82 24.48 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 120.903 0.382 . . . . 0.0 111.234 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.581 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 58.5 tt0 -64.14 -42.86 96.64 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.59 -172.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.55 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 4.7 t -64.52 -31.5 72.73 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.5 -0.48 . . . . 0.0 109.84 178.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.424 ' O ' ' HB3' ' A' ' 65' ' ' LEU . . . -69.68 -40.07 76.6 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.546 -0.462 . . . . 0.0 111.209 176.445 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 12.4 pt-20 -72.85 -38.47 67.06 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.95 0.405 . . . . 0.0 110.653 -178.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.618 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 12.8 m -73.56 -26.39 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.366 0 CA-C-O 121.638 0.732 . . . . 0.0 110.446 174.22 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.55 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 25.6 tp -54.94 -47.46 74.42 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 174.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.542 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 40.0 tt0 -73.98 -39.84 63.39 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.486 -175.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.618 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.0 pt-20 -55.24 -45.28 76.03 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.549 -177.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.585 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 33.0 m -80.16 -32.93 13.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.542 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 13.9 p -70.19 -27.98 64.94 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.217 -178.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.32 -19.74 63.87 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.629 176.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 11.3 mt -87.85 -20.31 7.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.827 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 114.51 -1.88 23.5 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 119.935 -1.126 . . . . 0.0 112.648 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -78.71 123.51 85.36 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.663 0.232 . . . . 0.0 111.155 -178.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.651 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 52.8 Cg_exo -62.0 117.68 4.53 Favored 'Trans proline' 0 CA--C 1.516 -0.394 0 C-N-CA 123.045 2.497 . . . . 0.0 111.973 175.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.463 ' HA ' ' O ' ' A' ' 44' ' ' PHE . . . -135.22 149.4 49.87 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.811 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 ptmt -150.15 112.64 4.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.483 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.786 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 29.6 m -103.23 92.56 4.56 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.569 170.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.3 p -107.84 160.39 15.78 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.654 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 7.9 p -109.42 101.36 10.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.991 0.424 . . . . 0.0 111.029 -175.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.565 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 3.4 tt0 179.64 152.04 0.41 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -179.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.537 ' C ' HD23 ' A' ' 82' ' ' LEU . 78.0 m-20 -64.37 132.54 50.4 Favored 'General case' 0 CA--C 1.506 -0.714 0 C-N-CA 118.388 -1.325 . . . . 0.0 109.981 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.537 HD23 ' C ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.54 16.84 10.53 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.531 172.883 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . 0.565 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 39.6 t -61.37 -18.54 59.22 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -172.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.456 ' ND2' ' H ' ' A' ' 23' ' ' PHE . 4.3 p30 . . . . . 0 CA--C 1.541 0.599 0 CA-C-O 119.234 -0.412 . . . . 0.0 110.474 -179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 mm? . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.481 ' HG2' ' HB ' ' A' ' 34' ' ' THR . 29.0 mtmm -120.9 98.57 6.06 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 119.471 -0.892 . . . . 0.0 110.808 176.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.2 m -107.17 151.62 25.17 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.262 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -73.28 153.56 40.53 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.823 179.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.4 m -142.11 127.91 19.32 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.41 177.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.739 HH11 ' HG2' ' A' ' 51' ' ' GLU . 63.0 mtp180 . . . . . 0 C--N 1.327 -0.392 0 C-N-CA 119.379 -0.929 . . . . 0.0 111.161 -178.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.516 ' HB3' ' HG2' ' A' ' 25' ' ' ARG . 15.0 ptp180 . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 121.096 0.474 . . . . 0.0 110.562 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 19.1 p -94.99 157.02 16.08 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.199 -178.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 61.8 t -99.31 112.81 32.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 176.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.46 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 41.3 p -107.64 148.01 29.9 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.394 176.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.481 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 1.7 t -101.92 112.28 24.85 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.753 176.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 39' ' ' GLN . 1.6 p -95.12 162.55 13.66 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.4 -175.63 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.53 178.04 7.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.749 -173.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -51.23 -33.07 26.28 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.494 0.664 . . . . 0.0 110.343 174.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.493 ' HG2' HG22 ' A' ' 57' ' ' THR . 39.8 tt0 -51.3 -49.61 60.95 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.387 -1.278 . . . . 0.0 110.939 175.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.558 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 34.8 mm-40 -96.76 94.29 7.19 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 119.715 -0.794 . . . . 0.0 109.67 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.8 18.87 20.82 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.591 177.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.727 ' HG2' ' SG ' ' A' ' 61' ' ' CYS . 2.8 tpt180 -131.29 174.45 10.04 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.502 174.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.654 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.1 m -134.01 131.07 38.47 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.338 -0.847 . . . . 0.0 108.739 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.551 HD22 HG22 ' A' ' 45' ' ' VAL . 0.2 OUTLIER -91.79 128.91 37.81 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -179.328 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.522 ' HB2' ' HB2' ' A' ' 84' ' ' ASN . 24.9 t80 -138.36 102.14 4.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.323 172.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.586 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 31.8 t -105.35 133.95 48.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 175.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.891 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -97.68 134.01 41.44 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.013 -179.118 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.507 HD23 ' HA ' ' A' ' 51' ' ' GLU . 3.7 mm? -119.48 157.85 50.58 Favored Pre-proline 0 C--N 1.319 -0.734 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.38 -28.41 87.51 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.473 2.115 . . . . 0.0 113.013 -178.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -135.31 9.76 3.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.822 0.344 . . . . 0.0 111.021 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.442 ' C ' ' HB2' ' A' ' 47' ' ' LEU . 37.2 m -156.58 -166.63 2.18 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.528 -0.469 . . . . 0.0 109.97 -175.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.739 ' HG2' HH11 ' A' ' 25' ' ' ARG . 7.7 pt-20 -165.6 151.05 9.07 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 175.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.586 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 24.7 mm -105.87 128.39 60.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.457 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.43 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 17.7 mt-30 -139.2 130.56 26.94 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.999 -0.68 . . . . 0.0 110.124 -179.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -165.74 158.73 15.55 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.678 -178.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 6.3 m -77.98 117.51 19.38 Favored 'General case' 0 CA--C 1.507 -0.687 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 163.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -123.86 144.93 49.45 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 176.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.558 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 21.9 p -63.01 156.86 23.44 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 118.925 -1.11 . . . . 0.0 108.127 -178.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.542 HG23 ' HD3' ' A' ' 41' ' ' ARG . 57.6 t -58.17 -37.04 60.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.033 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -65.52 -55.68 16.48 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.981 177.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.646 ' O ' HG11 ' A' ' 64' ' ' VAL . 34.1 tt0 -64.06 -28.59 69.89 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.23 -175.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.727 ' SG ' ' HG2' ' A' ' 41' ' ' ARG . 0.5 OUTLIER -67.86 -33.84 75.54 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.997 178.975 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.12 -40.41 78.31 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 174.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.559 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 88.1 mt-10 -58.45 -53.2 61.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.647 177.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.646 HG11 ' O ' ' A' ' 60' ' ' GLN . 17.7 m -72.8 -28.89 28.14 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.569 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.661 -177.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.538 HD13 ' HB2' ' A' ' 75' ' ' ALA . 52.5 tp -58.93 -50.79 72.71 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.617 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -75.21 -36.38 61.39 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.331 -176.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.598 ' HG3' ' N ' ' A' ' 68' ' ' VAL . 11.4 pt-20 -56.33 -47.65 78.32 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.59 -176.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.598 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.6 m -80.67 -34.97 14.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 C-N-CA 120.809 -0.357 . . . . 0.0 111.806 -179.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 89.7 m -67.76 -28.61 67.77 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.855 0.36 . . . . 0.0 110.955 -177.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.58 -21.52 62.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.992 0.425 . . . . 0.0 110.682 176.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 67' ' ' GLU . 8.9 mt -87.22 -20.13 7.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.269 0.557 . . . . 0.0 109.753 178.07 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 115.49 -1.12 22.04 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.015 -1.088 . . . . 0.0 112.494 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.488 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 63.1 m-85 -87.58 116.88 67.57 Favored Pre-proline 0 N--CA 1.448 -0.529 0 CA-C-O 120.596 0.236 . . . . 0.0 110.547 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.891 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 46.6 Cg_exo -63.08 129.08 24.63 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 123.193 2.595 . . . . 0.0 112.616 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.538 ' HB2' HD13 ' A' ' 65' ' ' LEU . . . -138.34 162.4 34.47 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.079 -0.649 . . . . 0.0 111.796 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.77 154.36 38.35 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.317 168.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.654 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 9.4 p -129.62 111.64 12.9 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-O 121.759 0.79 . . . . 0.0 109.912 164.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 2.5 p -106.08 153.21 22.39 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.174 179.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.42 ' HB3' ' HD2' ' A' ' 41' ' ' ARG . 7.7 p -109.64 100.23 9.3 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.424 -0.51 . . . . 0.0 109.893 177.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 173.45 145.08 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -177.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.536 ' CB ' HD23 ' A' ' 82' ' ' LEU . 70.8 m-20 -61.65 139.24 58.31 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.328 -0.949 . . . . 0.0 110.593 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.536 HD23 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 62.82 17.81 10.21 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.582 171.738 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 14.7 p -79.58 -37.62 35.92 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.011 -175.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.522 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 20.4 p-10 . . . . . 0 N--CA 1.465 0.305 0 CA-C-O 121.149 0.499 . . . . 0.0 110.607 -177.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 30.2 tp . . . . . 0 C--O 1.235 0.294 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -118.08 109.58 16.6 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 119.556 -0.858 . . . . 0.0 111.273 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 38.7 m -128.81 163.27 25.57 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.674 -0.411 . . . . 0.0 110.679 175.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.445 ' HB3' ' HB3' ' A' ' 30' ' ' ARG . 98.8 m-85 -78.51 124.97 28.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.925 -177.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.461 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 48.2 m -125.14 125.44 43.72 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 172.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.551 ' HA ' ' HA ' ' A' ' 30' ' ' ARG . 39.9 ttp85 . . . . . 0 C--N 1.322 -0.622 0 C-N-CA 119.924 -0.71 . . . . 0.0 110.821 -175.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.551 ' HA ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 121.147 0.499 . . . . 0.0 111.965 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 35.2 p -100.45 144.38 29.52 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.911 174.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.9 t -76.05 105.69 5.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 120.258 -0.577 . . . . 0.0 109.938 178.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.5 p -97.44 149.67 21.89 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.207 -176.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.9 t -89.51 112.48 23.66 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 174.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.73 147.22 23.55 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.603 -174.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.88 176.99 8.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.234 -0.439 . . . . 0.0 112.072 -174.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -56.21 -39.55 72.65 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.539 -177.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.786 ' HG3' ' HG3' ' A' ' 39' ' ' GLN . 9.5 pt-20 -61.7 -34.06 75.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.929 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.786 ' HG3' ' HG3' ' A' ' 38' ' ' GLU . 29.2 mt-30 -95.5 59.31 2.13 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.421 -173.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.97 7.21 19.08 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.062 0.458 . . . . 0.0 111.484 -178.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.969 ' HD3' HG23 ' A' ' 58' ' ' VAL . 7.3 mpt_? -120.24 177.38 5.04 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 168.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.763 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 59.8 m -145.62 130.15 17.88 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 119.741 -0.784 . . . . 0.0 110.284 -176.265 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.4 ' HA ' HD22 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -88.52 135.96 33.22 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.082 0.467 . . . . 0.0 110.933 -175.075 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.519 ' O ' ' HA ' ' A' ' 75' ' ' ALA . 20.1 t80 -139.71 109.23 6.21 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.979 -1.009 . . . . 0.0 108.673 170.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.566 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 27.8 t -115.04 123.79 71.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 173.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.425 ' O ' ' HG3' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -94.32 116.28 28.64 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.436 0.636 . . . . 0.0 110.162 -178.074 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.613 ' HB2' ' O ' ' A' ' 50' ' ' SER . 2.3 mm? -111.15 156.37 41.12 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.59 -178.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -75.31 15.34 0.81 Allowed 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.01 2.473 . . . . 0.0 112.829 178.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -141.15 -45.98 0.38 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.539 0.685 . . . . 0.0 110.175 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.613 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 54.2 m -146.45 -163.08 1.66 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 177.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.494 ' HA ' HD23 ' A' ' 47' ' ' LEU . 29.7 mt-10 -142.88 152.04 41.69 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 119.928 -0.709 . . . . 0.0 111.025 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.566 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 49.8 mt -103.28 102.63 13.92 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.583 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.019 176.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.461 ' O ' ' HA ' ' A' ' 24' ' ' THR . 54.0 mt-30 -124.75 130.61 52.74 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 119.799 -0.761 . . . . 0.0 109.878 178.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -168.7 167.75 11.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.91 -176.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 16.3 m -90.99 119.49 31.22 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.692 -0.803 . . . . 0.0 108.9 171.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -121.23 139.99 52.64 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.493 -174.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 30.5 p -64.3 147.24 52.92 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 119.891 -0.723 . . . . 0.0 109.852 -178.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.969 HG23 ' HD3' ' A' ' 41' ' ' ARG . 25.0 t -51.65 -50.02 32.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 O-C-N 123.439 0.462 . . . . 0.0 112.145 -171.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.576 ' HG3' ' HG2' ' A' ' 60' ' ' GLN . 17.6 pt20 -63.03 -48.44 78.74 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 120.874 0.369 . . . . 0.0 111.872 -176.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.617 ' O ' HG12 ' A' ' 64' ' ' VAL . 0.4 OUTLIER -69.5 -38.49 77.63 Favored 'General case' 0 C--O 1.212 -0.919 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 -176.696 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.556 ' HA ' HG22 ' A' ' 64' ' ' VAL . 0.8 OUTLIER -60.96 -33.15 72.75 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.404 -178.728 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.63 -47.46 75.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.972 0.415 . . . . 0.0 110.454 177.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 8.2 pt-20 -72.16 -36.85 69.41 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.032 -176.032 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.617 HG12 ' O ' ' A' ' 60' ' ' GLN . 14.4 m -74.41 -27.21 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 CA-C-O 121.524 0.678 . . . . 0.0 110.553 177.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.432 HD11 ' HB1' ' A' ' 75' ' ' ALA . 58.3 tp -59.08 -49.42 77.94 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 174.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.548 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 44.0 mt-10 -74.1 -32.04 63.05 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.556 -175.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.601 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.5 pt-20 -61.4 -44.96 96.24 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 120.159 -0.617 . . . . 0.0 109.929 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.55 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 33.6 m -80.21 -32.47 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.548 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 27.7 p -73.77 -25.29 60.07 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 120.201 -0.6 . . . . 0.0 111.203 -178.357 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.07 -21.45 63.15 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.061 0.458 . . . . 0.0 110.275 175.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 67' ' ' GLU . 16.4 mt -82.47 -18.43 10.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.515 176.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 105.48 9.06 34.17 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.197 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -89.76 122.52 67.96 Favored Pre-proline 0 N--CA 1.448 -0.561 0 CA-C-O 120.974 0.416 . . . . 0.0 111.749 -178.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_exo -51.95 124.93 15.77 Favored 'Trans proline' 0 N--CA 1.471 0.174 0 C-N-CA 123.929 3.086 . . . . 0.0 112.566 174.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.519 ' HA ' ' O ' ' A' ' 44' ' ' PHE . . . -151.93 157.85 42.36 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 119.955 -0.698 . . . . 0.0 112.09 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -155.5 147.07 22.98 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.956 172.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.763 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 27.6 p -130.84 94.51 3.63 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.536 0.684 . . . . 0.0 109.513 165.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 6.0 p -106.98 166.92 10.25 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.932 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 9.2 p -109.26 105.33 14.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.932 0.396 . . . . 0.0 110.991 -175.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.586 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 4.3 tt0 175.25 147.36 0.08 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 -176.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.571 ' CB ' HD21 ' A' ' 82' ' ' LEU . 16.5 m-20 -61.84 135.71 57.69 Favored 'General case' 0 CA--C 1.504 -0.825 0 C-N-CA 118.979 -1.088 . . . . 0.0 109.312 175.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.571 HD21 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 63.6 19.42 11.7 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.238 175.427 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . 0.586 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.2 t -73.57 -31.58 63.68 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.666 -176.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.415 ' HB3' ' CB ' ' A' ' 42' ' ' CYS . 22.0 p-10 . . . . . 0 C--N 1.322 -0.605 0 C-N-CA 120.164 -0.615 . . . . 0.0 110.012 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 30.2 tp . . . . . 0 C--O 1.234 0.246 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt -111.26 98.67 7.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.099 0.476 . . . . 0.0 111.205 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.443 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 18.0 m -108.02 153.44 23.1 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 175.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -71.87 134.98 46.4 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.089 -0.645 . . . . 0.0 110.287 175.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.5 p -115.45 118.32 32.85 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 172.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.5 ' HD3' ' O ' ' A' ' 51' ' ' GLU . 32.5 ttt85 . . . . . 0 C--N 1.322 -0.591 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.071 -178.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' A' ' 30' ' ' ARG . 9.4 ptp180 . . . . . 0 N--CA 1.446 -0.635 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -103.83 136.37 43.64 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.478 -172.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.2 t -75.47 106.63 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 169.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 40.2 p -121.25 131.75 54.4 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 119.841 -0.743 . . . . 0.0 110.938 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.5 t -72.84 116.57 13.5 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 169.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.83 177.9 7.15 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -174.48 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.559 ' HB3' ' OE1' ' A' ' 38' ' ' GLU . . . -66.36 161.09 23.27 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 119.267 -0.973 . . . . 0.0 109.257 178.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -80.44 -6.81 58.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -165.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.559 ' OE1' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -80.19 -30.42 38.76 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.118 173.089 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.6 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 30.3 mt-30 -80.46 97.25 7.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.119 179.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.26 11.31 33.09 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.411 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.797 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 18.0 mmt85 -129.33 179.37 5.82 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.437 0.637 . . . . 0.0 110.676 175.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.622 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 82.9 m -136.48 132.88 35.93 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.738 -171.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.3 OUTLIER -104.14 125.68 50.64 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.007 -172.185 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.819 ' HD2' ' HD3' ' A' ' 76' ' ' LYS . 49.7 t80 -141.15 124.88 16.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.572 172.435 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.495 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 41.4 t -121.54 140.53 45.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.366 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.765 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 10.0 mm100 -72.72 134.07 44.86 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.095 0.247 . . . . 0.0 110.875 178.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.496 HD23 ' C ' ' A' ' 46' ' ' GLN . 4.2 mm? -129.95 143.93 51.03 Favored Pre-proline 0 C--N 1.326 -0.437 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 174.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 7.2 Cg_exo -75.19 28.54 0.37 Allowed 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 123.294 2.663 . . . . 0.0 113.226 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -172.13 -26.02 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.04 0.448 . . . . 0.0 111.088 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.491 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 70.2 m -149.7 -153.31 0.48 Allowed 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.5 ' O ' ' HD3' ' A' ' 25' ' ' ARG . 10.2 pt-20 -149.11 151.96 35.31 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.688 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 68.1 mt -101.93 131.09 50.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.049 175.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.406 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 39.1 mt-30 -138.87 130.73 27.78 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.71 ' CG ' ' HE2' ' A' ' 56' ' ' LYS . 2.9 tp10 -168.58 157.24 8.54 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 123.396 0.435 . . . . 0.0 109.863 -168.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.443 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 60.6 m -94.84 139.25 31.55 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 173.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.71 ' HE2' ' CG ' ' A' ' 54' ' ' GLU . 18.6 mmtt -147.0 149.41 33.09 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 176.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.6 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 68.3 p -66.48 153.16 43.6 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 175.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.587 HG22 ' HG2' ' A' ' 41' ' ' ARG . 19.9 t -48.67 -49.49 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 120.863 0.363 . . . . 0.0 110.63 -175.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -64.09 -57.08 10.65 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.766 -178.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.71 ' O ' HG12 ' A' ' 64' ' ' VAL . 96.2 mt-30 -63.75 -28.96 70.24 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.191 -175.079 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.563 ' HA ' HG21 ' A' ' 64' ' ' VAL . 5.4 t -71.36 -33.02 69.19 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.59 -35.95 70.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.079 0.466 . . . . 0.0 109.951 173.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -62.38 -52.28 64.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.573 175.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.71 HG12 ' O ' ' A' ' 60' ' ' GLN . 15.2 m -69.47 -26.65 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.615 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.417 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.494 HD12 ' HB2' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -58.08 -49.03 78.34 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 174.077 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -73.19 -33.87 65.65 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.009 -174.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.635 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.0 pt-20 -59.92 -42.7 94.49 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 119.826 -0.749 . . . . 0.0 110.132 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.499 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.2 m -80.01 -36.16 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 99.1 m -74.52 -29.19 61.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.34 -174.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.64 -21.95 64.44 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.561 174.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 67' ' ' GLU . 14.8 mt -79.14 -25.49 12.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 121.283 0.563 . . . . 0.0 109.91 177.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.412 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 113.88 11.39 12.69 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 119.811 -1.185 . . . . 0.0 111.972 -176.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -102.26 105.1 41.18 Favored Pre-proline 0 N--CA 1.451 -0.401 0 CA-C-O 120.658 0.266 . . . . 0.0 111.014 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.765 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 87.4 Cg_exo -52.18 128.56 27.7 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 123.377 2.718 . . . . 0.0 113.001 177.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.494 ' HB2' HD12 ' A' ' 65' ' ' LEU . . . -136.29 161.88 34.54 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.018 -0.673 . . . . 0.0 111.193 176.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.819 ' HD3' ' HD2' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -138.27 152.51 48.62 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.24 177.277 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.797 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 9.3 t -145.71 89.78 1.94 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.998 174.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 7.2 p -107.55 162.95 13.49 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.942 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.473 ' HB2' ' HD3' ' A' ' 41' ' ' ARG . 45.4 t -109.15 107.94 18.41 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.421 -174.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.495 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 9.7 tp10 171.26 150.79 0.05 OUTLIER 'General case' 0 C--O 1.237 0.444 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -178.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.533 ' CB ' HD23 ' A' ' 82' ' ' LEU . 96.4 m-20 -59.66 138.64 57.68 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 119.24 -0.984 . . . . 0.0 109.674 175.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.533 HD23 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.58 13.72 8.46 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.963 172.556 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . 0.495 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 7.8 t -71.86 -30.39 65.38 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.33 -173.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.545 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 28.2 p-10 . . . . . 0 C--N 1.329 -0.311 0 CA-C-O 121.52 0.676 . . . . 0.0 110.362 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.443 HD22 HG21 ' A' ' 40' ' ' THR . 3.3 mm? . . . . . 0 C--O 1.235 0.333 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.425 ' HB3' ' CG1' ' A' ' 32' ' ' VAL . 19.0 mtpp -120.95 116.39 25.02 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 119.605 -0.838 . . . . 0.0 111.075 177.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.3 m -140.13 170.09 16.48 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.577 176.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -76.84 132.2 39.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.825 -176.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.3 m -130.07 158.29 40.03 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 175.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 15.1 mmm180 . . . . . 0 C--N 1.325 -0.472 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.94 -179.052 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 45.1 mtt180 . . . . . 0 N--CA 1.448 -0.556 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.5 m -113.49 131.44 56.04 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.098 -170.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.425 ' CG1' ' HB3' ' A' ' 21' ' ' LYS . 98.7 t -73.04 105.38 2.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 174.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.5 p -94.82 149.88 20.78 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.622 0.725 . . . . 0.0 111.479 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -72.56 127.16 31.71 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 161.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -110.04 153.25 24.89 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 119.804 -0.758 . . . . 0.0 109.622 -179.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.82 164.99 11.33 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -172.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -58.21 -34.24 70.17 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.451 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.611 ' HG3' ' HG3' ' A' ' 39' ' ' GLN . 4.1 pt-20 -60.91 -38.57 86.19 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.42 0.629 . . . . 0.0 110.491 175.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.611 ' HG3' ' HG3' ' A' ' 38' ' ' GLU . 75.4 mt-30 -88.16 74.89 8.72 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.53 -174.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.443 HG21 HD22 ' A' ' 20' ' ' LEU . 0.9 OUTLIER -95.56 16.51 16.94 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.568 0.699 . . . . 0.0 110.33 177.734 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.862 ' HD3' HG23 ' A' ' 58' ' ' VAL . 0.6 OUTLIER -128.35 177.6 6.85 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.471 173.502 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.756 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.9 m -142.3 131.04 22.76 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.095 -178.225 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.486 HD23 HG22 ' A' ' 45' ' ' VAL . 0.2 OUTLIER -95.37 136.73 35.37 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.005 0.431 . . . . 0.0 110.722 -177.231 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.628 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 1.6 t80 -145.16 109.42 4.87 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.196 -0.911 . . . . 0.0 108.781 171.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.531 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 46.0 t -110.09 133.76 54.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.839 179.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.813 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 9.4 mm100 -77.81 140.82 39.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.877 0.37 . . . . 0.0 110.431 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.2 mm? -128.23 152.17 77.43 Favored Pre-proline 0 C--N 1.319 -0.759 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -70.87 -11.18 29.03 Favored 'Trans proline' 0 CA--C 1.529 0.258 0 C-N-CA 122.391 2.061 . . . . 0.0 112.622 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -135.86 -0.56 2.55 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.52 0.2 . . . . 0.0 111.434 -177.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.589 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 32.6 p -169.57 -163.92 0.41 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -175.154 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -148.5 152.45 36.9 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 177.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.628 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 74.7 mt -105.61 130.4 57.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.368 176.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -139.28 131.32 27.93 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 177.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -167.71 162.07 13.75 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 123.376 0.423 . . . . 0.0 110.706 -178.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 13.3 m -89.12 134.07 34.15 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.128 -0.629 . . . . 0.0 109.465 172.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.4 tppt? -138.46 153.05 48.81 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -176.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 10.9 p -73.62 152.12 40.63 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 119.468 -0.893 . . . . 0.0 109.154 178.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.862 HG23 ' HD3' ' A' ' 41' ' ' ARG . 50.7 t -59.19 -41.54 84.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 120.653 0.263 . . . . 0.0 111.517 -175.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.603 ' HG3' ' N ' ' A' ' 60' ' ' GLN . 12.3 pt20 -69.05 -48.0 63.92 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.663 -177.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.624 ' O ' HG11 ' A' ' 64' ' ' VAL . 0.2 OUTLIER -69.33 -37.49 77.73 Favored 'General case' 0 C--O 1.211 -0.94 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -176.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.663 ' SG ' ' HG2' ' A' ' 41' ' ' ARG . 1.9 p -61.65 -32.7 72.88 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.485 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.9 -47.19 75.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.917 0.389 . . . . 0.0 110.567 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.616 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 8.9 pt-20 -71.55 -37.76 71.07 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.9 -176.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.624 HG11 ' O ' ' A' ' 60' ' ' GLN . 12.1 m -73.59 -26.52 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 121.566 0.698 . . . . 0.0 110.479 176.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.521 HD11 ' HB1' ' A' ' 75' ' ' ALA . 50.4 tp -58.33 -49.75 76.07 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.53 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 41.7 mt-10 -74.33 -33.1 63.06 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.432 -175.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.597 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.4 pt-20 -60.31 -45.85 91.95 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 120.254 -0.578 . . . . 0.0 110.139 -179.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.585 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 35.0 m -79.9 -32.62 14.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 C-N-CA 120.743 -0.383 . . . . 0.0 111.944 -178.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.53 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 21.3 p -71.27 -26.23 62.8 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 120.394 -0.522 . . . . 0.0 110.875 -178.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.64 -22.76 61.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.488 175.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 67' ' ' GLU . 19.0 mt -83.6 -25.68 7.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.767 177.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 121.39 -0.61 11.39 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 119.858 -1.163 . . . . 0.0 112.508 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -85.93 115.27 61.1 Favored Pre-proline 0 N--CA 1.451 -0.385 0 CA-C-N 116.519 0.159 . . . . 0.0 110.863 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.813 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 33.6 Cg_exo -63.65 133.16 38.21 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.768 2.312 . . . . 0.0 111.402 174.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.521 ' HB1' HD11 ' A' ' 65' ' ' LEU . . . -146.89 163.32 36.48 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.343 -0.543 . . . . 0.0 111.59 -179.068 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.465 ' CG ' ' HB3' ' A' ' 44' ' ' PHE . 15.5 ptpt -143.99 150.11 37.77 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.638 174.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.756 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 27.7 p -139.92 98.21 3.41 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.79 0.805 . . . . 0.0 109.182 161.046 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.2 p -107.61 164.41 12.25 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.782 -178.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 7.5 p -107.93 100.77 10.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.349 0.595 . . . . 0.0 109.517 -178.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.535 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 24.8 tt0 175.13 137.64 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 -172.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.573 ' CB ' HD21 ' A' ' 82' ' ' LEU . 16.5 m-20 -62.06 139.02 58.46 Favored 'General case' 0 CA--C 1.505 -0.758 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.952 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.573 HD21 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.65 13.99 8.71 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.862 174.362 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . 0.535 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 47.4 t -71.43 -19.85 62.19 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.823 0.344 . . . . 0.0 111.59 -174.006 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.451 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 22.8 p-10 . . . . . 0 C--N 1.324 -0.509 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.596 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.6 tp . . . . . 0 CA--C 1.517 -0.289 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.413 ' O ' ' HA ' ' A' ' 81' ' ' ASP . 26.5 mttt -82.22 141.27 33.13 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.972 178.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.553 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 6.6 t -161.66 153.89 19.7 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.602 -0.439 . . . . 0.0 109.851 -178.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -81.5 128.64 34.11 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.741 -0.383 . . . . 0.0 111.208 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 42.8 m -111.0 134.46 52.58 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 174.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.529 ' HD2' ' HB3' ' A' ' 30' ' ' ARG . 22.9 mmm-85 . . . . . 0 C--N 1.329 -0.291 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.827 -177.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.529 ' HB3' ' HD2' ' A' ' 25' ' ' ARG . 2.2 ptt180 . . . . . 0 N--CA 1.453 -0.289 0 CA-C-O 120.826 0.346 . . . . 0.0 110.125 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 94.2 m -99.12 138.4 36.27 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.827 -178.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 66.0 t -72.12 106.74 2.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 172.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.0 p -118.75 148.11 43.15 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.886 0.374 . . . . 0.0 111.266 -178.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.6 t -88.0 119.99 28.91 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 175.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.73 147.05 24.75 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 -177.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.82 166.57 19.09 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -172.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -55.75 -36.54 67.39 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.51 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 39' ' ' GLN . 2.9 pt-20 -50.57 -48.31 57.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.741 175.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.653 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 36.6 mt-30 -101.1 78.54 1.92 Allowed 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.141 -176.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.67 12.62 22.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.713 -175.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.999 ' HD3' ' SG ' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -121.51 177.94 5.01 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.377 0.608 . . . . 0.0 110.142 173.908 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.552 ' HB3' ' HB3' ' A' ' 84' ' ' ASN . 66.7 m -129.22 172.83 11.07 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.123 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.569 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.4 OUTLIER -127.98 113.34 15.71 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.533 176.508 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.652 ' HD2' ' HD2' ' A' ' 76' ' ' LYS . 2.6 t80 -124.8 99.52 6.19 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 172.056 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.588 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 19.2 t -104.34 133.0 49.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.054 -0.976 . . . . 0.0 108.741 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.806 ' CG ' ' HB2' ' A' ' 74' ' ' PRO . 0.8 OUTLIER -83.42 141.04 32.0 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 120.006 -0.677 . . . . 0.0 110.001 179.592 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.676 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.7 mm? -133.62 152.02 78.24 Favored Pre-proline 0 C--N 1.317 -0.817 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.29 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -78.57 3.22 7.43 Favored 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 122.755 2.303 . . . . 0.0 111.583 171.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -124.25 -31.99 3.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.875 -176.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.676 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 11.4 p -169.36 -154.95 0.13 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.636 -173.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.79 131.83 26.23 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.409 176.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.588 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 26.5 mm -82.54 129.12 37.99 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.204 176.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.623 ' HB3' ' ND2' ' A' ' 84' ' ' ASN . 6.5 mt-30 -135.84 131.85 35.87 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -167.25 150.21 6.26 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 123.529 0.518 . . . . 0.0 109.781 -170.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.553 ' SG ' ' HB3' ' A' ' 22' ' ' CYS . 6.4 m -93.01 132.39 37.15 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 172.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.415 ' HB2' ' HE2' ' A' ' 56' ' ' LYS . 3.3 tppt? -138.94 156.22 47.43 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 119.027 -1.069 . . . . 0.0 110.686 -178.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.653 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 35.4 p -66.28 153.41 42.67 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 177.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.601 ' HA ' ' HG3' ' A' ' 41' ' ' ARG . 20.9 t -59.29 -47.58 89.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 120.997 0.427 . . . . 0.0 110.663 -175.068 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -56.94 -55.72 30.9 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.054 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.62 ' O ' HG11 ' A' ' 64' ' ' VAL . 20.6 mt-30 -68.66 -25.56 64.87 Favored 'General case' 0 C--O 1.2 -1.552 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.605 -174.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.512 ' SG ' ' HG3' ' A' ' 41' ' ' ARG . 0.6 OUTLIER -63.35 -33.88 76.51 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.115 -0.634 . . . . 0.0 109.891 178.519 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.56 -39.62 73.84 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.091 0.472 . . . . 0.0 110.225 174.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -62.46 -52.42 63.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.834 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.62 HG11 ' O ' ' A' ' 60' ' ' GLN . 16.2 m -68.71 -28.15 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.397 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.503 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 28.8 tp -58.02 -49.74 75.82 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 176.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.565 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 39.7 tt0 -73.88 -36.03 64.76 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.363 -175.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -58.24 -43.68 87.91 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.276 -177.182 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.541 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.0 m -79.7 -31.73 14.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 C-N-CA 120.48 -0.488 . . . . 0.0 111.714 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.565 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 37.7 p -72.98 -21.29 60.88 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.995 -179.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.09 -19.99 59.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.088 0.47 . . . . 0.0 110.27 176.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 10.7 mt -86.24 -15.92 9.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.334 176.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 108.9 -0.31 31.85 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.366 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -90.72 116.56 66.67 Favored Pre-proline 0 N--CA 1.448 -0.525 0 CA-C-O 120.692 0.282 . . . . 0.0 111.221 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.806 ' HB2' ' CG ' ' A' ' 46' ' ' GLN . 52.8 Cg_exo -58.24 140.66 95.13 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 123.169 2.579 . . . . 0.0 112.124 175.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.434 ' HB1' HD12 ' A' ' 65' ' ' LEU . . . -148.79 168.62 22.46 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.614 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.652 ' HD2' ' HD2' ' A' ' 44' ' ' PHE . 6.0 ptpp? -154.34 139.08 17.05 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.749 171.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 31.0 p -116.81 104.86 11.75 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 166.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.2 p -106.72 162.27 13.92 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 119.929 -0.708 . . . . 0.0 112.089 -178.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.999 ' SG ' ' HD3' ' A' ' 41' ' ' ARG . 33.6 m -109.24 101.57 10.58 Favored 'General case' 0 CA--C 1.523 -0.076 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.909 175.009 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.565 ' HB3' ' HB3' ' A' ' 83' ' ' CYS . 16.0 tt0 176.85 141.46 0.07 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -177.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.572 ' CB ' HD23 ' A' ' 82' ' ' LEU . 15.9 m-20 -58.64 129.55 42.62 Favored 'General case' 0 CA--C 1.503 -0.828 0 C-N-CA 119.641 -0.824 . . . . 0.0 110.095 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.572 HD23 ' CB ' ' A' ' 81' ' ' ASP . 0.3 OUTLIER 64.77 15.81 10.03 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.927 173.278 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . 0.565 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . 9.9 p -63.24 -22.33 66.8 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.896 0.379 . . . . 0.0 111.701 -171.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.623 ' ND2' ' HB3' ' A' ' 53' ' ' GLN . 35.9 p-10 . . . . . 0 CA--C 1.536 0.419 0 CA-C-O 121.039 0.447 . . . . 0.0 111.116 -177.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.411 ' HG ' ' N ' ' A' ' 21' ' ' LYS . 32.1 tp . . . . . 0 N--CA 1.455 -0.192 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.411 ' N ' ' HG ' ' A' ' 20' ' ' LEU . 11.5 mtpt -125.89 114.15 18.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.04 177.149 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.609 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 12.9 m -128.43 158.5 38.15 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 174.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.419 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 15.6 m-85 -72.41 120.76 18.46 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.659 -0.416 . . . . 0.0 109.971 173.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 88.2 m -111.15 142.75 42.92 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 176.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 . . . . . 0 C--N 1.324 -0.524 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.883 -177.647 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 . . . . . 0 N--CA 1.456 -0.17 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 p -129.48 169.33 15.09 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.565 -178.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 53.8 t -72.11 121.24 22.01 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.408 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.2 p -123.14 132.59 54.13 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 119.994 -0.683 . . . . 0.0 110.674 174.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 t -76.42 113.97 14.6 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 170.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.76 170.23 11.4 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.878 -170.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.42 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -66.81 166.35 13.43 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.502 -179.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.06 -19.94 56.46 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.723 -166.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.42 ' OE2' ' HB3' ' A' ' 36' ' ' ALA . 3.2 pm0 -81.96 -22.85 36.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.284 0.564 . . . . 0.0 109.611 176.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.424 ' OE1' ' HB2' ' A' ' 55' ' ' CYS . 8.3 mt-30 -72.89 121.55 20.2 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.193 176.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.53 ' OG1' HG23 ' A' ' 58' ' ' VAL . 0.5 OUTLIER -134.51 4.83 3.41 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.327 -0.852 . . . . 0.0 111.597 -170.39 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.76 ' CG ' ' HA ' ' A' ' 58' ' ' VAL . 6.1 mmm180 -138.49 178.48 7.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.633 0.73 . . . . 0.0 110.09 175.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.517 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 8.8 m -132.36 131.5 41.94 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 114.437 -1.256 . . . . 0.0 109.044 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.2 OUTLIER -91.75 130.44 37.54 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 121.031 -0.267 . . . . 0.0 110.306 179.504 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.781 ' HD2' ' HG3' ' A' ' 76' ' ' LYS . 57.1 t80 -128.45 100.9 5.96 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.28 170.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.586 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 16.8 t -99.44 129.95 49.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 174.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.888 ' HB3' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -99.04 116.77 32.04 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.197 -178.541 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.604 ' HB2' ' O ' ' A' ' 50' ' ' SER . 1.8 mm? -114.94 156.93 44.5 Favored Pre-proline 0 C--N 1.327 -0.38 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 -176.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -75.49 18.98 0.55 Allowed 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 122.877 2.385 . . . . 0.0 112.391 175.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -136.55 -55.75 0.74 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.517 0.675 . . . . 0.0 109.44 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.604 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 41.5 p -148.26 -162.58 1.58 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.968 -1.015 . . . . 0.0 108.283 176.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.464 ' HA ' HD23 ' A' ' 47' ' ' LEU . 2.3 mp0 -131.14 147.32 52.59 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 118.434 -1.306 . . . . 0.0 110.9 177.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.586 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 52.0 mm -93.77 132.11 38.83 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.909 176.014 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.478 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 14.9 mt-30 -141.67 130.88 23.45 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 120.04 -0.664 . . . . 0.0 109.406 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.439 ' CD ' ' HZ2' ' A' ' 56' ' ' LYS . 2.6 pt-20 -163.03 153.87 16.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.245 -176.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.718 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 79.1 m -82.04 125.22 30.56 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.294 169.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.718 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 11.3 mptt -132.71 -179.17 5.3 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 173.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.419 HG22 ' HG2' ' A' ' 38' ' ' GLU . 16.1 p -86.06 169.05 13.52 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 119.274 -0.971 . . . . 0.0 108.744 177.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.76 ' HA ' ' CG ' ' A' ' 41' ' ' ARG . 66.8 t -61.16 -50.25 81.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 C-N-CA 119.583 -0.847 . . . . 0.0 110.102 178.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -56.53 -54.37 46.61 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.863 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.549 ' HA ' ' OE1' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -58.91 -34.91 72.24 Favored 'General case' 0 C--O 1.204 -1.326 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.964 -177.637 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.542 ' HA ' ' CG2' ' A' ' 64' ' ' VAL . 0.5 OUTLIER -68.22 -34.21 75.82 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.055 -175.921 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.71 -35.8 67.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.347 0.594 . . . . 0.0 109.611 176.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.549 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 74.8 mt-10 -65.91 -52.02 53.64 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.814 -1.084 . . . . 0.0 110.943 178.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.598 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 33.4 m -68.44 -28.7 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.54 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.277 178.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.466 HD11 ' HB1' ' A' ' 75' ' ' ALA . 46.5 tp -58.03 -50.9 71.83 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 176.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.563 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 40.8 tt0 -74.2 -33.88 63.55 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.183 -174.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.598 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -60.19 -44.61 94.95 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.313 -177.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.536 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 28.4 m -80.37 -28.42 11.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.938 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.563 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 31.0 p -75.48 -22.47 57.19 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.842 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.15 -18.43 61.88 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.184 0.516 . . . . 0.0 110.285 176.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 19.2 mt -86.37 -18.34 8.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.504 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 107.67 3.76 34.61 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.182 -1.008 . . . . 0.0 112.498 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -90.24 134.11 32.02 Favored Pre-proline 0 N--CA 1.447 -0.603 0 CA-C-O 120.808 0.337 . . . . 0.0 111.478 -178.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.888 ' HB2' ' HB3' ' A' ' 46' ' ' GLN . 79.7 Cg_exo -56.17 130.79 42.06 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.598 2.865 . . . . 0.0 112.054 173.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.508 ' C ' ' HG2' ' A' ' 76' ' ' LYS . . . -149.16 156.63 42.46 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.711 -0.796 . . . . 0.0 111.861 179.166 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.781 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -153.85 155.52 35.91 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.243 174.943 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.517 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 26.9 p -137.46 115.72 11.79 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.627 0.727 . . . . 0.0 109.901 166.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.1 p -108.17 172.48 6.81 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.891 -176.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.431 ' HB2' ' CD ' ' A' ' 41' ' ' ARG . 52.9 t -131.14 100.97 5.39 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.13 178.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.578 ' HB3' ' HB3' ' A' ' 83' ' ' CYS . 14.1 tt0 174.81 148.73 0.08 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 -175.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.525 ' CB ' HD23 ' A' ' 82' ' ' LEU . 1.0 OUTLIER -55.93 124.02 16.27 Favored 'General case' 0 CA--C 1.509 -0.598 0 C-N-CA 119.805 -0.758 . . . . 0.0 110.365 179.079 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.62 HD11 ' N ' ' A' ' 82' ' ' LEU . 0.1 OUTLIER 66.02 16.06 10.31 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.752 169.713 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . 0.578 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . 21.3 p -64.53 -29.57 70.6 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -171.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.452 ' ND2' ' HB3' ' A' ' 53' ' ' GLN . 29.5 p-10 . . . . . 0 C--N 1.329 -0.286 0 CA-C-O 121.17 0.51 . . . . 0.0 110.773 -178.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.6 tp . . . . . 0 N--CA 1.453 -0.308 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.529 ' HE2' HG13 ' A' ' 32' ' ' VAL . 36.6 mtpt -107.0 104.36 14.01 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 118.867 -1.133 . . . . 0.0 111.685 -177.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.5 m -103.47 152.46 21.63 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 176.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.494 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 58.5 m-85 -71.65 149.67 45.34 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.565 176.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -121.29 132.03 54.55 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.052 172.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 . . . . . 0 C--N 1.323 -0.58 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.574 -175.383 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 30' ' ' ARG . 8.7 ptp180 . . . . . 0 N--CA 1.441 -0.878 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.9 m -93.98 127.95 40.04 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.645 -172.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.529 HG13 ' HE2' ' A' ' 21' ' ' LYS . 25.0 t -75.93 104.02 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 176.186 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.425 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 1.3 p -115.82 149.24 38.9 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.652 -174.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.7 t -90.4 136.43 33.06 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.851 178.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -127.37 148.85 50.26 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 -178.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.528 ' HB2' ' OE2' ' A' ' 38' ' ' GLU . . . -82.89 -176.75 6.47 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -168.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.36 -43.83 92.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.597 -1.183 . . . . 0.0 112.715 -173.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.601 ' OE2' ' HG3' ' A' ' 39' ' ' GLN . 4.2 pm0 -62.63 -24.47 67.61 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.019 0.438 . . . . 0.0 110.027 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.715 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 37.4 mt-30 -110.1 52.39 0.73 Allowed 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.876 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -79.85 25.64 0.35 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.145 0.498 . . . . 0.0 111.445 178.031 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.721 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 16.1 mmt85 -131.34 179.52 5.98 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.752 172.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.716 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 62.7 m -142.95 131.49 22.4 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.625 -174.008 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.414 HD23 ' SG ' ' A' ' 61' ' ' CYS . 0.5 OUTLIER -100.39 127.68 46.64 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.983 0.421 . . . . 0.0 111.103 -175.697 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.645 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 40.7 t80 -142.35 115.6 8.92 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.588 174.097 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.426 ' HA ' ' HA ' ' A' ' 75' ' ' ALA . 58.2 t -105.92 138.04 33.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 C-N-CA 120.452 -0.499 . . . . 0.0 109.895 179.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.744 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 7.4 mm100 -74.93 137.45 41.67 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 120.094 -0.642 . . . . 0.0 109.944 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.511 ' HB2' ' C ' ' A' ' 50' ' ' SER . 3.3 mm? -131.85 143.13 47.79 Favored Pre-proline 0 C--N 1.312 -1.03 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.015 171.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 12.0 Cg_exo -72.12 -3.33 13.09 Favored 'Trans proline' 0 CA--C 1.529 0.254 0 C-N-CA 122.836 2.357 . . . . 0.0 112.776 -179.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 28.4 p90 -149.65 5.91 0.62 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.951 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.511 ' C ' ' HB2' ' A' ' 47' ' ' LEU . 66.8 m -161.67 -162.09 0.84 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -176.193 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -163.8 147.34 10.01 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 174.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.645 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 67.5 mt -106.07 136.85 38.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 177.722 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -146.83 129.9 16.42 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -177.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.536 ' HG3' ' HE2' ' A' ' 56' ' ' LYS . 7.0 pt-20 -179.26 157.26 0.8 Allowed 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.558 0.536 . . . . 0.0 109.965 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 2.8 m -81.34 141.4 34.06 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 119.809 -0.756 . . . . 0.0 109.121 175.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.536 ' HE2' ' HG3' ' A' ' 54' ' ' GLU . 69.6 mmtt -135.87 155.09 50.85 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.715 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 27.7 p -68.83 146.09 53.16 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 118.697 -1.201 . . . . 0.0 108.792 176.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.546 HG21 ' HG2' ' A' ' 41' ' ' ARG . 29.8 t -46.37 -54.73 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 O-C-N 123.461 0.476 . . . . 0.0 111.377 -173.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -63.09 -55.85 21.89 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.586 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.76 ' O ' HG12 ' A' ' 64' ' ' VAL . 99.1 mt-30 -64.51 -26.58 68.49 Favored 'General case' 0 C--O 1.204 -1.317 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.495 -174.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.537 ' HA ' HG21 ' A' ' 64' ' ' VAL . 8.7 t -71.77 -33.63 68.78 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 177.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.07 -34.5 73.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.085 0.469 . . . . 0.0 109.867 172.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -64.97 -51.24 62.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.664 176.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.76 HG12 ' O ' ' A' ' 60' ' ' GLN . 14.1 m -67.49 -27.06 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.251 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.499 HD12 ' HB2' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.48 -49.26 76.86 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 173.443 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -73.33 -34.16 65.53 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.144 -174.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.9 pt-20 -60.15 -42.15 94.3 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 120.034 -0.667 . . . . 0.0 110.068 -178.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.503 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.5 m -79.91 -36.67 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 CA-C-O 120.779 0.323 . . . . 0.0 111.796 179.193 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 96.0 m -71.98 -29.46 64.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.206 -175.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.94 -23.75 64.19 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.562 174.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.514 HG13 ' O ' ' A' ' 67' ' ' GLU . 18.6 mt -79.11 -26.02 13.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.323 0.582 . . . . 0.0 109.739 176.388 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.468 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 114.25 2.11 23.33 Favored Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 119.838 -1.172 . . . . 0.0 112.035 -177.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -96.03 107.31 33.89 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-O 120.555 0.217 . . . . 0.0 110.602 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.744 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 77.8 Cg_exo -56.74 134.65 65.82 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 123.257 2.638 . . . . 0.0 112.979 178.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.499 ' HB2' HD12 ' A' ' 65' ' ' LEU . . . -130.79 161.25 32.15 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.847 174.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -130.05 140.06 50.9 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.533 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.721 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 6.1 t -150.72 109.65 3.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.137 0.494 . . . . 0.0 109.793 173.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.3 p -136.43 172.3 13.22 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.321 -171.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.575 ' SG ' ' HD3' ' A' ' 41' ' ' ARG . 55.7 m -107.88 101.9 11.14 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.074 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.505 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 7.5 tp10 179.06 142.15 0.12 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -176.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.557 ' CB ' HD21 ' A' ' 82' ' ' LEU . 43.7 m-20 -62.9 137.95 58.41 Favored 'General case' 0 CA--C 1.505 -0.776 0 C-N-CA 118.278 -1.369 . . . . 0.0 109.349 177.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.557 HD21 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 62.68 21.75 12.92 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.902 175.292 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . 0.505 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 6.4 t -69.62 -31.17 69.14 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.68 -174.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.585 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 28.7 p-10 . . . . . 0 C--N 1.328 -0.35 0 CA-C-O 122.202 1.001 . . . . 0.0 108.909 174.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 35.6 tp . . . . . 0 N--CA 1.454 -0.264 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.503 ' HG2' ' HB ' ' A' ' 34' ' ' THR . 33.4 mtmm -102.25 114.24 28.23 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.021 -178.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 18.0 m -113.46 173.42 6.42 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.603 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 46.2 m-85 -82.95 136.08 34.67 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 173.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.7 p -116.24 130.53 56.83 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 173.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.8 tpt180 . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.536 -176.562 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.406 ' HB3' ' OE1' ' A' ' 53' ' ' GLN . 30.2 ptt180 . . . . . 0 N--CA 1.447 -0.592 0 CA-C-O 121.466 0.65 . . . . 0.0 109.749 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -113.09 146.72 38.68 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.929 -173.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.404 HG13 HD12 ' A' ' 82' ' ' LEU . 94.4 t -80.96 108.11 13.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.029 175.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.1 p -119.4 148.37 43.29 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.853 0.359 . . . . 0.0 110.271 176.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.503 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 3.1 t -91.63 115.59 28.17 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.094 -0.642 . . . . 0.0 109.87 177.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -87.98 160.44 17.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.41 -0.813 . . . . 0.0 109.186 -176.74 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.574 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -74.89 -179.19 4.1 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.243 -0.583 . . . . 0.0 112.423 -169.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -63.83 -37.26 86.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.377 -172.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.574 ' OE2' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -76.11 -25.84 55.81 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.254 -174.028 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.6 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 40.4 mt-30 -98.24 80.68 2.69 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.366 0.603 . . . . 0.0 110.392 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.54 21.29 9.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.261 -0.882 . . . . 0.0 112.103 -176.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.787 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 15.8 mmt85 -126.82 179.69 5.25 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 119.956 -0.698 . . . . 0.0 109.947 171.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.692 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 63.8 m -139.73 131.88 28.09 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.54 -173.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.488 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 1.0 OUTLIER -103.69 130.64 51.2 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.673 0.273 . . . . 0.0 111.081 -171.899 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.71 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 1.2 t80 -146.75 104.05 3.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.331 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.563 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 46.3 t -102.48 136.14 36.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.922 178.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.787 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 10.5 mm100 -76.59 140.24 40.97 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.962 0.41 . . . . 0.0 110.791 -178.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.509 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.0 mm? -132.09 153.95 81.51 Favored Pre-proline 0 C--N 1.321 -0.656 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 174.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -74.63 18.17 0.52 Allowed 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 122.941 2.427 . . . . 0.0 113.018 179.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -160.46 -48.31 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.929 0.395 . . . . 0.0 110.634 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.509 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 20.5 m -120.55 -153.17 0.53 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.74 178.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -155.64 144.61 20.63 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.71 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 69.1 mt -89.84 128.95 41.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.381 -0.527 . . . . 0.0 109.761 176.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.488 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 49.0 mt-30 -139.48 131.53 27.94 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -177.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.874 ' HG2' ' HE2' ' A' ' 56' ' ' LYS . 1.1 tp10 -170.42 153.89 4.51 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -168.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 4.9 m -93.17 128.41 39.11 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 119.689 -0.805 . . . . 0.0 108.895 173.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.874 ' HE2' ' HG2' ' A' ' 54' ' ' GLU . 57.8 mmtt -131.12 147.65 52.64 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.6 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 46.0 p -62.8 153.67 32.25 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 174.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.581 ' HA ' ' HG3' ' A' ' 41' ' ' ARG . 40.9 t -49.67 -48.15 21.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 123.238 0.336 . . . . 0.0 110.87 -176.184 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -65.83 -56.11 13.57 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.464 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.698 ' O ' HG12 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -58.43 -34.12 70.45 Favored 'General case' 0 C--O 1.21 -0.995 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.803 -175.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.54 ' HA ' HG22 ' A' ' 64' ' ' VAL . 4.3 t -72.6 -33.4 66.68 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.613 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.85 -36.76 73.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.276 0.56 . . . . 0.0 109.698 173.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.563 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 92.6 mt-10 -59.99 -52.8 63.83 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.459 175.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.698 HG12 ' O ' ' A' ' 60' ' ' GLN . 17.9 m -70.38 -27.41 31.56 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.618 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.615 -178.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.517 HD12 ' HB3' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -59.3 -50.63 73.24 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 175.847 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -73.85 -33.28 64.04 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.944 -173.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.592 ' O ' HG13 ' A' ' 71' ' ' ILE . 11.9 pt-20 -60.28 -43.31 96.35 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.097 -179.234 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.51 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.0 m -79.76 -35.86 16.77 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.738 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 99.4 m -71.84 -27.71 63.07 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.983 -176.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.18 -23.52 61.28 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.484 173.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.592 HG13 ' O ' ' A' ' 67' ' ' GLU . 43.6 mt -78.21 -32.49 17.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.342 0.592 . . . . 0.0 109.971 177.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.465 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 121.0 2.34 11.19 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.21 -0.995 . . . . 0.0 111.757 -176.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -97.86 106.61 35.18 Favored Pre-proline 0 N--CA 1.448 -0.53 0 CA-C-O 120.629 0.252 . . . . 0.0 110.824 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.787 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 79.2 Cg_exo -54.61 133.83 58.98 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 123.183 2.589 . . . . 0.0 112.846 177.219 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.517 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -130.49 157.13 43.5 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.234 -0.587 . . . . 0.0 110.937 174.248 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.1 mmtp -128.69 143.09 50.86 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.535 -179.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.787 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 8.4 t -156.27 112.29 3.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.919 0.39 . . . . 0.0 110.392 176.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 3.8 p -143.77 173.28 11.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.002 -174.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.574 ' SG ' ' HD3' ' A' ' 41' ' ' ARG . 57.6 m -108.07 104.09 13.45 Favored 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.514 -175.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.469 ' HG3' ' HB2' ' A' ' 83' ' ' CYS . 0.0 OUTLIER 177.22 161.72 0.46 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 173.557 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.539 ' C ' HD23 ' A' ' 82' ' ' LEU . 56.7 m-20 -68.22 135.24 51.7 Favored 'General case' 0 CA--C 1.501 -0.915 0 C-N-CA 117.023 -1.871 . . . . 0.0 109.558 -179.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.603 ' HB3' ' CE2' ' A' ' 23' ' ' PHE . 0.2 OUTLIER 63.9 22.21 12.92 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.626 175.364 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . 0.469 ' HB2' ' HG3' ' A' ' 80' ' ' GLU . 4.3 t -64.5 -27.61 69.09 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.891 0.377 . . . . 0.0 111.049 -174.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.597 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 27.7 p-10 . . . . . 0 C--N 1.328 -0.354 0 CA-C-O 122.419 1.104 . . . . 0.0 108.677 172.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.592 HD21 ' H ' ' A' ' 80' ' ' GLU . 21.8 tp . . . . . 0 N--CA 1.452 -0.359 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.582 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 28.8 mtmm -82.67 114.76 21.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.267 0.556 . . . . 0.0 111.403 -175.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.7 m -113.27 162.57 15.87 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.794 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.41 ' HE1' ' HB3' ' A' ' 82' ' ' LEU . 34.7 m-85 -79.33 138.87 37.88 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.618 176.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 32.2 m -129.0 131.83 47.46 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.3 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.697 HH11 ' HB2' ' A' ' 51' ' ' GLU . 30.8 mtp180 . . . . . 0 C--N 1.329 -0.321 0 C-N-CA 119.923 -0.711 . . . . 0.0 111.749 -176.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 . . . . . 0 N--CA 1.445 -0.684 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.5 m -100.63 145.15 28.75 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.731 -175.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 96.8 t -72.46 106.93 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 31.2 p -104.26 137.4 42.23 Favored 'General case' 0 C--N 1.314 -0.955 0 C-N-CA 120.069 -0.652 . . . . 0.0 110.346 175.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.582 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.7 t -86.37 111.99 21.03 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 121.634 0.73 . . . . 0.0 109.404 176.14 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -89.28 172.88 8.72 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.089 -173.017 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.89 166.35 20.98 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.291 -0.564 . . . . 0.0 111.147 -175.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -51.98 -26.98 11.8 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.37 176.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.483 ' HG2' ' CG2' ' A' ' 57' ' ' THR . 27.6 tt0 -62.62 -39.68 94.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.012 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.461 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 16.5 mm-40 -82.04 100.66 9.86 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 118.904 -1.118 . . . . 0.0 109.675 -178.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.414 ' OG1' HG22 ' A' ' 58' ' ' VAL . 0.7 OUTLIER -101.58 21.71 13.9 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.591 0.71 . . . . 0.0 110.04 175.537 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.88 ' HG3' ' HB2' ' A' ' 77' ' ' CYS . 1.2 tpt180 -152.4 177.76 10.26 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.741 -176.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.592 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 79.4 m -141.34 131.88 25.41 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 179.537 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.412 HD22 HG22 ' A' ' 45' ' ' VAL . 0.3 OUTLIER -94.93 130.47 41.55 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 -178.881 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.488 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 18.6 t80 -139.54 113.51 8.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.86 170.318 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.617 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 22.0 t -108.72 133.84 52.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 176.634 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.873 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -90.03 132.36 35.42 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 119.397 -0.921 . . . . 0.0 110.455 177.296 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.5 mm? -121.06 152.03 56.12 Favored Pre-proline 0 C--N 1.319 -0.739 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -66.51 -17.25 53.04 Favored 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.46 2.106 . . . . 0.0 112.713 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -134.93 -2.43 2.6 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.526 -177.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.598 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 49.1 m -157.97 -168.61 2.56 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.188 -174.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.697 ' HB2' HH11 ' A' ' 25' ' ' ARG . 18.4 mt-10 -147.01 148.06 31.31 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 176.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.617 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 26.8 mm -109.28 129.18 64.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 175.484 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -140.93 130.27 23.7 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.171 -0.612 . . . . 0.0 110.203 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.426 ' CD ' ' HZ2' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -162.11 158.03 24.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.661 -179.328 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.488 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 8.3 m -80.42 118.34 21.96 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 166.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.488 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 12.1 mptt -124.25 147.88 47.76 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.605 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.483 ' CG2' ' HG2' ' A' ' 38' ' ' GLU . 18.2 p -68.34 164.3 21.14 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.414 HG22 ' OG1' ' A' ' 40' ' ' THR . 57.8 t -59.1 -43.27 88.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 119.261 -0.976 . . . . 0.0 110.33 177.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -64.09 -54.57 31.86 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.748 179.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.644 ' O ' HG12 ' A' ' 64' ' ' VAL . 33.6 tt0 -61.58 -32.8 72.91 Favored 'General case' 0 C--O 1.206 -1.219 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.247 -174.37 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.687 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 0.6 OUTLIER -66.12 -33.42 75.74 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.13 -0.628 . . . . 0.0 110.18 178.845 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.91 -41.54 74.55 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.043 0.449 . . . . 0.0 109.943 174.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.538 ' OE2' ' HA ' ' A' ' 60' ' ' GLN . 44.9 mt-10 -56.53 -53.34 58.65 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.545 176.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.644 HG12 ' O ' ' A' ' 60' ' ' GLN . 15.3 m -73.77 -27.63 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.656 0 CA-C-N 114.659 -1.155 . . . . 0.0 111.693 -176.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.687 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 6.7 tp -59.78 -50.5 73.58 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 179.144 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -74.72 -34.99 62.67 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.465 -0.788 . . . . 0.0 112.218 -176.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.602 ' HG3' ' N ' ' A' ' 68' ' ' VAL . 11.4 pt-20 -58.0 -47.27 83.52 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.529 -177.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.602 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 33.4 m -80.54 -34.13 14.2 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.833 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 32.5 m -72.16 -23.89 61.35 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 120.606 -0.438 . . . . 0.0 111.157 -177.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.39 -21.35 62.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.119 0.485 . . . . 0.0 110.099 174.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 67' ' ' GLU . 12.2 mt -86.99 -19.2 8.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.542 176.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 111.18 12.57 15.25 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.09 -1.052 . . . . 0.0 112.362 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -98.65 118.66 62.8 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 120.911 0.386 . . . . 0.0 111.289 -178.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.873 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 46.4 Cg_exo -64.23 123.3 11.62 Favored 'Trans proline' 0 CA--C 1.519 -0.232 0 C-N-CA 123.585 2.857 . . . . 0.0 112.569 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -135.59 155.76 49.95 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 120.481 -0.487 . . . . 0.0 111.509 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.473 ' HD3' HE22 ' A' ' 46' ' ' GLN . 0.0 OUTLIER -139.75 152.06 46.31 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.348 0.594 . . . . 0.0 111.278 172.977 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.88 ' HB2' ' HG3' ' A' ' 41' ' ' ARG . 2.6 p -129.73 115.89 17.97 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.695 161.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.6 p -106.56 159.01 16.5 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.798 176.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.436 ' SG ' ' CD ' ' A' ' 41' ' ' ARG . 28.2 m -108.81 101.17 10.3 Favored 'General case' 0 CA--C 1.521 -0.135 0 C-N-CA 120.282 -0.567 . . . . 0.0 109.7 177.17 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.592 ' H ' HD21 ' A' ' 20' ' ' LEU . 9.0 tp10 173.74 144.16 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.557 ' CB ' HD21 ' A' ' 82' ' ' LEU . 58.5 m-20 -60.14 139.73 57.34 Favored 'General case' 0 CA--C 1.511 -0.519 0 C-N-CA 118.937 -1.105 . . . . 0.0 109.614 177.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.557 HD21 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 66.73 13.88 9.55 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.51 170.9 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . 0.485 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . 9.2 p -77.91 -32.33 51.64 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.268 -173.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.524 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 22.1 p-10 . . . . . 0 N--CA 1.465 0.285 0 CA-C-O 120.935 0.397 . . . . 0.0 111.157 -174.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.0 tp . . . . . 0 N--CA 1.453 -0.313 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.467 ' O ' HD12 ' A' ' 82' ' ' LEU . 9.4 mtmp? -113.45 109.12 18.16 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 119.643 -0.823 . . . . 0.0 111.056 175.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 19.6 m -112.29 154.67 25.3 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 175.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.562 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 11.6 m-85 -70.48 134.11 47.44 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.825 -0.75 . . . . 0.0 109.93 175.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.5 m -132.07 129.33 39.85 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.218 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.763 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 1.9 mtt-85 . . . . . 0 C--N 1.327 -0.379 0 C-N-CA 119.579 -0.848 . . . . 0.0 109.747 175.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.763 ' HG3' ' HG3' ' A' ' 25' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.483 HG21 HG23 ' A' ' 33' ' ' THR . 12.2 t -127.53 162.75 25.69 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 169.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 48.7 t -74.6 106.26 4.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.289 -0.564 . . . . 0.0 109.836 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.483 HG23 HG21 ' A' ' 31' ' ' THR . 27.1 p -115.69 147.78 40.47 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.152 0.501 . . . . 0.0 111.389 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.4 t -105.37 126.75 52.47 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.4 176.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 5.4 p -91.65 176.63 6.47 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 177.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.29 -176.81 6.3 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.154 -0.618 . . . . 0.0 111.793 -172.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 -61.66 -32.28 72.44 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -172.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.426 ' HG2' HG21 ' A' ' 57' ' ' THR . 10.2 pm0 -77.21 -23.32 51.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.834 0.349 . . . . 0.0 111.176 -176.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.571 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 69.0 mt-30 -92.93 109.06 20.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.141 0.496 . . . . 0.0 110.152 -178.353 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.34 5.16 10.22 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.768 -174.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.564 ' HG3' ' HA ' ' A' ' 58' ' ' VAL . 10.0 mmm180 -130.44 -179.68 5.41 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-O 121.617 0.722 . . . . 0.0 110.032 174.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.558 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 40.4 m -126.51 150.33 48.82 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.245 -177.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.493 ' HB2' ' CG ' ' A' ' 56' ' ' LYS . 0.2 OUTLIER -109.01 122.34 47.05 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.87 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.575 ' HB2' ' HB2' ' A' ' 84' ' ' ASN . 52.6 t80 -131.93 117.95 19.14 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.015 175.059 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.523 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 42.2 t -116.46 130.02 71.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 177.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.798 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 2.6 mm100 -75.63 141.25 42.86 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 119.73 -0.788 . . . . 0.0 109.932 178.442 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.491 HD23 HG12 ' A' ' 52' ' ' ILE . 2.5 mm? -138.86 155.82 72.96 Favored Pre-proline 0 C--N 1.318 -0.785 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 172.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -85.82 11.27 3.38 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.494 2.129 . . . . 0.0 111.37 171.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -128.38 -64.56 0.94 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.877 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.457 ' O ' HD21 ' A' ' 47' ' ' LEU . 20.6 t -152.94 132.22 12.79 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 177.006 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.4 ' HA ' HD21 ' A' ' 47' ' ' LEU . 0.9 OUTLIER -77.11 148.63 35.93 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.425 -173.783 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.523 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 38.5 mm -88.65 131.69 35.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.176 177.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.568 ' OE1' ' HD3' ' A' ' 30' ' ' ARG . 17.4 mt-30 -144.57 130.39 19.22 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.344 -0.543 . . . . 0.0 110.166 -178.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.406 ' HG3' ' HE2' ' A' ' 56' ' ' LYS . 10.7 pt-20 -175.79 170.74 2.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.423 -178.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.471 ' HB3' ' OE1' ' A' ' 39' ' ' GLN . 8.1 t -92.33 148.92 21.75 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 119.665 -0.814 . . . . 0.0 109.699 177.179 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.493 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 56.6 mmtt -142.08 162.41 35.53 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 176.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 29.3 p -72.34 160.32 32.56 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 172.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.564 ' HA ' ' HG3' ' A' ' 41' ' ' ARG . 22.0 t -59.12 -39.38 78.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 C-N-CA 120.029 -0.669 . . . . 0.0 109.637 -179.396 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.47 ' O ' ' HG3' ' A' ' 63' ' ' GLU . 41.3 tp60 -62.53 -56.12 20.99 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.697 177.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.58 ' O ' HG11 ' A' ' 64' ' ' VAL . 34.8 tt0 -69.75 -30.93 68.63 Favored 'General case' 0 C--O 1.203 -1.351 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.633 -173.097 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.484 ' HA ' ' CG2' ' A' ' 64' ' ' VAL . 2.7 p -65.15 -33.21 75.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 179.111 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.29 -45.87 65.46 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 173.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.538 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 75.7 mt-10 -54.91 -52.32 63.28 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.294 178.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.587 ' HA ' ' OE1' ' A' ' 67' ' ' GLU . 27.6 m -68.98 -30.42 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.528 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.481 -177.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.401 ' CD1' ' HB3' ' A' ' 75' ' ' ALA . 6.5 tp -62.59 -49.61 74.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.46 174.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -74.2 -31.44 62.64 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -176.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.587 ' OE1' ' HA ' ' A' ' 64' ' ' VAL . 11.6 pt-20 -63.35 -45.61 90.43 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.38 -177.006 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.559 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 29.3 m -79.34 -31.8 14.55 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 C-N-CA 120.279 -0.568 . . . . 0.0 111.335 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 85.5 m -66.41 -31.37 72.09 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 120.935 0.398 . . . . 0.0 110.484 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.0 -23.95 65.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.612 176.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 67' ' ' GLU . 16.0 mt -86.43 -20.63 7.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.959 178.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 114.95 -4.21 22.53 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.094 -1.05 . . . . 0.0 112.362 -178.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -91.91 114.71 62.9 Favored Pre-proline 0 N--CA 1.448 -0.554 0 CA-C-O 120.658 0.266 . . . . 0.0 110.926 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.798 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 51.6 Cg_exo -59.25 128.8 28.81 Favored 'Trans proline' 0 C--O 1.232 0.212 0 C-N-CA 123.177 2.585 . . . . 0.0 113.09 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.469 ' C ' ' HG2' ' A' ' 76' ' ' LYS . . . -126.53 165.56 18.9 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.451 173.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.563 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 0.9 OUTLIER -145.71 118.66 8.75 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.118 -178.115 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.558 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 1.4 t -104.31 106.79 17.42 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.248 0.547 . . . . 0.0 110.078 171.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 54.0 t -110.91 160.86 16.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.226 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.537 ' HB2' ' HD2' ' A' ' 41' ' ' ARG . 36.3 t -125.84 100.09 6.24 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 175.501 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.576 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 3.5 tm-20 171.53 149.79 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 105.681 -1.97 . . . . 0.0 105.681 -173.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.554 ' C ' HD23 ' A' ' 82' ' ' LEU . 35.3 m-20 -65.38 135.43 55.26 Favored 'General case' 0 CA--C 1.504 -0.793 0 C-N-CA 117.368 -1.733 . . . . 0.0 110.9 -172.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.562 ' HB3' ' CE2' ' A' ' 23' ' ' PHE . 0.2 OUTLIER 65.82 1.95 2.0 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.839 173.603 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . 0.576 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 16.9 t -54.94 -18.71 5.34 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -167.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.575 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 27.9 p-10 . . . . . 0 C--N 1.321 -0.661 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.469 175.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 55.5 tp . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 34' ' ' THR . 30.8 mtmm -89.46 139.04 30.92 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.986 -179.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.532 ' HA ' HD23 ' A' ' 82' ' ' LEU . 2.7 m -152.9 166.72 31.44 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.591 173.043 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -76.36 121.61 23.26 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.384 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 54' ' ' GLU . 67.6 m -115.26 144.0 44.4 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 174.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.487 HH12 ' CD ' ' A' ' 51' ' ' GLU . 3.5 tpt180 . . . . . 0 C--N 1.325 -0.475 0 CA-C-O 120.89 0.376 . . . . 0.0 111.12 -174.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.599 ' HD2' ' OE1' ' A' ' 53' ' ' GLN . 69.3 mtm180 . . . . . 0 CA--C 1.512 -0.51 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.5 m -108.36 138.49 44.57 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.535 -169.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.728 HG11 HD22 ' A' ' 82' ' ' LEU . 94.3 t -74.52 106.09 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 173.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.416 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 42.8 p -113.79 143.14 45.14 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.915 -178.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.9 t -93.05 111.95 23.75 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 175.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 37.0 m -108.0 155.99 19.73 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.742 -173.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.593 ' HB2' ' HG2' ' A' ' 38' ' ' GLU . . . -74.99 172.06 12.98 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -166.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -57.94 -27.44 63.39 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.419 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.593 ' HG2' ' HB2' ' A' ' 36' ' ' ALA . 4.8 pt-20 -52.47 -45.03 65.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.365 0.603 . . . . 0.0 110.203 173.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.629 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 41.9 mt-30 -102.44 72.78 1.28 Allowed 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.843 -177.242 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.11 9.73 18.94 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.318 -177.657 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.527 ' HB2' ' HA ' ' A' ' 58' ' ' VAL . 2.4 tpt180 -123.8 174.89 7.22 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 173.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.717 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 57.9 m -142.08 131.67 23.95 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 120.516 -0.474 . . . . 0.0 109.765 -175.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.544 HD22 HG23 ' A' ' 45' ' ' VAL . 0.3 OUTLIER -91.14 131.39 36.73 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.84 -174.985 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.762 ' HD2' ' HG3' ' A' ' 76' ' ' LYS . 77.8 t80 -138.28 121.15 16.52 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.367 169.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.578 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 30.1 t -122.43 141.75 41.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.384 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.716 ' CG ' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -81.41 142.51 32.91 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 176.193 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.541 HD21 ' C ' ' A' ' 46' ' ' GLN . 4.2 mm? -129.93 153.38 80.96 Favored Pre-proline 0 C--N 1.318 -0.792 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 174.291 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -72.18 18.39 0.32 Allowed 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 123.0 2.467 . . . . 0.0 113.154 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 28.9 p90 -168.87 -22.41 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.906 0.384 . . . . 0.0 110.797 -177.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.53 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 33.8 p -144.59 -157.4 0.78 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.34 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.487 ' CD ' HH12 ' A' ' 25' ' ' ARG . 0.0 OUTLIER -151.53 157.37 42.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.882 0.373 . . . . 0.0 110.945 176.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.578 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 29.1 mm -105.26 134.16 47.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.658 177.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.599 ' OE1' ' HD2' ' A' ' 30' ' ' ARG . 36.7 mt-30 -140.95 131.71 25.77 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.866 174.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.523 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 8.0 pt-20 -169.36 160.92 9.68 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.325 0.391 . . . . 0.0 110.842 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.418 ' O ' ' HE2' ' A' ' 56' ' ' LYS . 80.6 m -80.36 145.41 32.06 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 169.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.418 ' HE2' ' O ' ' A' ' 55' ' ' CYS . 4.6 tppt? -152.16 148.65 27.87 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.397 -0.521 . . . . 0.0 109.778 178.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.629 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 31.7 p -67.46 142.71 56.55 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.179 -0.608 . . . . 0.0 109.518 178.217 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.527 ' HA ' ' HB2' ' A' ' 41' ' ' ARG . 42.3 t -52.59 -46.34 48.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 120.694 0.283 . . . . 0.0 111.132 -175.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -58.48 -56.96 15.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.269 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.792 ' O ' HG13 ' A' ' 64' ' ' VAL . 53.4 mt-30 -71.05 -32.59 69.35 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.849 -174.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.523 ' HA ' HG21 ' A' ' 64' ' ' VAL . 2.9 t -66.33 -32.97 74.69 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.228 -178.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.07 -42.76 84.16 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.173 0.511 . . . . 0.0 110.177 172.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -57.68 -52.57 64.9 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.978 0.894 . . . . 0.0 111.042 176.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.792 HG13 ' O ' ' A' ' 60' ' ' GLN . 4.3 m -68.23 -26.45 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.862 0 CA-C-N 114.721 -1.127 . . . . 0.0 110.818 -179.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.521 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -55.18 -49.96 70.56 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 174.914 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -73.37 -35.41 65.93 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 119.721 -0.792 . . . . 0.0 112.134 -174.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.603 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.9 pt-20 -59.74 -42.89 94.19 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.042 -0.663 . . . . 0.0 110.447 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.51 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 28.5 m -78.13 -36.74 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.864 0.364 . . . . 0.0 111.212 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 97.6 m -71.08 -20.26 62.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.136 0.493 . . . . 0.0 110.798 -177.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -79.66 -25.12 41.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.388 175.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.562 HG13 ' O ' ' A' ' 67' ' ' GLU . 17.6 mt -79.55 -29.77 13.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.392 0.615 . . . . 0.0 109.648 177.103 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.423 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 120.03 13.53 5.93 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.396 -0.907 . . . . 0.0 111.897 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . 0.436 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 55.7 m-85 -104.48 102.47 33.94 Favored Pre-proline 0 N--CA 1.448 -0.528 0 CA-C-O 120.622 0.248 . . . . 0.0 110.89 179.459 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.716 ' HB2' ' CG ' ' A' ' 46' ' ' GLN . 81.7 Cg_exo -54.4 124.72 16.78 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.3 2.667 . . . . 0.0 112.767 176.221 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.521 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -128.05 154.24 45.89 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.279 -0.568 . . . . 0.0 111.165 176.616 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.762 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 1.5 mttt -138.72 112.44 8.35 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.106 179.099 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.717 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 59.3 m -102.09 102.22 12.67 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 119.834 -0.746 . . . . 0.0 109.797 173.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 40.6 t -107.61 160.0 16.02 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.365 -178.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.468 ' HB2' ' HD2' ' A' ' 41' ' ' ARG . 49.0 t -122.72 100.47 6.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.304 0.573 . . . . 0.0 109.996 178.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.81 ' HG2' ' H ' ' A' ' 81' ' ' ASP . 2.7 tt0 -173.98 166.5 4.31 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 105.892 -1.892 . . . . 0.0 105.892 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.81 ' H ' ' HG2' ' A' ' 80' ' ' GLU . 9.4 t70 -69.29 109.12 3.97 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.155 -174.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.728 HD22 HG11 ' A' ' 32' ' ' VAL . 30.5 mt 69.27 31.35 3.95 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.983 -177.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . 0.608 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 3.3 t -70.82 -6.76 40.34 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -173.1 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.42 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 29.7 p-10 . . . . . 0 C--N 1.325 -0.465 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.135 177.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.3 tp . . . . . 0 N--CA 1.455 -0.22 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.527 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 31.4 mtmm -106.47 108.25 19.67 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.14 0.495 . . . . 0.0 111.415 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 12.4 m -111.33 153.29 26.2 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.678 ' HB3' ' HB2' ' A' ' 30' ' ' ARG . 63.2 m-85 -70.66 137.31 49.76 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.212 176.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.7 p -116.37 144.51 44.19 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.346 175.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.422 HH12 ' NH2' ' A' ' 30' ' ' ARG . 10.8 tpt180 . . . . . 0 C--N 1.324 -0.504 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.678 ' HB2' ' HB3' ' A' ' 23' ' ' PHE . 1.0 OUTLIER . . . . . 0 N--CA 1.453 -0.311 0 CA-C-O 121.436 0.636 . . . . 0.0 112.41 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 27.2 m -108.04 132.01 53.99 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.007 174.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 95.5 t -73.14 107.79 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 176.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 19.4 p -123.74 134.7 53.63 Favored 'General case' 0 C--N 1.317 -0.848 0 C-N-CA 120.103 -0.639 . . . . 0.0 111.582 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.527 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.5 t -79.65 113.49 17.85 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 170.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.3 m -87.88 166.07 14.81 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.373 -170.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.504 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -61.81 157.5 17.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.051 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -81.28 -12.28 59.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -164.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.504 ' OE2' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -78.83 -27.53 44.31 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.511 0.672 . . . . 0.0 109.522 175.566 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.564 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 12.7 mt-30 -88.06 88.06 7.52 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.43 177.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 p -97.15 5.11 50.77 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.253 -175.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.777 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 17.7 mmt85 -117.51 178.89 4.22 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 119.376 -0.929 . . . . 0.0 110.036 172.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.543 ' HB3' ' HB3' ' A' ' 84' ' ' ASN . 86.0 m -135.61 131.12 35.43 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.649 -1.16 . . . . 0.0 109.407 -174.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.486 ' HB2' ' CG ' ' A' ' 56' ' ' LYS . 1.6 tm? -100.23 128.21 46.35 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.667 -173.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.578 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 52.3 t80 -142.17 114.85 8.54 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.768 174.022 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.546 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 41.4 t -101.61 128.88 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 175.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.72 ' HB3' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -90.04 114.22 26.06 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.27 -178.576 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.547 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.5 mm? -109.69 153.33 43.02 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.039 179.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -80.15 27.18 0.55 Allowed 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 122.737 2.291 . . . . 0.0 112.724 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 39.0 p90 -170.63 -23.38 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.829 -177.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.547 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 45.2 m -148.09 -160.95 1.24 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.421 ' HA ' HD23 ' A' ' 47' ' ' LEU . 16.3 pt-20 -158.01 150.47 22.37 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.816 179.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.578 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 37.8 mt -112.38 137.97 43.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 177.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.472 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 45.3 mt-30 -144.5 128.95 17.97 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -178.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -150.84 174.98 12.45 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 -179.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 3.6 m -107.72 127.2 53.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 167.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.51 ' HB2' ' SG ' ' A' ' 61' ' ' CYS . 71.9 mmtt -133.5 148.38 51.68 Favored 'General case' 0 C--N 1.314 -0.954 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.599 -174.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.564 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 43.9 p -66.18 154.72 39.01 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 172.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.57 ' HA ' ' HG3' ' A' ' 41' ' ' ARG . 21.7 t -50.1 -45.66 23.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.453 -176.545 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -66.01 -56.53 11.15 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.648 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.688 ' O ' HG12 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -58.45 -33.42 69.71 Favored 'General case' 0 C--O 1.211 -0.937 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -176.239 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.534 ' HA ' HG21 ' A' ' 64' ' ' VAL . 2.7 t -72.68 -33.5 66.57 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.623 -179.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.45 -36.85 71.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.238 0.542 . . . . 0.0 109.684 173.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.572 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 92.5 mt-10 -59.5 -52.36 65.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.547 175.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.688 HG12 ' O ' ' A' ' 60' ' ' GLN . 19.8 m -71.77 -27.67 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.659 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.523 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.511 HD11 ' HG1' ' A' ' 69' ' ' THR . 0.2 OUTLIER -60.52 -49.44 77.55 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 175.382 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -73.88 -32.32 63.54 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.834 -174.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.607 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.2 pt-20 -61.13 -41.86 97.48 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.744 -0.783 . . . . 0.0 109.895 -179.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.463 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 28.6 m -81.07 -37.57 16.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 178.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.511 ' HG1' HD11 ' A' ' 65' ' ' LEU . 97.8 m -78.15 -25.73 47.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.532 -172.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.38 -19.74 63.83 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.426 173.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 9.5 mt -80.56 -22.17 11.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.745 177.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 112.27 2.08 26.37 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 119.884 -1.15 . . . . 0.0 112.17 -177.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -88.69 126.55 59.39 Favored Pre-proline 0 N--CA 1.448 -0.553 0 O-C-N 122.819 -0.224 . . . . 0.0 110.909 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.72 ' HB2' ' HB3' ' A' ' 46' ' ' GLN . 78.8 Cg_exo -56.64 131.27 44.61 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 123.319 2.68 . . . . 0.0 112.723 176.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -146.93 155.13 42.04 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 119.154 -1.018 . . . . 0.0 111.641 174.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.422 ' HD3' ' CD2' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -141.26 151.54 43.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.772 176.012 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.777 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 37.4 t -145.76 92.76 2.25 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.92 173.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 3.9 p -107.13 166.13 10.85 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.956 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.55 ' HB2' ' HD3' ' A' ' 41' ' ' ARG . 47.3 t -109.46 105.01 14.18 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.533 -173.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 172.13 151.82 0.07 Allowed 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.537 ' CB ' HD21 ' A' ' 82' ' ' LEU . 62.0 m-20 -57.79 138.97 55.07 Favored 'General case' 0 CA--C 1.512 -0.492 0 C-N-CA 119.429 -0.908 . . . . 0.0 109.764 176.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.537 HD21 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 63.85 17.18 10.35 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.065 172.2 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 4.8 t -78.53 -6.7 56.19 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.058 0.456 . . . . 0.0 111.21 -174.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.543 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 29.5 p-10 . . . . . 0 C--N 1.319 -0.751 0 CA-C-O 121.401 0.62 . . . . 0.0 110.36 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.8 tp . . . . . 0 N--CA 1.462 0.146 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.521 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 28.8 mtmm -110.37 106.13 15.37 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.807 -173.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.47 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 17.2 m -106.23 156.01 18.9 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 175.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.609 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 16.2 m-85 -67.58 115.32 7.04 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.72 175.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.9 m -96.09 133.45 40.33 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.076 -0.712 . . . . 0.0 109.076 171.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.9 ttt180 . . . . . 0 C--N 1.323 -0.583 0 CA-C-O 120.991 0.424 . . . . 0.0 111.627 -175.507 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.445 -0.694 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -106.8 143.97 34.13 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.329 -0.549 . . . . 0.0 111.464 -169.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.473 HG11 HD12 ' A' ' 82' ' ' LEU . 85.1 t -75.32 106.49 5.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.834 174.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.408 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 32.6 p -122.08 139.22 53.98 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.324 -0.55 . . . . 0.0 110.845 178.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.521 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.8 t -89.12 112.24 23.18 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.18 177.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . 0.502 ' HB3' ' OE1' ' A' ' 39' ' ' GLN . 44.9 m -101.45 161.71 13.43 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.833 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.67 158.16 28.11 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.251 -175.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -66.9 -17.45 64.91 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.297 0.57 . . . . 0.0 110.768 177.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.523 ' HG2' HG22 ' A' ' 57' ' ' THR . 10.7 tt0 -45.18 -48.01 12.43 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.574 -1.194 . . . . 0.0 108.884 163.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.559 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 41.3 mt-30 -98.06 73.17 2.22 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 114.423 -1.262 . . . . 0.0 109.686 -176.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.16 18.56 3.05 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.518 -177.044 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.638 HH21 HG13 ' A' ' 58' ' ' VAL . 1.6 tpp85 -136.38 168.8 18.76 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.698 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 21.7 m -129.92 137.51 50.41 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -178.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.596 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.0 OUTLIER -98.83 123.36 43.03 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.529 0.204 . . . . 0.0 110.507 -176.501 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.648 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 50.7 t80 -131.24 105.27 7.55 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.062 171.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.563 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 42.1 t -98.0 138.12 23.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 120.391 -0.524 . . . . 0.0 109.818 177.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.78 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 2.1 mm100 -79.75 139.15 37.39 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 119.666 -0.813 . . . . 0.0 109.303 175.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.713 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.9 mm? -134.14 149.06 70.42 Favored Pre-proline 0 C--N 1.314 -0.942 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.631 178.119 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 5.1 Cg_exo -79.9 13.23 2.2 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.93 2.42 . . . . 0.0 112.134 174.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -138.63 -43.75 0.49 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.079 0.466 . . . . 0.0 110.71 -176.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.713 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 38.8 m -147.72 -156.71 0.74 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -178.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -139.56 135.88 33.85 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.954 -0.698 . . . . 0.0 110.279 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.648 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 73.7 mt -89.92 126.62 42.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.546 177.602 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.596 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 17.9 mt-30 -139.74 130.77 26.34 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 175.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -172.52 163.97 5.5 Favored 'General case' 0 C--N 1.33 -0.279 0 O-C-N 123.473 0.483 . . . . 0.0 110.509 -177.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.47 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 73.5 m -87.91 135.85 33.22 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.052 0.453 . . . . 0.0 111.109 -179.418 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.524 ' HB2' ' HB2' ' A' ' 61' ' ' CYS . 68.2 mmtt -138.23 157.28 46.59 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.559 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 5.3 p -70.96 152.18 43.88 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 118.969 -1.092 . . . . 0.0 108.061 173.122 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.638 HG13 HH21 ' A' ' 41' ' ' ARG . 55.4 t -48.67 -51.92 10.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 120.648 0.261 . . . . 0.0 110.745 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.551 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 17.6 tt0 -63.26 -55.69 22.75 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.19 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.769 ' O ' HG13 ' A' ' 64' ' ' VAL . 29.3 tt0 -58.24 -37.31 74.65 Favored 'General case' 0 C--O 1.209 -1.052 0 CA-C-N 116.541 -0.299 . . . . 0.0 110.961 -174.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.537 ' HA ' HG21 ' A' ' 64' ' ' VAL . 2.7 t -70.94 -32.97 70.03 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.38 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.91 -39.35 87.36 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.93 172.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.551 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 20.1 mm-40 -58.68 -52.66 64.73 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.492 176.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.769 HG13 ' O ' ' A' ' 60' ' ' GLN . 7.4 m -69.77 -26.43 30.47 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.705 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.107 -178.63 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.496 HD12 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -57.11 -50.47 72.7 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 175.698 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -73.82 -34.68 64.67 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 120.215 -0.594 . . . . 0.0 111.98 -174.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.603 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.1 pt-20 -59.43 -42.74 92.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.17 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.504 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 34.4 m -79.68 -38.51 19.35 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.13 0 CA-C-O 120.738 0.304 . . . . 0.0 111.663 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.8 m -74.03 -19.92 60.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.83 0.347 . . . . 0.0 111.341 -175.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.23 -23.47 59.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.999 0.428 . . . . 0.0 110.181 173.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 67' ' ' GLU . 6.1 mt -83.83 -21.86 8.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.355 0.598 . . . . 0.0 109.623 177.295 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.433 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 115.43 9.33 13.09 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.13 -1.033 . . . . 0.0 112.224 -178.136 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -101.51 107.11 49.79 Favored Pre-proline 0 N--CA 1.45 -0.43 0 CA-C-O 120.739 0.304 . . . . 0.0 110.966 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.78 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 52.2 Cg_exo -60.54 137.45 73.88 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 123.116 2.544 . . . . 0.0 112.682 175.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.496 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -138.3 160.13 40.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.715 0.293 . . . . 0.0 110.327 174.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.3 mmtp -136.25 114.86 11.92 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.032 -178.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.698 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 39.0 m -114.13 98.48 6.98 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.946 173.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 7.9 p -111.13 167.69 10.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.692 -0.231 . . . . 0.0 110.727 -178.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 37.7 m -109.63 106.04 15.56 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.839 -176.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.484 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 23.2 tt0 178.1 153.71 0.32 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.564 ' CB ' HD21 ' A' ' 82' ' ' LEU . 49.7 m-20 -65.27 139.32 58.6 Favored 'General case' 0 CA--C 1.507 -0.708 0 C-N-CA 117.919 -1.512 . . . . 0.0 108.738 172.806 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.609 ' HB3' ' CE2' ' A' ' 23' ' ' PHE . 0.2 OUTLIER 61.37 23.72 13.93 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.084 174.556 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . 0.484 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 5.7 t -69.98 -34.26 73.13 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.619 -171.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.569 ' OD1' ' HB3' ' A' ' 42' ' ' CYS . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.35 0 C-N-CA 118.756 -1.177 . . . . 0.0 109.402 174.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 27.2 tp . . . . . 0 C--O 1.233 0.199 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.644 ' HG2' ' HB ' ' A' ' 34' ' ' THR . 27.6 mtmm -114.61 114.9 26.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.244 0.545 . . . . 0.0 112.072 -174.318 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 17.2 m -129.41 168.58 16.1 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.044 175.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -75.27 132.27 40.93 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.259 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 61.8 m -129.55 135.29 48.41 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 175.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 51.5 ttt180 . . . . . 0 C--N 1.324 -0.508 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.909 -176.833 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.668 ' HD2' ' OE1' ' A' ' 53' ' ' GLN . 77.6 mtm180 . . . . . 0 N--CA 1.452 -0.34 0 CA-C-O 120.78 0.324 . . . . 0.0 110.65 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.8 t -120.09 176.11 5.6 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.852 -178.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 76.9 t -90.08 116.75 32.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.498 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.477 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 64.4 p -106.76 143.37 34.96 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.69 175.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.644 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 1.5 t -98.43 112.32 24.38 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.479 175.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 57.9 m -110.54 164.97 12.18 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.241 -172.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.2 -175.98 4.41 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -170.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -67.05 -32.6 73.91 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.44 -0.8 . . . . 0.0 113.009 -167.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.541 ' CD ' ' H ' ' A' ' 38' ' ' GLU . 1.1 mp0 -55.11 -44.16 74.73 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 122.159 0.98 . . . . 0.0 108.619 177.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.69 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 2.2 mm-40 -90.98 49.19 1.61 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 113.694 -1.594 . . . . 0.0 110.411 -172.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.74 3.65 11.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.204 0.526 . . . . 0.0 110.906 178.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.604 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 19.4 mmt85 -120.07 -179.44 3.93 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.704 0.764 . . . . 0.0 109.367 169.078 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.584 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 35.9 m -144.41 156.1 44.06 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.344 -172.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.418 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.0 OUTLIER -114.77 135.62 53.98 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 120.922 0.392 . . . . 0.0 110.247 -177.799 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.565 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 70.3 t80 -141.73 119.97 12.22 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.36 -0.836 . . . . 0.0 108.984 170.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.603 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 25.3 t -119.43 140.58 42.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.426 -178.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.982 HE21 ' HA ' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -84.48 133.33 34.48 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.122 0.487 . . . . 0.0 110.694 176.302 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.677 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.5 mm? -130.24 146.05 59.95 Favored Pre-proline 0 C--N 1.318 -0.799 0 CA-C-N 115.471 -0.786 . . . . 0.0 108.894 176.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -76.15 15.08 1.01 Allowed 'Trans proline' 0 CA--C 1.528 0.212 0 C-N-CA 122.797 2.331 . . . . 0.0 112.193 177.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -143.45 -39.42 0.31 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.633 -176.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.677 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 49.0 m -149.11 -156.83 0.76 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.428 ' CD ' HH12 ' A' ' 30' ' ' ARG . 22.3 mt-10 -138.65 149.56 45.31 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 177.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.603 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 27.9 mm -104.74 129.27 57.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.193 174.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.668 ' OE1' ' HD2' ' A' ' 30' ' ' ARG . 50.9 mt-30 -142.86 131.85 22.99 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.58 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -168.2 160.26 11.51 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 123.556 0.535 . . . . 0.0 111.107 -178.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 64.7 m -78.32 132.63 37.52 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 170.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.429 ' HG2' HG23 ' A' ' 64' ' ' VAL . 8.7 tppt? -137.95 135.33 35.94 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 -178.553 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.69 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 6.1 p -59.09 156.45 11.96 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 119.509 -0.876 . . . . 0.0 109.827 -178.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.542 HG21 ' HG2' ' A' ' 41' ' ' ARG . 37.3 t -54.81 -46.63 75.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.091 0.472 . . . . 0.0 111.296 -175.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.632 ' HG3' ' N ' ' A' ' 60' ' ' GLN . 8.5 pt20 -65.82 -45.36 82.61 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.881 -179.543 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.632 ' N ' ' HG3' ' A' ' 59' ' ' GLN . 70.9 mt-30 -72.87 -26.71 61.55 Favored 'General case' 0 C--O 1.2 -1.528 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.884 -175.404 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.514 ' HA ' ' CG2' ' A' ' 64' ' ' VAL . 9.1 p -69.43 -33.05 72.39 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.45 -40.75 73.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 0.0 109.997 172.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.21 -52.01 66.61 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.174 178.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.614 HG13 ' O ' ' A' ' 60' ' ' GLN . 30.6 m -67.77 -29.39 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.375 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.637 -178.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.479 HD12 ' HB3' ' A' ' 75' ' ' ALA . 18.4 tp -57.81 -50.79 72.08 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.804 176.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -75.25 -32.38 61.07 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -176.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.59 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -61.1 -46.91 88.7 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.615 -175.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.582 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.6 m -79.76 -31.32 13.72 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 C-N-CA 120.74 -0.384 . . . . 0.0 111.299 -179.577 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 96.3 m -68.41 -29.06 67.65 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.559 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.76 -22.78 63.32 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.541 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 67' ' ' GLU . 20.1 mt -85.1 -20.61 8.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.337 0.589 . . . . 0.0 109.729 177.654 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 111.2 11.97 16.77 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.187 -1.006 . . . . 0.0 112.453 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -106.47 113.39 63.19 Favored Pre-proline 0 N--CA 1.448 -0.559 0 CA-C-O 120.612 0.244 . . . . 0.0 111.212 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.667 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 90.6 Cg_exo -52.36 129.78 33.09 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 123.577 2.851 . . . . 0.0 113.088 177.41 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.487 ' HA ' ' O ' ' A' ' 44' ' ' PHE . . . -132.4 161.21 34.2 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.236 -0.585 . . . . 0.0 111.0 174.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.54 ' HG3' ' HB3' ' A' ' 44' ' ' PHE . 14.9 ptmt -145.2 124.33 12.88 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.017 0.437 . . . . 0.0 111.409 175.025 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.604 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 0.6 OUTLIER -100.44 96.66 7.56 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.602 -0.727 . . . . 0.0 109.122 168.714 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 42.7 t -106.81 152.45 23.85 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.579 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.467 ' HB2' ' CD ' ' A' ' 41' ' ' ARG . 41.9 t -115.22 100.28 8.02 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.334 -178.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.487 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 42.8 tt0 169.68 155.1 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.553 ' CB ' HD21 ' A' ' 82' ' ' LEU . 69.5 m-20 -63.31 135.2 56.88 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 119.038 -1.065 . . . . 0.0 110.001 177.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.553 HD21 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 66.72 6.8 4.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.032 170.843 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . 0.487 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 42.6 t -75.88 -13.15 60.26 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 120.336 -0.545 . . . . 0.0 111.387 -175.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 . . . . . 0 C--N 1.327 -0.372 0 C-N-CA 120.111 -0.635 . . . . 0.0 110.599 178.672 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 26.1 tp . . . . . 0 N--CA 1.456 -0.175 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.518 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 33.1 mtmm -108.58 106.88 17.16 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 119.63 -0.828 . . . . 0.0 111.632 -179.577 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.516 ' HA ' HD22 ' A' ' 84' ' ' ASN . 8.1 m -110.05 166.26 11.08 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.016 177.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -80.75 132.35 35.52 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 119.929 -0.708 . . . . 0.0 110.415 178.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.1 p -101.97 130.9 48.61 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 171.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.2 tpt85 . . . . . 0 C--N 1.322 -0.625 0 C-N-CA 120.446 -0.502 . . . . 0.0 109.741 -176.412 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.468 HH11 ' HD3' ' A' ' 30' ' ' ARG . 1.1 ptt-85 . . . . . 0 N--CA 1.451 -0.417 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.9 m -97.14 133.48 41.73 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.615 -168.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 95.5 t -72.72 106.84 3.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 173.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.1 p -122.3 138.36 54.53 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.557 -0.457 . . . . 0.0 111.513 -177.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.518 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.9 t -77.66 115.92 17.79 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 173.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.2 m -89.17 178.21 6.42 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.709 -170.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.5 161.04 30.31 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.072 0.463 . . . . 0.0 112.181 -174.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -56.45 -33.32 65.79 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.791 -177.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -74.25 -29.57 61.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.133 0.492 . . . . 0.0 111.093 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.494 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 22.7 mt-30 -83.96 90.4 7.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.457 0.646 . . . . 0.0 110.114 -172.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.492 ' OG1' HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -102.48 14.5 31.8 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.52 -176.658 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.619 ' HD3' HG21 ' A' ' 58' ' ' VAL . 1.6 tpt180 -135.11 172.44 13.0 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 121.168 0.509 . . . . 0.0 109.724 175.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.595 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 70.1 m -131.0 131.64 44.49 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.511 -0.768 . . . . 0.0 108.943 179.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.492 ' HB3' ' HG2' ' A' ' 54' ' ' GLU . 0.7 OUTLIER -96.33 123.71 40.07 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.059 -177.151 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.52 ' HD2' ' HG3' ' A' ' 76' ' ' LYS . 71.9 t80 -131.64 109.37 10.16 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.853 170.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.622 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 39.9 t -99.42 134.22 39.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 172.044 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 1.024 ' HB3' ' HB2' ' A' ' 74' ' ' PRO . 1.9 tp-100 -93.4 114.78 27.28 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.856 -175.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.538 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.6 mm? -107.8 156.71 37.59 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.909 -179.029 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_exo -70.9 14.93 0.32 Allowed 'Trans proline' 0 CA--C 1.535 0.562 0 C-N-CA 123.23 2.62 . . . . 0.0 114.019 -176.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -171.02 -30.94 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.879 -178.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.538 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 23.8 p -124.31 -168.4 1.79 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.828 179.015 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -150.48 149.73 30.37 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 119.584 -0.846 . . . . 0.0 111.285 178.118 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.622 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 25.9 mm -98.78 129.49 49.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.777 175.255 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.413 ' OE1' ' HD3' ' A' ' 30' ' ' ARG . 48.5 mt-30 -140.31 130.25 24.69 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 119.811 -0.756 . . . . 0.0 110.565 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.494 ' CD ' ' HZ3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -163.4 163.86 24.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.733 -179.189 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.558 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.3 m -94.86 126.43 40.18 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 168.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.558 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 14.0 mptt -128.05 170.86 12.43 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 119.926 -0.71 . . . . 0.0 109.144 175.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.494 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 30.9 p -80.68 159.63 25.23 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 118.471 -1.292 . . . . 0.0 107.96 174.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.619 HG21 ' HD3' ' A' ' 41' ' ' ARG . 83.4 t -55.3 -43.75 72.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.53 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -66.54 -56.74 9.41 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.053 -178.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.717 ' O ' HG13 ' A' ' 64' ' ' VAL . 74.5 mt-30 -56.44 -44.38 80.38 Favored 'General case' 0 C--O 1.207 -1.178 0 O-C-N 123.456 0.473 . . . . 0.0 110.21 -177.309 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.573 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -66.35 -31.6 72.48 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.852 -178.108 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.78 -41.18 75.45 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.189 -0.604 . . . . 0.0 110.141 173.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.475 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 45.3 mt-10 -56.32 -53.33 58.53 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.981 0.896 . . . . 0.0 110.655 175.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.717 HG13 ' O ' ' A' ' 60' ' ' GLN . 5.7 m -72.73 -26.36 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.735 0 CA-C-N 114.532 -1.213 . . . . 0.0 111.081 -178.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 19.8 tp -56.85 -47.71 79.74 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 176.267 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.531 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 38.7 tt0 -73.98 -37.63 64.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.462 -176.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.599 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -58.3 -43.74 88.24 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.611 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.53 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 29.9 m -79.66 -31.75 14.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 120.599 -0.44 . . . . 0.0 112.06 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.531 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 21.0 p -73.87 -26.27 60.47 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.105 -178.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.87 -20.21 63.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.183 0.515 . . . . 0.0 110.493 176.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 67' ' ' GLU . 22.6 mt -82.07 -19.6 10.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.605 176.678 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 108.65 1.84 32.56 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.18 -1.01 . . . . 0.0 112.398 179.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -87.43 134.53 35.97 Favored Pre-proline 0 N--CA 1.45 -0.469 0 CA-C-O 120.787 0.327 . . . . 0.0 111.385 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 1.024 ' HB2' ' HB3' ' A' ' 46' ' ' GLN . 54.4 Cg_exo -59.55 130.82 37.16 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 123.394 2.729 . . . . 0.0 111.897 175.163 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -147.03 151.23 36.59 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.2 -0.6 . . . . 0.0 111.508 178.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.52 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 1.1 ptmt -151.01 119.57 6.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.549 179.312 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.595 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 65.7 m -113.57 97.97 6.77 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.358 -0.537 . . . . 0.0 109.893 168.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 3.5 p -108.46 157.42 18.45 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.069 177.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . 0.45 ' O ' ' HG2' ' A' ' 80' ' ' GLU . 14.5 t -108.42 100.95 10.17 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.354 -175.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 79' ' ' CYS . 3.0 mm-40 178.9 151.01 0.3 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.553 ' CB ' HD22 ' A' ' 82' ' ' LEU . 70.0 m-20 -63.02 135.9 57.52 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 118.819 -1.152 . . . . 0.0 109.772 178.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.553 HD22 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 65.51 10.08 6.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.583 171.636 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 42.7 t -69.65 -20.69 63.58 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.726 0.774 . . . . 0.0 110.313 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.516 HD22 ' HA ' ' A' ' 22' ' ' CYS . 6.0 p30 . . . . . 0 C--N 1.324 -0.504 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.366 178.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.7 tp . . . . . 0 C--O 1.232 0.182 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.498 ' HB3' HG11 ' A' ' 32' ' ' VAL . 23.0 mtpp -115.33 101.17 8.68 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 119.219 -0.992 . . . . 0.0 111.867 178.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.409 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 8.4 m -100.71 158.38 15.99 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 173.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -76.37 142.21 41.24 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.35 -0.54 . . . . 0.0 109.779 174.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 88.9 m -133.64 129.57 37.06 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 173.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 . . . . . 0 C--N 1.324 -0.54 0 C-N-CA 119.576 -0.85 . . . . 0.0 112.223 -173.698 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.5 mtt-85 . . . . . 0 N--CA 1.452 -0.33 0 CA-C-O 121.22 0.533 . . . . 0.0 111.073 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 m -115.29 139.24 50.14 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.065 -178.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.498 HG11 ' HB3' ' A' ' 21' ' ' LYS . 6.3 t -88.6 104.59 14.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 C-N-CA 119.789 -0.764 . . . . 0.0 109.846 177.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.2 p -87.61 150.24 23.79 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.858 -173.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 t -90.15 112.25 23.68 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 171.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.1 140.87 35.8 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.894 0.378 . . . . 0.0 110.499 -173.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.44 172.23 10.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.258 -171.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -56.19 -38.53 71.08 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.107 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -52.07 -46.13 65.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.793 175.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.621 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 38.2 mt-30 -103.07 72.54 1.18 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.237 -177.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.09 15.57 11.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.302 -179.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.686 ' HG2' ' SG ' ' A' ' 61' ' ' CYS . 1.7 tpt180 -119.68 171.13 8.6 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.299 -0.56 . . . . 0.0 109.494 173.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.714 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.3 m -130.42 131.0 45.02 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.504 -179.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.516 HD11 ' HE3' ' A' ' 56' ' ' LYS . 0.7 OUTLIER -94.95 130.73 41.47 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.835 0.35 . . . . 0.0 110.507 -176.596 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.627 ' HE2' ' OE1' ' A' ' 46' ' ' GLN . 54.4 t80 -143.69 119.23 10.36 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.468 174.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.5 t -122.49 138.8 51.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -179.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.832 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 7.1 mm100 -75.58 142.0 42.8 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.663 178.421 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.603 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.4 mm? -130.55 158.57 74.22 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 169.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -76.27 13.82 1.26 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.761 2.308 . . . . 0.0 112.39 176.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -140.43 -54.48 0.51 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.467 0.651 . . . . 0.0 109.69 -179.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.603 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 6.7 p -137.83 -151.5 0.39 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.675 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.454 ' HA ' HD22 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -147.14 161.01 41.74 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.297 176.347 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.611 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 67.3 mt -92.92 133.96 32.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.524 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -135.1 130.51 35.62 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 120.345 -0.542 . . . . 0.0 109.544 176.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -169.99 162.24 9.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.06 177.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 4.4 m -86.81 140.8 29.33 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 170.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.516 ' HE3' HD11 ' A' ' 43' ' ' LEU . 5.0 tppt? -143.72 153.3 42.3 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.136 -0.626 . . . . 0.0 109.647 -178.139 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.621 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 29.3 p -69.45 142.82 53.72 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 176.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.655 HG21 ' HD3' ' A' ' 41' ' ' ARG . 39.9 t -54.96 -35.97 36.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-O 121.079 0.466 . . . . 0.0 110.794 -176.348 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.449 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 13.2 tt0 -69.1 -56.55 7.37 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.548 179.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.797 HE21 ' HA ' ' A' ' 60' ' ' GLN . 0.0 OUTLIER -67.55 -29.32 68.67 Favored 'General case' 0 C--O 1.209 -1.053 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.615 -175.543 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.686 ' SG ' ' HG2' ' A' ' 41' ' ' ARG . 2.5 p -67.25 -32.93 74.29 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.148 178.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.13 -44.79 75.32 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 173.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 49.6 mm-40 -53.74 -53.14 56.44 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.769 177.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.603 HG11 ' O ' ' A' ' 60' ' ' GLN . 16.1 m -73.31 -26.84 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.626 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.315 -177.3 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.642 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 4.3 tp -62.67 -50.9 69.34 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.591 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 49.1 mt-10 -76.05 -29.61 58.09 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -176.173 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.593 ' OE1' ' HA ' ' A' ' 64' ' ' VAL . 11.3 pt-20 -61.94 -45.17 94.87 Favored 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.095 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.569 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 34.4 m -80.29 -31.06 12.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.591 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 15.7 p -71.15 -28.35 64.2 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.857 -179.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.76 -21.26 63.45 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.453 175.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 67' ' ' GLU . 28.4 mt -84.71 -26.37 6.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.794 176.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.426 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 121.33 -1.91 11.42 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.111 -1.042 . . . . 0.0 112.507 -179.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -88.19 112.77 51.7 Favored Pre-proline 0 N--CA 1.451 -0.38 0 CA-C-O 120.516 0.198 . . . . 0.0 111.099 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.832 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 32.4 Cg_exo -62.91 130.96 30.97 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.997 2.464 . . . . 0.0 112.059 176.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -145.19 155.19 43.12 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.35 -178.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -148.03 131.67 16.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.575 177.348 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.714 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 24.4 p -119.29 102.24 8.56 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.537 0.684 . . . . 0.0 109.723 165.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 2.5 p -107.49 163.46 13.04 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.298 178.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 7.1 p -108.55 101.33 10.5 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.405 -175.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.552 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 24.3 tt0 177.84 146.44 0.13 Allowed 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 -177.254 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.575 ' CB ' HD23 ' A' ' 82' ' ' LEU . 17.6 m-20 -60.47 138.15 58.05 Favored 'General case' 0 CA--C 1.506 -0.723 0 C-N-CA 119.471 -0.892 . . . . 0.0 109.793 177.01 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.575 HD23 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 63.13 18.58 11.06 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.664 173.613 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . 0.552 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 12.1 t -75.03 -23.95 58.23 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.096 0.474 . . . . 0.0 111.299 -173.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.533 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 29.6 p-10 . . . . . 0 C--N 1.325 -0.466 0 CA-C-O 121.589 0.709 . . . . 0.0 109.951 177.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.0 tp . . . . . 0 N--CA 1.46 0.073 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.535 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 30.8 mtmm -106.44 113.32 26.77 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.911 -0.315 . . . . 0.0 111.181 -177.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.609 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 34.7 m -116.47 138.11 51.64 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.729 178.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.652 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 11.8 m-85 -57.23 105.6 0.25 Allowed 'General case' 0 N--CA 1.465 0.309 0 O-C-N 123.118 0.261 . . . . 0.0 111.333 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.1 m -91.37 129.03 37.41 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 175.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 . . . . . 0 C--N 1.33 -0.264 0 C-N-CA 119.768 -0.773 . . . . 0.0 111.196 -175.905 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 . . . . . 0 N--CA 1.445 -0.723 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.8 m -99.41 147.17 25.52 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.282 -170.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.502 HG11 HD12 ' A' ' 82' ' ' LEU . 58.0 t -78.07 105.67 7.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 172.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.5 p -125.09 140.21 53.09 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 120.07 -0.652 . . . . 0.0 111.172 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.535 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 2.2 t -88.39 111.67 22.02 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.637 176.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 81.7 m -95.57 161.3 14.11 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.685 -179.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.72 153.9 27.0 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.234 -175.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -66.84 -19.95 65.84 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.365 0.602 . . . . 0.0 110.914 178.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.552 ' HG2' HG22 ' A' ' 57' ' ' THR . 8.4 tt0 -46.72 -44.82 19.1 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.178 164.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.644 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 2.1 mt-30 -99.14 70.73 1.79 Allowed 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.541 -1.208 . . . . 0.0 109.567 -176.298 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.74 14.87 4.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.472 -0.786 . . . . 0.0 112.211 -173.544 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ARG . . . . . 0.673 ' CG ' ' HA ' ' A' ' 58' ' ' VAL . 13.6 mmt85 -131.77 177.4 7.55 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.374 0.606 . . . . 0.0 109.993 172.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.662 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 8.6 m -133.56 139.56 46.65 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.085 -0.961 . . . . 0.0 108.68 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.536 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -99.33 122.99 43.24 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.717 0.294 . . . . 0.0 110.341 -177.035 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.656 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 56.3 t80 -131.7 107.28 8.69 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.953 171.229 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.54 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 43.9 t -102.62 138.65 26.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 120.411 -0.516 . . . . 0.0 109.681 177.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.796 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 3.7 mm100 -77.9 139.27 39.22 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 176.009 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.653 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.1 mm? -135.03 153.0 78.2 Favored Pre-proline 0 C--N 1.317 -0.846 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.896 178.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -87.77 8.75 4.07 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.463 2.109 . . . . 0.0 112.221 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -133.92 -24.8 1.67 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.967 0.413 . . . . 0.0 110.95 -179.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.653 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 68.0 m -162.31 -157.83 0.49 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 -175.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -140.81 135.92 31.92 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 172.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ILE . . . . . 0.656 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 59.6 mt -88.96 127.05 41.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.621 178.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.468 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 24.2 mt-30 -139.35 130.46 26.55 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 123.499 0.499 . . . . 0.0 109.917 177.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -173.4 172.32 3.76 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.671 0.607 . . . . 0.0 110.198 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.609 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 34.7 m -98.82 138.24 36.25 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.683 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.536 ' HE3' HD12 ' A' ' 43' ' ' LEU . 66.0 mmtt -137.66 156.05 48.46 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.644 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 7.8 p -69.77 152.74 44.26 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 172.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.673 ' HA ' ' CG ' ' A' ' 41' ' ' ARG . 40.3 t -49.7 -55.33 5.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.799 0.333 . . . . 0.0 110.513 -176.568 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.574 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 39.0 tt0 -61.82 -55.14 33.02 Favored 'General case' 0 C--O 1.217 -0.624 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.371 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.791 ' O ' HG13 ' A' ' 64' ' ' VAL . 3.8 tt0 -54.46 -38.84 66.83 Favored 'General case' 0 C--O 1.206 -1.197 0 O-C-N 123.11 0.256 . . . . 0.0 111.202 -175.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.531 ' O ' HG21 ' A' ' 64' ' ' VAL . 2.4 t -69.68 -32.8 71.62 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 120.069 -0.652 . . . . 0.0 110.382 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.8 -39.35 87.73 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.038 171.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 14.5 mm-40 -57.79 -52.54 65.05 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.96 0.886 . . . . 0.0 110.217 176.306 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.791 HG13 ' O ' ' A' ' 60' ' ' GLN . 4.7 m -69.83 -26.41 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.759 0 CA-C-N 114.591 -1.186 . . . . 0.0 111.053 -178.669 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.511 HD11 ' HB2' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -55.75 -49.36 73.32 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 174.787 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -73.26 -36.39 66.36 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.535 -0.466 . . . . 0.0 112.102 -174.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.604 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.3 pt-20 -59.41 -43.35 93.05 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.292 -179.205 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . 0.502 HG22 ' O ' ' A' ' 64' ' ' VAL . 34.6 m -79.37 -34.95 16.57 Favored 'Isoleucine or valine' 0 C--O 1.231 0.096 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.488 -179.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 95.7 m -74.67 -20.54 59.83 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 0.0 110.882 -176.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.3 -23.34 57.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.021 0.439 . . . . 0.0 110.015 173.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.506 HG13 ' O ' ' A' ' 67' ' ' GLU . 14.3 mt -82.8 -25.86 8.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.723 176.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.437 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 115.52 7.67 15.66 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.279 -0.962 . . . . 0.0 112.017 -178.256 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -101.03 106.21 43.22 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-O 120.701 0.286 . . . . 0.0 111.063 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.796 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 74.8 Cg_exo -57.2 130.63 40.47 Favored 'Trans proline' 0 N--CA 1.471 0.173 0 C-N-CA 123.383 2.722 . . . . 0.0 113.043 177.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.511 ' HB2' HD11 ' A' ' 65' ' ' LEU . . . -126.16 159.32 33.23 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.034 175.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -135.46 120.98 19.31 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.836 -178.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.662 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 70.1 m -123.27 92.45 3.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.178 0.513 . . . . 0.0 110.721 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.7 p -110.29 159.87 17.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.763 -176.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 41.8 t -109.71 102.79 11.57 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.04 -178.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.554 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 9.9 tt0 -175.02 146.99 0.9 Allowed 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 -178.279 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.556 ' CB ' HD21 ' A' ' 82' ' ' LEU . 58.2 m-20 -63.78 135.18 56.43 Favored 'General case' 0 CA--C 1.504 -0.818 0 C-N-CA 117.878 -1.529 . . . . 0.0 109.313 177.031 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.652 ' HB3' ' CE2' ' A' ' 23' ' ' PHE . 0.2 OUTLIER 64.76 20.37 12.11 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.166 174.116 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' CYS . . . . . 0.554 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.7 t -65.24 -45.78 83.24 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.397 -173.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.502 ' N ' HD21 ' A' ' 84' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.357 0 C-N-CA 119.517 -0.873 . . . . 0.0 109.443 174.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 52.9 ttm . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.533 ' HB2' ' OG1' ' A' ' 34' ' ' THR . . . 67.4 107.76 0.04 OUTLIER 'General case' 0 C--O 1.234 0.261 0 O-C-N 124.219 0.949 . . . . 0.0 112.867 174.327 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.54 HD23 HG21 ' A' ' 40' ' ' THR . 2.3 mm? -90.95 138.59 31.48 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 175.43 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 33' ' ' THR . 30.5 mtmm -115.02 98.61 6.9 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 119.552 -0.859 . . . . 0.0 111.323 -178.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 27.9 m -123.1 165.98 15.93 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.12 175.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.446 ' HA ' ' O ' ' A' ' 31' ' ' THR . 76.8 m-85 -72.01 131.55 43.06 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.145 -176.65 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.1 m -116.82 128.02 54.88 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 167.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.723 ' HE ' ' HA ' ' A' ' 28' ' ' ASP . 18.6 ttt180 -101.5 110.09 22.02 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.441 -173.577 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -100.7 85.78 2.98 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 176.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.38 -89.9 0.87 Allowed Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 119.53 -1.319 . . . . 0.0 110.971 -173.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.723 ' HA ' ' HE ' ' A' ' 25' ' ' ARG . 17.7 t70 -144.9 0.62 0.96 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.161 0.505 . . . . 0.0 110.974 -179.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.533 ' O ' ' HG3' ' A' ' 25' ' ' ARG . 3.8 p-10 -75.73 165.48 24.97 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.788 -176.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 51.2 mtp85 -126.38 111.82 14.92 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 119.794 -0.763 . . . . 0.0 109.099 172.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.446 ' O ' ' HA ' ' A' ' 23' ' ' PHE . 97.1 m -130.88 133.41 45.87 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.324 -175.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 59.3 t -73.9 106.5 3.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.868 175.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.556 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 38.4 p -106.46 148.16 28.49 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.607 178.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.533 ' OG1' ' HB2' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -107.3 112.51 25.39 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.458 -179.526 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.5 ' O ' ' HA ' ' A' ' 19' ' ' ALA . 2.5 p -95.1 166.11 12.09 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.037 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.27 174.77 9.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.511 -176.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.08 -28.27 66.33 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.368 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.591 ' O ' HG21 ' A' ' 57' ' ' THR . 3.3 pt-20 -54.91 -56.78 15.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.645 175.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.74 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 54.9 mt-30 -86.96 53.6 2.89 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.774 -172.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.54 HG21 HD23 ' A' ' 20' ' ' LEU . 0.1 OUTLIER -73.67 -0.36 15.25 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -173.283 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.637 ' CG ' ' HA ' ' A' ' 58' ' ' VAL . 3.7 mmp_? -110.75 178.84 4.23 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 119.943 -0.703 . . . . 0.0 109.91 173.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.639 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 61.2 m -135.73 131.93 36.22 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.066 -177.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.493 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.5 OUTLIER -93.12 128.72 39.16 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.288 -176.815 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.577 ' HB2' ' HB2' ' A' ' 84' ' ' ASN . 80.7 t80 -140.16 117.3 11.21 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.147 172.334 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.569 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 40.5 t -115.11 136.05 53.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 178.67 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.812 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 8.2 mm100 -74.22 139.73 44.57 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.141 177.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.555 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.8 mm? -132.19 147.86 67.47 Favored Pre-proline 0 C--N 1.316 -0.862 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 172.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 11.6 Cg_exo -72.84 8.98 1.44 Allowed 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.682 2.255 . . . . 0.0 112.479 177.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -139.02 -59.35 0.59 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.394 0.616 . . . . 0.0 109.566 -177.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.555 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 13.1 m -121.62 -150.08 0.44 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.436 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.487 ' HG2' ' NH1' ' A' ' 25' ' ' ARG . 2.7 pt-20 -151.21 147.8 27.45 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 177.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.569 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 22.5 mm -91.44 129.42 42.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.259 176.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.447 ' HB3' ' ND2' ' A' ' 84' ' ' ASN . 45.7 mt-30 -139.09 130.22 26.66 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.102 -178.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -173.6 160.56 3.81 Favored 'General case' 0 N--CA 1.463 0.21 0 O-C-N 123.403 0.439 . . . . 0.0 111.146 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.53 ' O ' ' HE2' ' A' ' 56' ' ' LYS . 1.3 m -79.27 147.25 32.6 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 168.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.53 ' HE2' ' O ' ' A' ' 55' ' ' CYS . 7.1 tppt? -156.96 132.5 9.31 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.154 -179.062 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.74 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 38.1 m -54.28 143.17 23.97 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.753 178.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.637 ' HA ' ' CG ' ' A' ' 41' ' ' ARG . 20.1 t -44.84 -61.46 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 123.796 0.685 . . . . 0.0 111.511 -173.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -57.51 -52.36 65.71 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.161 178.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.66 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -54.56 -47.48 73.19 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.86 -176.625 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.559 ' HA ' HG21 ' A' ' 64' ' ' VAL . 4.2 t -65.9 -32.8 74.52 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.382 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.36 -41.35 85.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.217 0.532 . . . . 0.0 110.835 176.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.66 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 9.1 pt-20 -74.52 -38.07 62.9 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.552 -176.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.617 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 13.5 m -72.23 -26.32 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-O 121.428 0.632 . . . . 0.0 110.414 174.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.654 HD22 ' SG ' ' A' ' 77' ' ' CYS . 0.2 OUTLIER -56.02 -47.64 77.42 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 174.059 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -72.7 -36.56 67.87 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.054 -174.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.617 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.5 pt-20 -59.6 -43.68 93.64 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.236 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.53 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 35.0 m -79.17 -34.42 16.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.951 0.405 . . . . 0.0 111.552 -178.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.494 ' HG1' HD11 ' A' ' 65' ' ' LEU . 97.8 m -78.42 -15.67 58.42 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.165 0.507 . . . . 0.0 110.861 -176.052 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.64 -19.56 45.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.082 173.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.511 HG13 ' O ' ' A' ' 67' ' ' GLU . 29.9 mt -81.0 -27.11 10.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.864 177.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 119.76 4.18 11.84 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 119.891 -1.147 . . . . 0.0 112.306 -178.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -97.82 112.4 61.52 Favored Pre-proline 0 N--CA 1.449 -0.499 0 CA-C-O 120.536 0.208 . . . . 0.0 110.797 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.812 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 54.4 Cg_exo -58.29 134.98 65.13 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.11 2.54 . . . . 0.0 112.306 177.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -143.29 160.92 39.6 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 119.983 -0.687 . . . . 0.0 111.427 178.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.412 ' HE3' ' HB3' ' A' ' 76' ' ' LYS . 7.6 ptpp? -142.19 147.58 36.82 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.917 175.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.654 ' SG ' HD22 ' A' ' 65' ' ' LEU . 76.6 m -130.24 87.08 2.46 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.151 173.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 15.4 p -106.95 171.02 7.6 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 119.943 -0.703 . . . . 0.0 111.475 -175.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.493 ' HB3' ' CZ ' ' A' ' 41' ' ' ARG . 10.0 p -115.35 107.08 14.77 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.085 0.469 . . . . 0.0 111.486 -174.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.551 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 23.7 tt0 177.63 153.17 0.27 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.552 ' C ' HD22 ' A' ' 82' ' ' LEU . 62.2 m-20 -64.43 137.31 57.81 Favored 'General case' 0 CA--C 1.505 -0.765 0 C-N-CA 117.563 -1.655 . . . . 0.0 108.66 173.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.552 HD22 ' C ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.99 15.8 10.19 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.607 175.12 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . 0.551 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.2 t -64.83 -23.42 67.23 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.654 -172.497 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.577 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 19.5 p-10 -73.46 81.31 1.44 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 122.03 0.919 . . . . 0.0 110.606 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -165.13 163.38 20.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.196 -1.365 . . . . 0.0 109.076 -174.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 71.3 m -153.98 -60.81 0.13 Allowed 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.455 173.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.503 ' H ' ' CD ' ' A' ' 87' ' ' GLU . 1.4 pm0 -83.58 33.87 0.47 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.557 -174.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.426 178.191 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.469 ' O ' ' HG3' ' A' ' 18' ' ' MET . 22.6 ptm . . . . . 0 N--CA 1.478 0.93 0 CA-C-O 121.207 0.527 . . . . 0.0 110.358 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -90.07 -175.49 4.58 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.066 179.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.475 HD23 ' HG ' ' A' ' 79' ' ' CYS . 46.2 tp -135.61 148.41 49.01 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.658 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.502 ' HA ' ' O ' ' A' ' 33' ' ' THR . 9.9 mtmp? -91.44 102.9 15.58 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 120.449 -0.5 . . . . 0.0 111.306 178.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 30.4 m -111.26 139.34 46.73 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 178.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.633 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 19.0 m-85 -54.24 123.86 14.07 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.893 175.248 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -100.61 167.36 10.39 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 171.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.562 ' HG3' ' HB2' ' A' ' 53' ' ' GLN . 7.2 mtp180 -123.82 111.35 16.0 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.062 -0.655 . . . . 0.0 112.241 178.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -98.53 107.32 19.74 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 170.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 65.23 -98.75 0.33 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 119.497 -1.335 . . . . 0.0 110.831 -172.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.539 ' HA ' ' NH2' ' A' ' 25' ' ' ARG . 8.7 t70 -130.62 -4.07 4.18 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.597 173.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -75.46 157.61 33.82 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 118.174 -1.41 . . . . 0.0 108.989 177.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.427 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . 3.2 mmt85 -106.33 130.98 54.07 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 119.068 -1.053 . . . . 0.0 109.491 -179.045 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.3 m -114.28 114.9 26.58 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.53 -169.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 48.6 t -80.01 106.37 11.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 174.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.502 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 47.2 p -128.48 142.74 50.99 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.313 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 t -85.43 121.73 28.56 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 165.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.4 t -87.66 -163.39 0.93 Allowed 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.536 -172.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.27 168.67 12.52 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.65 -0.42 . . . . 0.0 111.04 -176.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -60.21 -18.68 50.05 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.042 178.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.683 ' HG2' HG22 ' A' ' 57' ' ' THR . 19.1 tt0 -63.63 -40.94 98.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.44 176.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.0 mp0 -96.98 120.88 38.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.656 0.741 . . . . 0.0 112.741 -169.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.419 ' OG1' HG22 ' A' ' 58' ' ' VAL . 1.1 p -124.92 12.53 8.43 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.552 -1.204 . . . . 0.0 110.582 177.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.634 ' HG3' ' H ' ' A' ' 42' ' ' CYS . 8.2 tpp85 -138.18 173.4 11.66 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.489 177.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.643 ' HB3' ' OD1' ' A' ' 84' ' ' ASN . 18.1 m -126.36 149.31 49.28 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.544 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.3 OUTLIER -110.1 122.03 46.64 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 123.147 0.279 . . . . 0.0 110.298 -176.231 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.612 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 50.2 t80 -133.12 104.06 6.32 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.487 173.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.513 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 61.8 t -101.48 134.36 42.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.118 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.772 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 1.6 mm100 -76.78 138.07 39.66 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 119.777 -0.769 . . . . 0.0 109.637 177.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.478 HD23 ' C ' ' A' ' 46' ' ' GLN . 2.9 mm? -138.51 152.38 70.96 Favored Pre-proline 0 C--N 1.314 -0.978 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.762 176.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -86.32 9.42 4.04 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 122.438 2.092 . . . . 0.0 111.424 172.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -125.0 -65.39 1.03 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.842 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.3 m -151.85 132.24 13.75 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.13 149.85 37.29 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.79 0.329 . . . . 0.0 110.542 -172.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.612 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 65.8 mt -90.95 124.91 43.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.377 178.172 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.562 ' HB2' ' HG3' ' A' ' 25' ' ' ARG . 48.5 mt-30 -135.85 129.96 33.16 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -176.25 163.69 2.6 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 123.419 0.449 . . . . 0.0 110.979 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 2.0 p -85.88 135.87 33.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.724 0.297 . . . . 0.0 110.585 177.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.544 ' HB2' ' HB2' ' A' ' 61' ' ' CYS . 68.1 mmtt -138.71 158.76 43.64 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 176.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.683 HG22 ' HG2' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -69.54 155.2 40.85 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.605 -1.258 . . . . 0.0 107.605 171.722 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.466 ' HA ' ' HB2' ' A' ' 41' ' ' ARG . 85.3 t -52.76 -46.09 50.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.254 -0.579 . . . . 0.0 109.92 179.077 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.573 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 37.5 tt0 -66.87 -55.56 14.2 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.117 178.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.808 ' O ' HG13 ' A' ' 64' ' ' VAL . 7.8 tt0 -54.84 -40.23 69.4 Favored 'General case' 0 C--O 1.212 -0.887 0 O-C-N 123.331 0.394 . . . . 0.0 110.594 -175.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.544 ' HB2' ' HB2' ' A' ' 56' ' ' LYS . 3.8 t -69.93 -32.19 70.35 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.711 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.37 -38.75 85.24 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.059 171.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.573 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 11.5 mm-40 -57.61 -52.71 64.3 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 122.114 0.959 . . . . 0.0 110.202 175.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.808 HG13 ' O ' ' A' ' 60' ' ' GLN . 4.2 m -71.06 -26.06 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.79 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.84 -178.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.511 HD12 ' HB2' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -56.09 -49.33 74.13 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 175.23 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -72.88 -37.11 67.43 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 120.562 -0.455 . . . . 0.0 112.011 -174.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.589 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 12.1 pt-20 -59.25 -42.95 92.33 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.109 -0.637 . . . . 0.0 110.355 -179.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 64' ' ' VAL . 34.8 m -79.3 -36.37 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-O 120.827 0.346 . . . . 0.0 111.691 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 98.3 m -74.75 -20.74 59.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.994 -175.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.61 -23.7 58.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.152 0.501 . . . . 0.0 110.149 174.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 67' ' ' GLU . 12.1 mt -81.03 -23.85 10.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.666 177.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.444 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 112.87 5.82 23.41 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.979 -178.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -98.66 107.94 45.61 Favored Pre-proline 0 N--CA 1.449 -0.475 0 CA-C-O 120.777 0.322 . . . . 0.0 111.081 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.772 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 74.9 Cg_exo -55.38 130.75 42.26 Favored 'Trans proline' 0 C--N 1.34 0.118 0 C-N-CA 123.478 2.785 . . . . 0.0 113.262 177.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.511 ' HB2' HD12 ' A' ' 65' ' ' LEU . . . -128.38 154.51 45.92 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.889 174.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -134.61 118.81 17.62 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.885 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 45.9 m -114.34 93.85 4.53 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.187 173.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 17.8 p -109.33 155.1 21.6 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.944 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.475 ' HG ' HD23 ' A' ' 20' ' ' LEU . 49.6 t -109.48 103.44 12.34 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 119.991 -0.684 . . . . 0.0 110.469 -174.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.523 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 14.4 tt0 -173.87 152.67 2.01 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 -179.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.547 ' CB ' HD21 ' A' ' 82' ' ' LEU . 28.7 m-20 -63.48 136.43 57.58 Favored 'General case' 0 CA--C 1.504 -0.812 0 C-N-CA 117.878 -1.529 . . . . 0.0 109.389 176.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.633 ' HB3' ' CE2' ' A' ' 23' ' ' PHE . 0.2 OUTLIER 62.38 21.53 12.61 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.114 174.654 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . 0.523 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.1 t -68.43 -37.03 79.91 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.559 -172.166 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.643 ' OD1' ' HB3' ' A' ' 42' ' ' CYS . 0.3 OUTLIER -74.29 91.96 2.22 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 119.085 -1.046 . . . . 0.0 109.528 175.454 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.513 ' HG2' ' O ' ' A' ' 83' ' ' CYS . 5.6 ptt180 -132.4 156.76 46.1 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.835 -171.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.5 m -56.62 115.82 2.77 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.796 0.685 . . . . 0.0 111.413 -176.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -99.08 -33.08 10.94 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.096 -179.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.601 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.725 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.623 ' H ' ' CD ' ' A' ' 37' ' ' GLU . 49.6 tpp . . . . . 0 N--CA 1.477 0.882 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.27 126.63 28.78 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 123.476 0.485 . . . . 0.0 110.845 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.569 HD21 HG22 ' A' ' 40' ' ' THR . 2.6 mm? -95.5 130.99 42.15 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.829 -178.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.754 ' HE3' ' N ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -83.92 124.49 31.05 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 171.689 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.608 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 12.3 t -147.47 153.54 39.67 Favored 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 119.399 -0.921 . . . . 0.0 109.972 -177.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.521 ' O ' ' HB3' ' A' ' 53' ' ' GLN . 92.1 m-85 -84.55 123.13 29.96 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 119.179 -1.009 . . . . 0.0 109.354 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.5 m -113.78 131.42 56.22 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 175.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.956 HH11 ' HA ' ' A' ' 28' ' ' ASP . 1.8 tpp180 -82.92 110.45 17.92 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.059 0.457 . . . . 0.0 110.379 -178.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.422 ' N ' HD21 ' A' ' 26' ' ' ASN . 0.9 OUTLIER -106.84 94.11 4.93 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 175.875 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 71.53 -98.26 0.74 Allowed Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 119.157 -1.497 . . . . 0.0 110.561 -173.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.956 ' HA ' HH11 ' A' ' 25' ' ' ARG . 33.5 t70 -115.9 -29.01 6.49 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.127 -0.629 . . . . 0.0 109.848 173.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -58.79 129.24 41.18 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.214 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 30' ' ' ARG . 27.4 mtp-105 -120.44 113.81 20.87 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 176.561 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.501 ' O ' ' HA ' ' A' ' 23' ' ' PHE . 9.1 t -140.15 163.97 31.3 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.753 -173.094 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.424 HG12 ' HB3' ' A' ' 21' ' ' LYS . 94.8 t -79.12 120.78 30.98 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.236 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.396 178.194 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.3 p -113.21 141.49 46.9 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.171 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.7 t -87.11 111.93 21.42 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 174.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.1 m -107.2 157.54 17.8 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.924 -171.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.12 170.99 10.39 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -167.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.623 ' CD ' ' H ' ' A' ' 18' ' ' MET . 26.9 mm-40 -52.68 -39.06 61.54 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.449 179.559 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 39' ' ' GLN . 4.5 pt-20 -56.85 -40.81 76.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.828 177.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.603 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 70.5 mt-30 -97.21 64.96 1.96 Allowed 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.797 -174.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.569 HG22 HD21 ' A' ' 20' ' ' LEU . 0.7 OUTLIER -89.71 27.28 1.56 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.433 0.635 . . . . 0.0 110.427 177.461 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.59 ' HD3' HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -136.23 177.78 7.57 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.979 178.253 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.786 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.0 m -137.21 131.28 32.22 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.809 179.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.421 ' HG ' ' SG ' ' A' ' 61' ' ' CYS . 0.5 OUTLIER -94.01 118.43 31.5 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 176.87 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.55 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 91.5 t80 -134.76 118.83 17.49 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.226 175.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.55 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 58.8 t -125.29 141.59 44.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.982 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.934 HE21 ' HA ' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -83.52 137.1 34.02 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.138 0.494 . . . . 0.0 110.901 177.934 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.572 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.7 mm? -131.9 154.02 81.6 Favored Pre-proline 0 C--N 1.319 -0.744 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 175.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.91 18.72 1.43 Allowed 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.28 1.986 . . . . 0.0 112.267 177.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -138.35 -44.43 0.5 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.461 0.648 . . . . 0.0 109.747 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.572 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 48.1 m -150.77 -151.39 0.39 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 178.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.29 153.78 42.37 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.264 175.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.55 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 14.3 mm -87.65 127.01 41.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.491 177.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.521 ' HB3' ' O ' ' A' ' 23' ' ' PHE . 83.5 mt-30 -140.69 129.11 22.57 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 123.556 0.535 . . . . 0.0 110.232 176.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.647 ' HB2' ' HZ2' ' A' ' 56' ' ' LYS . 0.5 OUTLIER -174.03 146.1 1.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.936 -177.314 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.608 ' SG ' ' HB3' ' A' ' 22' ' ' CYS . 88.2 m -79.91 118.67 21.87 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 119.984 -0.687 . . . . 0.0 109.223 169.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.647 ' HZ2' ' HB2' ' A' ' 54' ' ' GLU . 10.0 mptt -124.0 156.18 36.92 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 174.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.603 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 15.6 p -67.34 153.8 42.84 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 119.405 -0.918 . . . . 0.0 109.435 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.59 HG23 ' HD3' ' A' ' 41' ' ' ARG . 58.7 t -53.31 -46.67 57.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 121.221 -0.192 . . . . 0.0 111.105 -175.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -62.3 -55.82 24.48 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 120.903 0.382 . . . . 0.0 111.234 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.581 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 58.5 tt0 -64.14 -42.86 96.64 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.59 -172.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.55 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 4.7 t -64.52 -31.5 72.73 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.5 -0.48 . . . . 0.0 109.84 178.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.424 ' O ' ' HB3' ' A' ' 65' ' ' LEU . . . -69.68 -40.07 76.6 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.546 -0.462 . . . . 0.0 111.209 176.445 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 12.4 pt-20 -72.85 -38.47 67.06 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.95 0.405 . . . . 0.0 110.653 -178.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.618 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 12.8 m -73.56 -26.39 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.366 0 CA-C-O 121.638 0.732 . . . . 0.0 110.446 174.22 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.55 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 25.6 tp -54.94 -47.46 74.42 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 174.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.542 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 40.0 tt0 -73.98 -39.84 63.39 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.486 -175.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.618 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.0 pt-20 -55.24 -45.28 76.03 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.549 -177.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.585 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 33.0 m -80.16 -32.93 13.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.542 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 13.9 p -70.19 -27.98 64.94 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.217 -178.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.32 -19.74 63.87 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.629 176.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 11.3 mt -87.85 -20.31 7.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.827 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 114.51 -1.88 23.5 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 119.935 -1.126 . . . . 0.0 112.648 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 80.4 m-85 -78.71 123.51 85.36 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.663 0.232 . . . . 0.0 111.155 -178.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.651 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 52.8 Cg_exo -62.0 117.68 4.53 Favored 'Trans proline' 0 CA--C 1.516 -0.394 0 C-N-CA 123.045 2.497 . . . . 0.0 111.973 175.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.463 ' HA ' ' O ' ' A' ' 44' ' ' PHE . . . -135.22 149.4 49.87 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.811 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 ptmt -150.15 112.64 4.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.483 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.786 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 29.6 m -103.23 92.56 4.56 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.569 170.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.3 p -107.84 160.39 15.78 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.654 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 7.9 p -109.42 101.36 10.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.991 0.424 . . . . 0.0 111.029 -175.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.565 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 3.4 tt0 179.64 152.04 0.41 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -179.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.537 ' C ' HD23 ' A' ' 82' ' ' LEU . 78.0 m-20 -64.37 132.54 50.4 Favored 'General case' 0 CA--C 1.506 -0.714 0 C-N-CA 118.388 -1.325 . . . . 0.0 109.981 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.537 HD23 ' C ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.54 16.84 10.53 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.531 172.883 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . 0.565 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 39.6 t -61.37 -18.54 59.22 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -172.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.499 ' CG ' ' H ' ' A' ' 85' ' ' ARG . 4.3 p30 -60.09 -81.45 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 119.234 -0.412 . . . . 0.0 110.474 -179.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.499 ' H ' ' CG ' ' A' ' 84' ' ' ASN . 9.4 ptt180 31.96 -123.73 0.06 Allowed 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.325 1.05 . . . . 0.0 113.182 174.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.4 m 71.96 21.47 4.09 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 175.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -71.75 -27.85 63.26 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.334 178.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.394 178.098 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.627 ' H ' ' CD ' ' A' ' 37' ' ' GLU . 66.5 mtm . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.67 116.58 13.32 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 123.373 0.421 . . . . 0.0 110.659 178.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -90.1 147.88 23.35 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.33 -0.548 . . . . 0.0 109.718 -177.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.481 ' HG2' ' HB ' ' A' ' 34' ' ' THR . 29.0 mtmm -120.9 98.57 6.06 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 119.471 -0.892 . . . . 0.0 110.808 176.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.2 m -107.17 151.62 25.17 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.262 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.596 ' CD1' ' HB2' ' A' ' 85' ' ' ARG . 28.8 m-85 -73.28 153.56 40.53 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.823 179.335 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.4 m -142.11 127.91 19.32 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.41 177.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.739 HH11 ' HG2' ' A' ' 51' ' ' GLU . 63.0 mtp180 -91.09 110.87 22.15 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 119.379 -0.929 . . . . 0.0 111.161 -178.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -98.77 85.73 3.37 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.599 0.714 . . . . 0.0 109.906 177.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.52 -87.73 1.27 Allowed Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 119.667 -1.254 . . . . 0.0 110.869 -173.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -125.21 -53.37 1.62 Allowed 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.894 176.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -65.03 162.15 17.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.317 0.579 . . . . 0.0 110.672 -178.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.516 ' HB3' ' HG2' ' A' ' 25' ' ' ARG . 15.0 ptp180 -125.46 115.56 20.44 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.562 -175.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 19.1 p -94.99 157.02 16.08 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.199 -178.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 61.8 t -99.31 112.81 32.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 176.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.46 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 41.3 p -107.64 148.01 29.9 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.394 176.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.481 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 1.7 t -101.92 112.28 24.85 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.753 176.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 39' ' ' GLN . 1.6 p -95.12 162.55 13.66 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.4 -175.63 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.53 178.04 7.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.749 -173.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.627 ' CD ' ' H ' ' A' ' 18' ' ' MET . 25.8 mm-40 -51.23 -33.07 26.28 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.494 0.664 . . . . 0.0 110.343 174.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.493 ' HG2' HG22 ' A' ' 57' ' ' THR . 39.8 tt0 -51.3 -49.61 60.95 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.387 -1.278 . . . . 0.0 110.939 175.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.558 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 34.8 mm-40 -96.76 94.29 7.19 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 119.715 -0.794 . . . . 0.0 109.67 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.8 18.87 20.82 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.591 177.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.727 ' HG2' ' SG ' ' A' ' 61' ' ' CYS . 2.8 tpt180 -131.29 174.45 10.04 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.502 174.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.654 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.1 m -134.01 131.07 38.47 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.338 -0.847 . . . . 0.0 108.739 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.551 HD22 HG22 ' A' ' 45' ' ' VAL . 0.2 OUTLIER -91.79 128.91 37.81 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -179.328 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.522 ' HB2' ' HB2' ' A' ' 84' ' ' ASN . 24.9 t80 -138.36 102.14 4.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.323 172.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.586 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 31.8 t -105.35 133.95 48.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 175.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.891 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -97.68 134.01 41.44 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.013 -179.118 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.507 HD23 ' HA ' ' A' ' 51' ' ' GLU . 3.7 mm? -119.48 157.85 50.58 Favored Pre-proline 0 C--N 1.319 -0.734 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.38 -28.41 87.51 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.473 2.115 . . . . 0.0 113.013 -178.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -135.31 9.76 3.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.822 0.344 . . . . 0.0 111.021 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.442 ' C ' ' HB2' ' A' ' 47' ' ' LEU . 37.2 m -156.58 -166.63 2.18 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.528 -0.469 . . . . 0.0 109.97 -175.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.739 ' HG2' HH11 ' A' ' 25' ' ' ARG . 7.7 pt-20 -165.6 151.05 9.07 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 175.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.586 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 24.7 mm -105.87 128.39 60.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.457 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.43 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 17.7 mt-30 -139.2 130.56 26.94 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.999 -0.68 . . . . 0.0 110.124 -179.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -165.74 158.73 15.55 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.678 -178.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 6.3 m -77.98 117.51 19.38 Favored 'General case' 0 CA--C 1.507 -0.687 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 163.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -123.86 144.93 49.45 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 176.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.558 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 21.9 p -63.01 156.86 23.44 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 118.925 -1.11 . . . . 0.0 108.127 -178.105 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.542 HG23 ' HD3' ' A' ' 41' ' ' ARG . 57.6 t -58.17 -37.04 60.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.033 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -65.52 -55.68 16.48 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.981 177.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.646 ' O ' HG11 ' A' ' 64' ' ' VAL . 34.1 tt0 -64.06 -28.59 69.89 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.23 -175.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.727 ' SG ' ' HG2' ' A' ' 41' ' ' ARG . 0.5 OUTLIER -67.86 -33.84 75.54 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.997 178.975 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.12 -40.41 78.31 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 174.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.559 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 88.1 mt-10 -58.45 -53.2 61.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.647 177.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.646 HG11 ' O ' ' A' ' 60' ' ' GLN . 17.7 m -72.8 -28.89 28.14 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.569 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.661 -177.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.538 HD13 ' HB2' ' A' ' 75' ' ' ALA . 52.5 tp -58.93 -50.79 72.71 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.617 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -75.21 -36.38 61.39 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.331 -176.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.598 ' HG3' ' N ' ' A' ' 68' ' ' VAL . 11.4 pt-20 -56.33 -47.65 78.32 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.59 -176.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.598 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.6 m -80.67 -34.97 14.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 C-N-CA 120.809 -0.357 . . . . 0.0 111.806 -179.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 89.7 m -67.76 -28.61 67.77 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.855 0.36 . . . . 0.0 110.955 -177.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.58 -21.52 62.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.992 0.425 . . . . 0.0 110.682 176.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 67' ' ' GLU . 8.9 mt -87.22 -20.13 7.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.269 0.557 . . . . 0.0 109.753 178.07 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 115.49 -1.12 22.04 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.015 -1.088 . . . . 0.0 112.494 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.488 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 63.1 m-85 -87.58 116.88 67.57 Favored Pre-proline 0 N--CA 1.448 -0.529 0 CA-C-O 120.596 0.236 . . . . 0.0 110.547 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.891 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 46.6 Cg_exo -63.08 129.08 24.63 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 123.193 2.595 . . . . 0.0 112.616 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.538 ' HB2' HD13 ' A' ' 65' ' ' LEU . . . -138.34 162.4 34.47 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.079 -0.649 . . . . 0.0 111.796 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.556 ' HZ1' ' CD ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -149.77 154.36 38.35 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.317 168.148 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.654 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 9.4 p -129.62 111.64 12.9 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-O 121.759 0.79 . . . . 0.0 109.912 164.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 2.5 p -106.08 153.21 22.39 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.174 179.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.42 ' HB3' ' HD2' ' A' ' 41' ' ' ARG . 7.7 p -109.64 100.23 9.3 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.424 -0.51 . . . . 0.0 109.893 177.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 173.45 145.08 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -177.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.536 ' CB ' HD23 ' A' ' 82' ' ' LEU . 70.8 m-20 -61.65 139.24 58.31 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.328 -0.949 . . . . 0.0 110.593 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.536 HD23 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 62.82 17.81 10.21 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.582 171.738 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 14.7 p -79.58 -37.62 35.92 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.011 -175.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.522 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 20.4 p-10 -74.35 -3.78 32.4 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.149 0.499 . . . . 0.0 110.607 -177.279 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.596 ' HB2' ' CD1' ' A' ' 23' ' ' PHE . 1.3 ttp180 -66.63 -49.15 67.18 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.394 178.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.3 p -159.97 135.03 7.97 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.328 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.556 ' CD ' ' HZ1' ' A' ' 76' ' ' LYS . 12.5 pt-20 -85.92 -4.72 59.23 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.271 0.558 . . . . 0.0 110.722 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.299 179.203 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 12.7 tpt . . . . . 0 N--CA 1.48 1.031 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 67.08 175.38 0.25 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.43 -176.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 30.2 tp -157.49 157.66 34.29 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -118.08 109.58 16.6 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 119.556 -0.858 . . . . 0.0 111.273 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 38.7 m -128.81 163.27 25.57 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.674 -0.411 . . . . 0.0 110.679 175.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.445 ' HB3' ' HB3' ' A' ' 30' ' ' ARG . 98.8 m-85 -78.51 124.97 28.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.925 -177.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.461 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 48.2 m -125.14 125.44 43.72 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 172.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.551 ' HA ' ' HA ' ' A' ' 30' ' ' ARG . 39.9 ttp85 -90.8 110.8 22.01 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 119.924 -0.71 . . . . 0.0 110.821 -175.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -102.48 90.55 3.9 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.848 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 84.57 -86.71 1.54 Allowed Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 119.858 -1.163 . . . . 0.0 112.481 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.449 ' CG ' ' H ' ' A' ' 29' ' ' ASP . 3.3 p-10 -77.73 -83.21 0.08 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -175.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.525 ' C ' ' HG3' ' A' ' 25' ' ' ARG . 6.3 t70 -127.89 177.91 6.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.087 0.47 . . . . 0.0 111.295 -176.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.551 ' HA ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -81.48 120.27 24.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.965 -168.634 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 35.2 p -100.45 144.38 29.52 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.911 174.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.9 t -76.05 105.69 5.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 120.258 -0.577 . . . . 0.0 109.938 178.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.5 p -97.44 149.67 21.89 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.207 -176.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.9 t -89.51 112.48 23.66 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 174.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.73 147.22 23.55 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.603 -174.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.88 176.99 8.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.234 -0.439 . . . . 0.0 112.072 -174.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -56.21 -39.55 72.65 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.539 -177.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.786 ' HG3' ' HG3' ' A' ' 39' ' ' GLN . 9.5 pt-20 -61.7 -34.06 75.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.929 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.786 ' HG3' ' HG3' ' A' ' 38' ' ' GLU . 29.2 mt-30 -95.5 59.31 2.13 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.421 -173.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.97 7.21 19.08 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.062 0.458 . . . . 0.0 111.484 -178.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.969 ' HD3' HG23 ' A' ' 58' ' ' VAL . 7.3 mpt_? -120.24 177.38 5.04 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 168.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.763 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 59.8 m -145.62 130.15 17.88 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 119.741 -0.784 . . . . 0.0 110.284 -176.265 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.4 ' HA ' HD22 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -88.52 135.96 33.22 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.082 0.467 . . . . 0.0 110.933 -175.075 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.519 ' O ' ' HA ' ' A' ' 75' ' ' ALA . 20.1 t80 -139.71 109.23 6.21 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.979 -1.009 . . . . 0.0 108.673 170.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.566 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 27.8 t -115.04 123.79 71.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 173.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.425 ' O ' ' HG3' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -94.32 116.28 28.64 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.436 0.636 . . . . 0.0 110.162 -178.074 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.613 ' HB2' ' O ' ' A' ' 50' ' ' SER . 2.3 mm? -111.15 156.37 41.12 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.59 -178.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -75.31 15.34 0.81 Allowed 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.01 2.473 . . . . 0.0 112.829 178.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -141.15 -45.98 0.38 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.539 0.685 . . . . 0.0 110.175 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.613 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 54.2 m -146.45 -163.08 1.66 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 177.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.494 ' HA ' HD23 ' A' ' 47' ' ' LEU . 29.7 mt-10 -142.88 152.04 41.69 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 119.928 -0.709 . . . . 0.0 111.025 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.566 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 49.8 mt -103.28 102.63 13.92 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.583 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.019 176.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.461 ' O ' ' HA ' ' A' ' 24' ' ' THR . 54.0 mt-30 -124.75 130.61 52.74 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 119.799 -0.761 . . . . 0.0 109.878 178.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -168.7 167.75 11.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.91 -176.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 16.3 m -90.99 119.49 31.22 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.692 -0.803 . . . . 0.0 108.9 171.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -121.23 139.99 52.64 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.493 -174.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 30.5 p -64.3 147.24 52.92 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 119.891 -0.723 . . . . 0.0 109.852 -178.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.969 HG23 ' HD3' ' A' ' 41' ' ' ARG . 25.0 t -51.65 -50.02 32.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 O-C-N 123.439 0.462 . . . . 0.0 112.145 -171.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.576 ' HG3' ' HG2' ' A' ' 60' ' ' GLN . 17.6 pt20 -63.03 -48.44 78.74 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 120.874 0.369 . . . . 0.0 111.872 -176.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.617 ' O ' HG12 ' A' ' 64' ' ' VAL . 0.4 OUTLIER -69.5 -38.49 77.63 Favored 'General case' 0 C--O 1.212 -0.919 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 -176.696 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.556 ' HA ' HG22 ' A' ' 64' ' ' VAL . 0.8 OUTLIER -60.96 -33.15 72.75 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.404 -178.728 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.63 -47.46 75.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.972 0.415 . . . . 0.0 110.454 177.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 8.2 pt-20 -72.16 -36.85 69.41 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.032 -176.032 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.617 HG12 ' O ' ' A' ' 60' ' ' GLN . 14.4 m -74.41 -27.21 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 CA-C-O 121.524 0.678 . . . . 0.0 110.553 177.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.432 HD11 ' HB1' ' A' ' 75' ' ' ALA . 58.3 tp -59.08 -49.42 77.94 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 174.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.548 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 44.0 mt-10 -74.1 -32.04 63.05 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.556 -175.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.601 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.5 pt-20 -61.4 -44.96 96.24 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 120.159 -0.617 . . . . 0.0 109.929 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.55 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 33.6 m -80.21 -32.47 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.548 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 27.7 p -73.77 -25.29 60.07 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 120.201 -0.6 . . . . 0.0 111.203 -178.357 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.07 -21.45 63.15 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.061 0.458 . . . . 0.0 110.275 175.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 67' ' ' GLU . 16.4 mt -82.47 -18.43 10.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.515 176.338 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 105.48 9.06 34.17 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.197 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -89.76 122.52 67.96 Favored Pre-proline 0 N--CA 1.448 -0.561 0 CA-C-O 120.974 0.416 . . . . 0.0 111.749 -178.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_exo -51.95 124.93 15.77 Favored 'Trans proline' 0 N--CA 1.471 0.174 0 C-N-CA 123.929 3.086 . . . . 0.0 112.566 174.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.519 ' HA ' ' O ' ' A' ' 44' ' ' PHE . . . -151.93 157.85 42.36 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 119.955 -0.698 . . . . 0.0 112.09 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -155.5 147.07 22.98 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.956 172.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.763 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 27.6 p -130.84 94.51 3.63 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.536 0.684 . . . . 0.0 109.513 165.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 6.0 p -106.98 166.92 10.25 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.932 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 9.2 p -109.26 105.33 14.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.932 0.396 . . . . 0.0 110.991 -175.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.586 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 4.3 tt0 175.25 147.36 0.08 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 -176.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.571 ' CB ' HD21 ' A' ' 82' ' ' LEU . 16.5 m-20 -61.84 135.71 57.69 Favored 'General case' 0 CA--C 1.504 -0.825 0 C-N-CA 118.979 -1.088 . . . . 0.0 109.312 175.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.575 ' O ' ' HB3' ' A' ' 85' ' ' ARG . 0.2 OUTLIER 63.6 19.42 11.7 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.238 175.427 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . 0.586 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.2 t -73.57 -31.58 63.68 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.666 -176.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.415 ' HB3' ' CB ' ' A' ' 42' ' ' CYS . 22.0 p-10 -84.07 25.46 0.83 Allowed 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.164 -0.615 . . . . 0.0 110.012 178.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.575 ' HB3' ' O ' ' A' ' 82' ' ' LEU . 0.0 OUTLIER -59.7 160.65 7.08 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.436 -178.806 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.515 ' HA ' ' CE1' ' A' ' 44' ' ' PHE . 40.6 t -83.0 134.49 35.05 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.299 -178.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -80.38 -6.02 57.37 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.255 174.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.577 -179.272 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.483 1.2 0 N-CA-C 110.391 -0.226 . . . . 0.0 110.391 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.415 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . . . -81.64 156.84 24.91 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.579 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 30.2 tp -135.86 165.15 26.3 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt -111.26 98.67 7.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.099 0.476 . . . . 0.0 111.205 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.443 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 18.0 m -108.02 153.44 23.1 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 175.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -71.87 134.98 46.4 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.089 -0.645 . . . . 0.0 110.287 175.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.5 p -115.45 118.32 32.85 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 172.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.702 ' CZ ' ' HA ' ' A' ' 28' ' ' ASP . 32.5 ttt85 -91.23 111.39 22.85 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.071 -178.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -105.41 104.02 13.66 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 174.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 77.53 -78.38 1.48 Allowed Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 119.938 -1.125 . . . . 0.0 111.165 -175.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.702 ' HA ' ' CZ ' ' A' ' 25' ' ' ARG . 24.4 t70 -140.83 -34.85 0.5 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 176.41 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.515 ' O ' ' HA ' ' A' ' 25' ' ' ARG . 26.3 t70 -58.8 145.46 40.61 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.349 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.427 HH11 ' HD3' ' A' ' 30' ' ' ARG . 9.4 ptp180 -119.45 112.69 19.7 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.135 177.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -103.83 136.37 43.64 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.478 -172.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.2 t -75.47 106.63 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 169.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 40.2 p -121.25 131.75 54.4 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 119.841 -0.743 . . . . 0.0 110.938 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.5 t -72.84 116.57 13.5 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 169.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.83 177.9 7.15 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -174.48 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.559 ' HB3' ' OE1' ' A' ' 38' ' ' GLU . . . -66.36 161.09 23.27 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 119.267 -0.973 . . . . 0.0 109.257 178.254 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.415 ' HA ' ' HA ' ' A' ' 19' ' ' ALA . 2.3 pt-20 -80.44 -6.81 58.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -165.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.559 ' OE1' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -80.19 -30.42 38.76 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.118 173.089 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.6 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 30.3 mt-30 -80.46 97.25 7.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.119 179.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.26 11.31 33.09 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.411 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.797 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 18.0 mmt85 -129.33 179.37 5.82 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.437 0.637 . . . . 0.0 110.676 175.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.622 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 82.9 m -136.48 132.88 35.93 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.738 -171.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.406 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.3 OUTLIER -104.14 125.68 50.64 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.007 -172.185 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.819 ' HD2' ' HD3' ' A' ' 76' ' ' LYS . 49.7 t80 -141.15 124.88 16.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.572 172.435 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.495 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 41.4 t -121.54 140.53 45.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.366 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.765 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 10.0 mm100 -72.72 134.07 44.86 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.095 0.247 . . . . 0.0 110.875 178.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.496 HD23 ' C ' ' A' ' 46' ' ' GLN . 4.2 mm? -129.95 143.93 51.03 Favored Pre-proline 0 C--N 1.326 -0.437 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 174.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 7.2 Cg_exo -75.19 28.54 0.37 Allowed 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 123.294 2.663 . . . . 0.0 113.226 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -172.13 -26.02 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.04 0.448 . . . . 0.0 111.088 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.491 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 70.2 m -149.7 -153.31 0.48 Allowed 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.5 ' O ' ' HD3' ' A' ' 25' ' ' ARG . 10.2 pt-20 -149.11 151.96 35.31 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.688 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 68.1 mt -101.93 131.09 50.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.049 175.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.406 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 39.1 mt-30 -138.87 130.73 27.78 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.71 ' CG ' ' HE2' ' A' ' 56' ' ' LYS . 2.9 tp10 -168.58 157.24 8.54 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 123.396 0.435 . . . . 0.0 109.863 -168.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.443 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 60.6 m -94.84 139.25 31.55 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 173.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.71 ' HE2' ' CG ' ' A' ' 54' ' ' GLU . 18.6 mmtt -147.0 149.41 33.09 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 176.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.6 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 68.3 p -66.48 153.16 43.6 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 175.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.587 HG22 ' HG2' ' A' ' 41' ' ' ARG . 19.9 t -48.67 -49.49 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 120.863 0.363 . . . . 0.0 110.63 -175.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -64.09 -57.08 10.65 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.766 -178.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.71 ' O ' HG12 ' A' ' 64' ' ' VAL . 96.2 mt-30 -63.75 -28.96 70.24 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.191 -175.079 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.563 ' HA ' HG21 ' A' ' 64' ' ' VAL . 5.4 t -71.36 -33.02 69.19 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.59 -35.95 70.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.079 0.466 . . . . 0.0 109.951 173.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -62.38 -52.28 64.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.573 175.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.71 HG12 ' O ' ' A' ' 60' ' ' GLN . 15.2 m -69.47 -26.65 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.615 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.417 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.494 HD12 ' HB2' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -58.08 -49.03 78.34 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 174.077 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -73.19 -33.87 65.65 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.009 -174.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.635 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.0 pt-20 -59.92 -42.7 94.49 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 119.826 -0.749 . . . . 0.0 110.132 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.499 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.2 m -80.01 -36.16 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 99.1 m -74.52 -29.19 61.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.34 -174.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.64 -21.95 64.44 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.561 174.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.493 HG13 ' O ' ' A' ' 67' ' ' GLU . 14.8 mt -79.14 -25.49 12.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 121.283 0.563 . . . . 0.0 109.91 177.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.412 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 113.88 11.39 12.69 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 119.811 -1.185 . . . . 0.0 111.972 -176.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -102.26 105.1 41.18 Favored Pre-proline 0 N--CA 1.451 -0.401 0 CA-C-O 120.658 0.266 . . . . 0.0 111.014 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.765 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 87.4 Cg_exo -52.18 128.56 27.7 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 123.377 2.718 . . . . 0.0 113.001 177.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.494 ' HB2' HD12 ' A' ' 65' ' ' LEU . . . -136.29 161.88 34.54 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.018 -0.673 . . . . 0.0 111.193 176.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.819 ' HD3' ' HD2' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -138.27 152.51 48.62 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.24 177.277 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.797 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 9.3 t -145.71 89.78 1.94 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.998 174.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 7.2 p -107.55 162.95 13.49 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.942 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.473 ' HB2' ' HD3' ' A' ' 41' ' ' ARG . 45.4 t -109.15 107.94 18.41 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.421 -174.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.495 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 9.7 tp10 171.26 150.79 0.05 OUTLIER 'General case' 0 C--O 1.237 0.444 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -178.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.533 ' CB ' HD23 ' A' ' 82' ' ' LEU . 96.4 m-20 -59.66 138.64 57.68 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 119.24 -0.984 . . . . 0.0 109.674 175.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.533 HD23 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.58 13.72 8.46 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.963 172.556 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . 0.495 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 7.8 t -71.86 -30.39 65.38 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.33 -173.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.545 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 28.2 p-10 -82.82 40.61 0.69 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.52 0.676 . . . . 0.0 110.362 179.066 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.491 ' HG2' ' N ' ' A' ' 86' ' ' SER . 35.3 ttp180 -72.61 162.97 28.79 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.274 -0.876 . . . . 0.0 109.844 178.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.501 ' HA ' ' CE1' ' A' ' 44' ' ' PHE . 5.7 p -60.5 148.59 37.19 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.272 173.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.492 ' H ' ' CD ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -56.68 -37.09 70.38 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.36 -178.244 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.439 ' HG2' ' OE2' ' A' ' 87' ' ' GLU . 24.9 pt20 . . . . . 0 C--N 1.328 -0.333 0 CA-C-O 121.2 0.524 . . . . 0.0 111.036 176.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 13.8 tpt . . . . . 0 N--CA 1.481 1.083 0 CA-C-O 120.84 0.352 . . . . 0.0 110.069 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.41 ' HA ' ' O ' ' A' ' 35' ' ' CYS . . . 57.05 87.28 0.06 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.981 -176.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.443 HD22 HG21 ' A' ' 40' ' ' THR . 3.3 mm? -64.5 152.29 42.17 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.135 178.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.425 ' HB3' ' CG1' ' A' ' 32' ' ' VAL . 19.0 mtpp -120.95 116.39 25.02 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 119.605 -0.838 . . . . 0.0 111.075 177.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.3 m -140.13 170.09 16.48 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.577 176.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -76.84 132.2 39.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.825 -176.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.3 m -130.07 158.29 40.03 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 175.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.578 ' NH2' ' HA ' ' A' ' 28' ' ' ASP . 15.1 mmm180 -82.06 110.26 17.13 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.94 -179.052 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -117.21 103.97 10.71 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 176.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 69.75 -102.51 0.98 Allowed Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 119.77 -1.205 . . . . 0.0 110.52 -171.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.578 ' HA ' ' NH2' ' A' ' 25' ' ' ARG . 35.7 t70 -129.1 -4.07 5.03 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.611 0.719 . . . . 0.0 109.787 172.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -85.25 153.03 22.88 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.379 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 45.1 mtt180 -96.11 110.53 22.77 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.5 m -113.49 131.44 56.04 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.098 -170.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.425 ' CG1' ' HB3' ' A' ' 21' ' ' LYS . 98.7 t -73.04 105.38 2.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 174.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.5 p -94.82 149.88 20.78 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.622 0.725 . . . . 0.0 111.479 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -72.56 127.16 31.71 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 161.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.41 ' O ' ' HA ' ' A' ' 19' ' ' ALA . 0.8 OUTLIER -110.04 153.25 24.89 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 119.804 -0.758 . . . . 0.0 109.622 -179.252 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.82 164.99 11.33 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -172.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -58.21 -34.24 70.17 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.451 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.611 ' HG3' ' HG3' ' A' ' 39' ' ' GLN . 4.1 pt-20 -60.91 -38.57 86.19 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.42 0.629 . . . . 0.0 110.491 175.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.611 ' HG3' ' HG3' ' A' ' 38' ' ' GLU . 75.4 mt-30 -88.16 74.89 8.72 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.53 -174.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.443 HG21 HD22 ' A' ' 20' ' ' LEU . 0.9 OUTLIER -95.56 16.51 16.94 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.568 0.699 . . . . 0.0 110.33 177.734 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.862 ' HD3' HG23 ' A' ' 58' ' ' VAL . 0.6 OUTLIER -128.35 177.6 6.85 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.471 173.502 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.756 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.9 m -142.3 131.04 22.76 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.095 -178.225 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.486 HD23 HG22 ' A' ' 45' ' ' VAL . 0.2 OUTLIER -95.37 136.73 35.37 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.005 0.431 . . . . 0.0 110.722 -177.231 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.628 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 1.6 t80 -145.16 109.42 4.87 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.196 -0.911 . . . . 0.0 108.781 171.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.531 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 46.0 t -110.09 133.76 54.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.839 179.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.813 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 9.4 mm100 -77.81 140.82 39.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.877 0.37 . . . . 0.0 110.431 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.589 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.2 mm? -128.23 152.17 77.43 Favored Pre-proline 0 C--N 1.319 -0.759 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -70.87 -11.18 29.03 Favored 'Trans proline' 0 CA--C 1.529 0.258 0 C-N-CA 122.391 2.061 . . . . 0.0 112.622 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -135.86 -0.56 2.55 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.52 0.2 . . . . 0.0 111.434 -177.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.589 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 32.6 p -169.57 -163.92 0.41 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -175.154 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -148.5 152.45 36.9 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 177.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.628 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 74.7 mt -105.61 130.4 57.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.368 176.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -139.28 131.32 27.93 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 177.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -167.71 162.07 13.75 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 123.376 0.423 . . . . 0.0 110.706 -178.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 13.3 m -89.12 134.07 34.15 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.128 -0.629 . . . . 0.0 109.465 172.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.4 tppt? -138.46 153.05 48.81 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -176.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 10.9 p -73.62 152.12 40.63 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 119.468 -0.893 . . . . 0.0 109.154 178.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.862 HG23 ' HD3' ' A' ' 41' ' ' ARG . 50.7 t -59.19 -41.54 84.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 120.653 0.263 . . . . 0.0 111.517 -175.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.603 ' HG3' ' N ' ' A' ' 60' ' ' GLN . 12.3 pt20 -69.05 -48.0 63.92 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.663 -177.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.624 ' O ' HG11 ' A' ' 64' ' ' VAL . 0.2 OUTLIER -69.33 -37.49 77.73 Favored 'General case' 0 C--O 1.211 -0.94 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -176.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.663 ' SG ' ' HG2' ' A' ' 41' ' ' ARG . 1.9 p -61.65 -32.7 72.88 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.485 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.9 -47.19 75.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.917 0.389 . . . . 0.0 110.567 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.616 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 8.9 pt-20 -71.55 -37.76 71.07 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.9 -176.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.624 HG11 ' O ' ' A' ' 60' ' ' GLN . 12.1 m -73.59 -26.52 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 121.566 0.698 . . . . 0.0 110.479 176.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.521 HD11 ' HB1' ' A' ' 75' ' ' ALA . 50.4 tp -58.33 -49.75 76.07 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.53 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 41.7 mt-10 -74.33 -33.1 63.06 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.432 -175.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.597 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.4 pt-20 -60.31 -45.85 91.95 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 120.254 -0.578 . . . . 0.0 110.139 -179.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.585 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 35.0 m -79.9 -32.62 14.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 C-N-CA 120.743 -0.383 . . . . 0.0 111.944 -178.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.53 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 21.3 p -71.27 -26.23 62.8 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 120.394 -0.522 . . . . 0.0 110.875 -178.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.64 -22.76 61.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.488 175.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 67' ' ' GLU . 19.0 mt -83.6 -25.68 7.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.767 177.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 121.39 -0.61 11.39 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 119.858 -1.163 . . . . 0.0 112.508 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -85.93 115.27 61.1 Favored Pre-proline 0 N--CA 1.451 -0.385 0 CA-C-N 116.519 0.159 . . . . 0.0 110.863 -179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.813 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 33.6 Cg_exo -63.65 133.16 38.21 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.768 2.312 . . . . 0.0 111.402 174.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.521 ' HB1' HD11 ' A' ' 65' ' ' LEU . . . -146.89 163.32 36.48 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.343 -0.543 . . . . 0.0 111.59 -179.068 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.465 ' CG ' ' HB3' ' A' ' 44' ' ' PHE . 15.5 ptpt -143.99 150.11 37.77 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.638 174.256 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.756 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 27.7 p -139.92 98.21 3.41 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.79 0.805 . . . . 0.0 109.182 161.046 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.2 p -107.61 164.41 12.25 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.782 -178.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 7.5 p -107.93 100.77 10.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.349 0.595 . . . . 0.0 109.517 -178.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.535 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 24.8 tt0 175.13 137.64 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 -172.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.573 ' CB ' HD21 ' A' ' 82' ' ' LEU . 16.5 m-20 -62.06 139.02 58.46 Favored 'General case' 0 CA--C 1.505 -0.758 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.952 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.573 HD21 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.65 13.99 8.71 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.862 174.362 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . 0.535 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 47.4 t -71.43 -19.85 62.19 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.823 0.344 . . . . 0.0 111.59 -174.006 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.451 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 22.8 p-10 -86.15 19.56 2.63 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.596 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.678 ' HD3' ' H ' ' A' ' 85' ' ' ARG . 0.0 OUTLIER -67.01 163.13 20.55 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.093 175.583 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.458 ' HA ' ' CE2' ' A' ' 44' ' ' PHE . 22.7 t -71.5 139.13 49.43 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.129 -0.629 . . . . 0.0 109.313 175.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -88.65 11.28 17.89 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.217 0.532 . . . . 0.0 110.29 -177.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.219 178.746 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 14.5 tpt . . . . . 0 N--CA 1.481 1.111 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -152.67 176.84 11.32 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.6 tp -141.35 130.52 23.44 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 176.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.413 ' O ' ' HA ' ' A' ' 81' ' ' ASP . 26.5 mttt -82.22 141.27 33.13 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.972 178.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.553 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 6.6 t -161.66 153.89 19.7 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.602 -0.439 . . . . 0.0 109.851 -178.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -81.5 128.64 34.11 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.741 -0.383 . . . . 0.0 111.208 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 42.8 m -111.0 134.46 52.58 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 174.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.529 ' HD2' ' HB3' ' A' ' 30' ' ' ARG . 22.9 mmm-85 -85.08 111.53 19.84 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.827 -177.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -92.65 83.36 4.86 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 170.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 64.09 -107.52 1.83 Allowed Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 119.483 -1.341 . . . . 0.0 111.268 -170.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -89.73 -29.96 18.36 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.637 0.256 . . . . 0.0 110.538 177.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -69.86 150.27 46.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.907 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.529 ' HB3' ' HD2' ' A' ' 25' ' ' ARG . 2.2 ptt180 -127.74 113.09 15.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.125 169.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 94.2 m -99.12 138.4 36.27 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.827 -178.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 66.0 t -72.12 106.74 2.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 172.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.0 p -118.75 148.11 43.15 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.886 0.374 . . . . 0.0 111.266 -178.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.6 t -88.0 119.99 28.91 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 175.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.73 147.05 24.75 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 -177.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.82 166.57 19.09 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -172.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -55.75 -36.54 67.39 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.51 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 39' ' ' GLN . 2.9 pt-20 -50.57 -48.31 57.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.741 175.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.653 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 36.6 mt-30 -101.1 78.54 1.92 Allowed 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.141 -176.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.67 12.62 22.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.713 -175.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.999 ' HD3' ' SG ' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -121.51 177.94 5.01 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.377 0.608 . . . . 0.0 110.142 173.908 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.552 ' HB3' ' HB3' ' A' ' 84' ' ' ASN . 66.7 m -129.22 172.83 11.07 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.123 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.569 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.4 OUTLIER -127.98 113.34 15.71 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.533 176.508 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.652 ' HD2' ' HD2' ' A' ' 76' ' ' LYS . 2.6 t80 -124.8 99.52 6.19 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 172.056 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.588 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 19.2 t -104.34 133.0 49.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.054 -0.976 . . . . 0.0 108.741 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.806 ' CG ' ' HB2' ' A' ' 74' ' ' PRO . 0.8 OUTLIER -83.42 141.04 32.0 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 120.006 -0.677 . . . . 0.0 110.001 179.592 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.676 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.7 mm? -133.62 152.02 78.24 Favored Pre-proline 0 C--N 1.317 -0.817 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.29 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -78.57 3.22 7.43 Favored 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 122.755 2.303 . . . . 0.0 111.583 171.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -124.25 -31.99 3.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.875 -176.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.676 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 11.4 p -169.36 -154.95 0.13 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.636 -173.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.79 131.83 26.23 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.409 176.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.588 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 26.5 mm -82.54 129.12 37.99 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.204 176.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.623 ' HB3' ' ND2' ' A' ' 84' ' ' ASN . 6.5 mt-30 -135.84 131.85 35.87 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -167.25 150.21 6.26 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 123.529 0.518 . . . . 0.0 109.781 -170.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.553 ' SG ' ' HB3' ' A' ' 22' ' ' CYS . 6.4 m -93.01 132.39 37.15 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 172.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.415 ' HB2' ' HE2' ' A' ' 56' ' ' LYS . 3.3 tppt? -138.94 156.22 47.43 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 119.027 -1.069 . . . . 0.0 110.686 -178.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.653 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 35.4 p -66.28 153.41 42.67 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 177.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.601 ' HA ' ' HG3' ' A' ' 41' ' ' ARG . 20.9 t -59.29 -47.58 89.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 120.997 0.427 . . . . 0.0 110.663 -175.068 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -56.94 -55.72 30.9 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.054 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.62 ' O ' HG11 ' A' ' 64' ' ' VAL . 20.6 mt-30 -68.66 -25.56 64.87 Favored 'General case' 0 C--O 1.2 -1.552 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.605 -174.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.512 ' SG ' ' HG3' ' A' ' 41' ' ' ARG . 0.6 OUTLIER -63.35 -33.88 76.51 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.115 -0.634 . . . . 0.0 109.891 178.519 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.56 -39.62 73.84 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.091 0.472 . . . . 0.0 110.225 174.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -62.46 -52.42 63.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.834 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.62 HG11 ' O ' ' A' ' 60' ' ' GLN . 16.2 m -68.71 -28.15 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.397 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.503 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 28.8 tp -58.02 -49.74 75.82 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 176.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.565 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 39.7 tt0 -73.88 -36.03 64.76 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.363 -175.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -58.24 -43.68 87.91 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.276 -177.182 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.541 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.0 m -79.7 -31.73 14.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 C-N-CA 120.48 -0.488 . . . . 0.0 111.714 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.565 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 37.7 p -72.98 -21.29 60.88 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.995 -179.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.09 -19.99 59.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.088 0.47 . . . . 0.0 110.27 176.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 10.7 mt -86.24 -15.92 9.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.334 176.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 108.9 -0.31 31.85 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.366 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -90.72 116.56 66.67 Favored Pre-proline 0 N--CA 1.448 -0.525 0 CA-C-O 120.692 0.282 . . . . 0.0 111.221 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.806 ' HB2' ' CG ' ' A' ' 46' ' ' GLN . 52.8 Cg_exo -58.24 140.66 95.13 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 123.169 2.579 . . . . 0.0 112.124 175.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.434 ' HB1' HD12 ' A' ' 65' ' ' LEU . . . -148.79 168.62 22.46 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.614 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.652 ' HD2' ' HD2' ' A' ' 44' ' ' PHE . 6.0 ptpp? -154.34 139.08 17.05 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.749 171.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 31.0 p -116.81 104.86 11.75 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 166.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.2 p -106.72 162.27 13.92 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 119.929 -0.708 . . . . 0.0 112.089 -178.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.999 ' SG ' ' HD3' ' A' ' 41' ' ' ARG . 33.6 m -109.24 101.57 10.58 Favored 'General case' 0 CA--C 1.523 -0.076 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.909 175.009 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.565 ' HB3' ' HB3' ' A' ' 83' ' ' CYS . 16.0 tt0 176.85 141.46 0.07 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -177.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.572 ' CB ' HD23 ' A' ' 82' ' ' LEU . 15.9 m-20 -58.64 129.55 42.62 Favored 'General case' 0 CA--C 1.503 -0.828 0 C-N-CA 119.641 -0.824 . . . . 0.0 110.095 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.572 HD23 ' CB ' ' A' ' 81' ' ' ASP . 0.3 OUTLIER 64.77 15.81 10.03 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.927 173.278 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . 0.565 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . 9.9 p -63.24 -22.33 66.8 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.896 0.379 . . . . 0.0 111.701 -171.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.623 ' ND2' ' HB3' ' A' ' 53' ' ' GLN . 35.9 p-10 -76.72 16.23 0.54 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.039 0.447 . . . . 0.0 111.116 -177.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.444 ' H ' ' C ' ' A' ' 83' ' ' CYS . 7.9 ptt180 -82.89 -34.4 26.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.085 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 52.2 m -154.42 -175.79 5.57 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.375 -174.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.411 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 41.5 mm-40 -63.83 -31.11 72.19 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.587 -177.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 17.8 mm100 . . . . . 0 N--CA 1.464 0.244 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.217 179.172 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 15.0 tpt . . . . . 0 N--CA 1.482 1.149 0 CA-C-O 120.331 0.11 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.28 146.0 39.25 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.161 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.411 ' HG ' ' N ' ' A' ' 21' ' ' LYS . 32.1 tp -139.95 170.05 16.57 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -178.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.411 ' N ' ' HG ' ' A' ' 20' ' ' LEU . 11.5 mtpt -125.89 114.15 18.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.04 177.149 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.609 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 12.9 m -128.43 158.5 38.15 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 174.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.419 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 15.6 m-85 -72.41 120.76 18.46 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.659 -0.416 . . . . 0.0 109.971 173.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 88.2 m -111.15 142.75 42.92 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 176.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.46 ' HA ' ' O ' ' A' ' 29' ' ' ASP . 8.8 mmm180 -84.52 110.58 18.79 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.883 -177.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -96.82 85.65 3.85 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 174.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 73.37 -105.71 1.83 Allowed Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 119.659 -1.257 . . . . 0.0 111.066 -172.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -102.09 -10.67 19.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.905 0.383 . . . . 0.0 110.149 177.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.46 ' O ' ' HA ' ' A' ' 25' ' ' ARG . 2.3 t70 -82.8 148.09 27.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.192 -178.081 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 -127.78 113.64 16.23 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.003 166.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.433 HG23 ' OD1' ' A' ' 29' ' ' ASP . 1.2 p -129.48 169.33 15.09 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.565 -178.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 53.8 t -72.11 121.24 22.01 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.408 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.2 p -123.14 132.59 54.13 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 119.994 -0.683 . . . . 0.0 110.674 174.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 t -76.42 113.97 14.6 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 170.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.76 170.23 11.4 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.878 -170.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.42 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -66.81 166.35 13.43 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.502 -179.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.06 -19.94 56.46 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.723 -166.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.42 ' OE2' ' HB3' ' A' ' 36' ' ' ALA . 3.2 pm0 -81.96 -22.85 36.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.284 0.564 . . . . 0.0 109.611 176.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.424 ' OE1' ' HB2' ' A' ' 55' ' ' CYS . 8.3 mt-30 -72.89 121.55 20.2 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.193 176.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.53 ' OG1' HG23 ' A' ' 58' ' ' VAL . 0.5 OUTLIER -134.51 4.83 3.41 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.327 -0.852 . . . . 0.0 111.597 -170.39 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.76 ' CG ' ' HA ' ' A' ' 58' ' ' VAL . 6.1 mmm180 -138.49 178.48 7.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.633 0.73 . . . . 0.0 110.09 175.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.517 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 8.8 m -132.36 131.5 41.94 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 114.437 -1.256 . . . . 0.0 109.044 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.478 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.2 OUTLIER -91.75 130.44 37.54 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 121.031 -0.267 . . . . 0.0 110.306 179.504 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.781 ' HD2' ' HG3' ' A' ' 76' ' ' LYS . 57.1 t80 -128.45 100.9 5.96 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.28 170.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.586 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 16.8 t -99.44 129.95 49.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 174.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.888 ' HB3' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -99.04 116.77 32.04 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.197 -178.541 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.604 ' HB2' ' O ' ' A' ' 50' ' ' SER . 1.8 mm? -114.94 156.93 44.5 Favored Pre-proline 0 C--N 1.327 -0.38 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 -176.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -75.49 18.98 0.55 Allowed 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 122.877 2.385 . . . . 0.0 112.391 175.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -136.55 -55.75 0.74 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.517 0.675 . . . . 0.0 109.44 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.604 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 41.5 p -148.26 -162.58 1.58 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.968 -1.015 . . . . 0.0 108.283 176.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.464 ' HA ' HD23 ' A' ' 47' ' ' LEU . 2.3 mp0 -131.14 147.32 52.59 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 118.434 -1.306 . . . . 0.0 110.9 177.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.586 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 52.0 mm -93.77 132.11 38.83 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.909 176.014 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.478 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 14.9 mt-30 -141.67 130.88 23.45 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 120.04 -0.664 . . . . 0.0 109.406 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.439 ' CD ' ' HZ2' ' A' ' 56' ' ' LYS . 2.6 pt-20 -163.03 153.87 16.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.245 -176.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.718 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 79.1 m -82.04 125.22 30.56 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.294 169.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.718 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 11.3 mptt -132.71 -179.17 5.3 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 173.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.419 HG22 ' HG2' ' A' ' 38' ' ' GLU . 16.1 p -86.06 169.05 13.52 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 119.274 -0.971 . . . . 0.0 108.744 177.402 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.76 ' HA ' ' CG ' ' A' ' 41' ' ' ARG . 66.8 t -61.16 -50.25 81.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 C-N-CA 119.583 -0.847 . . . . 0.0 110.102 178.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -56.53 -54.37 46.61 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.863 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.549 ' HA ' ' OE1' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -58.91 -34.91 72.24 Favored 'General case' 0 C--O 1.204 -1.326 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.964 -177.637 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.542 ' HA ' ' CG2' ' A' ' 64' ' ' VAL . 0.5 OUTLIER -68.22 -34.21 75.82 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.055 -175.921 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.71 -35.8 67.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.347 0.594 . . . . 0.0 109.611 176.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.549 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 74.8 mt-10 -65.91 -52.02 53.64 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.814 -1.084 . . . . 0.0 110.943 178.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.598 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 33.4 m -68.44 -28.7 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.54 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.277 178.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.466 HD11 ' HB1' ' A' ' 75' ' ' ALA . 46.5 tp -58.03 -50.9 71.83 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 176.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.563 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 40.8 tt0 -74.2 -33.88 63.55 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.183 -174.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.598 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -60.19 -44.61 94.95 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.313 -177.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.536 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 28.4 m -80.37 -28.42 11.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.938 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.563 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 31.0 p -75.48 -22.47 57.19 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.842 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.15 -18.43 61.88 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.184 0.516 . . . . 0.0 110.285 176.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 19.2 mt -86.37 -18.34 8.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.504 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 107.67 3.76 34.61 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.182 -1.008 . . . . 0.0 112.498 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -90.24 134.11 32.02 Favored Pre-proline 0 N--CA 1.447 -0.603 0 CA-C-O 120.808 0.337 . . . . 0.0 111.478 -178.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.888 ' HB2' ' HB3' ' A' ' 46' ' ' GLN . 79.7 Cg_exo -56.17 130.79 42.06 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.598 2.865 . . . . 0.0 112.054 173.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.508 ' C ' ' HG2' ' A' ' 76' ' ' LYS . . . -149.16 156.63 42.46 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.711 -0.796 . . . . 0.0 111.861 179.166 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.781 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -153.85 155.52 35.91 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.243 174.943 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.517 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 26.9 p -137.46 115.72 11.79 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.627 0.727 . . . . 0.0 109.901 166.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.1 p -108.17 172.48 6.81 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.891 -176.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.431 ' HB2' ' CD ' ' A' ' 41' ' ' ARG . 52.9 t -131.14 100.97 5.39 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.13 178.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.578 ' HB3' ' HB3' ' A' ' 83' ' ' CYS . 14.1 tt0 174.81 148.73 0.08 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 -175.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.525 ' CB ' HD23 ' A' ' 82' ' ' LEU . 1.0 OUTLIER -55.93 124.02 16.27 Favored 'General case' 0 CA--C 1.509 -0.598 0 C-N-CA 119.805 -0.758 . . . . 0.0 110.365 179.079 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.62 HD11 ' N ' ' A' ' 82' ' ' LEU . 0.1 OUTLIER 66.02 16.06 10.31 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.752 169.713 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . 0.578 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . 21.3 p -64.53 -29.57 70.6 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -171.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.452 ' ND2' ' HB3' ' A' ' 53' ' ' GLN . 29.5 p-10 -76.11 18.01 0.31 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.17 0.51 . . . . 0.0 110.773 -178.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.471 ' H ' ' C ' ' A' ' 83' ' ' CYS . 7.3 ptp85 -63.8 -29.89 71.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.164 171.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 45.3 m -156.75 -160.23 0.95 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.459 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.491 ' HG2' ' HD2' ' A' ' 76' ' ' LYS . 32.8 mt-10 -66.37 -52.94 41.73 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.291 175.35 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . 0.822 HE21 ' HA ' ' A' ' 88' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.449 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.878 177.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.482 1.137 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 178.28 154.89 0.37 Allowed 'General case' 0 CA--C 1.516 -0.336 0 O-C-N 123.894 0.746 . . . . 0.0 110.032 173.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.6 tp -124.6 145.4 49.63 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 173.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.529 ' HE2' HG13 ' A' ' 32' ' ' VAL . 36.6 mtpt -107.0 104.36 14.01 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 118.867 -1.133 . . . . 0.0 111.685 -177.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.5 m -103.47 152.46 21.63 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 176.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.494 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 58.5 m-85 -71.65 149.67 45.34 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.565 176.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -121.29 132.03 54.55 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.052 172.194 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -86.37 111.89 20.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.574 -175.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -144.69 112.43 6.25 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.194 -178.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.4 ' C ' ' H ' ' A' ' 29' ' ' ASP . . . 62.02 34.08 87.77 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.23 -0.986 . . . . 0.0 112.484 179.151 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.6 t70 68.04 1.43 2.76 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.841 0.857 . . . . 0.0 111.326 -176.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.4 ' H ' ' C ' ' A' ' 27' ' ' GLY . 15.7 t70 -85.33 151.14 24.26 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 169.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 30' ' ' ARG . 8.7 ptp180 -116.57 110.79 19.01 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 119.07 -1.052 . . . . 0.0 108.623 174.355 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.9 m -93.98 127.95 40.04 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.645 -172.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.529 HG13 ' HE2' ' A' ' 21' ' ' LYS . 25.0 t -75.93 104.02 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 176.186 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.425 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 1.3 p -115.82 149.24 38.9 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.652 -174.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.7 t -90.4 136.43 33.06 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.851 178.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -127.37 148.85 50.26 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 -178.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.528 ' HB2' ' OE2' ' A' ' 38' ' ' GLU . . . -82.89 -176.75 6.47 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -168.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.36 -43.83 92.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.597 -1.183 . . . . 0.0 112.715 -173.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.601 ' OE2' ' HG3' ' A' ' 39' ' ' GLN . 4.2 pm0 -62.63 -24.47 67.61 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.019 0.438 . . . . 0.0 110.027 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.715 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 37.4 mt-30 -110.1 52.39 0.73 Allowed 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.876 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -79.85 25.64 0.35 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.145 0.498 . . . . 0.0 111.445 178.031 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.721 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 16.1 mmt85 -131.34 179.52 5.98 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.752 172.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.716 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 62.7 m -142.95 131.49 22.4 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.625 -174.008 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.414 HD23 ' SG ' ' A' ' 61' ' ' CYS . 0.5 OUTLIER -100.39 127.68 46.64 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.983 0.421 . . . . 0.0 111.103 -175.697 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.645 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 40.7 t80 -142.35 115.6 8.92 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.588 174.097 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.426 ' HA ' ' HA ' ' A' ' 75' ' ' ALA . 58.2 t -105.92 138.04 33.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 C-N-CA 120.452 -0.499 . . . . 0.0 109.895 179.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.744 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 7.4 mm100 -74.93 137.45 41.67 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 120.094 -0.642 . . . . 0.0 109.944 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.511 ' HB2' ' C ' ' A' ' 50' ' ' SER . 3.3 mm? -131.85 143.13 47.79 Favored Pre-proline 0 C--N 1.312 -1.03 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.015 171.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 12.0 Cg_exo -72.12 -3.33 13.09 Favored 'Trans proline' 0 CA--C 1.529 0.254 0 C-N-CA 122.836 2.357 . . . . 0.0 112.776 -179.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 28.4 p90 -149.65 5.91 0.62 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.951 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.511 ' C ' ' HB2' ' A' ' 47' ' ' LEU . 66.8 m -161.67 -162.09 0.84 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -176.193 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.414 ' OE1' ' HB3' ' A' ' 86' ' ' SER . 14.2 pt-20 -163.8 147.34 10.01 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 174.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.645 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 67.5 mt -106.07 136.85 38.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 177.722 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -146.83 129.9 16.42 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -177.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.536 ' HG3' ' HE2' ' A' ' 56' ' ' LYS . 7.0 pt-20 -179.26 157.26 0.8 Allowed 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.558 0.536 . . . . 0.0 109.965 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 2.8 m -81.34 141.4 34.06 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 119.809 -0.756 . . . . 0.0 109.121 175.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.536 ' HE2' ' HG3' ' A' ' 54' ' ' GLU . 69.6 mmtt -135.87 155.09 50.85 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.715 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 27.7 p -68.83 146.09 53.16 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 118.697 -1.201 . . . . 0.0 108.792 176.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.546 HG21 ' HG2' ' A' ' 41' ' ' ARG . 29.8 t -46.37 -54.73 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 O-C-N 123.461 0.476 . . . . 0.0 111.377 -173.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -63.09 -55.85 21.89 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.586 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.76 ' O ' HG12 ' A' ' 64' ' ' VAL . 99.1 mt-30 -64.51 -26.58 68.49 Favored 'General case' 0 C--O 1.204 -1.317 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.495 -174.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.537 ' HA ' HG21 ' A' ' 64' ' ' VAL . 8.7 t -71.77 -33.63 68.78 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 177.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.07 -34.5 73.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.085 0.469 . . . . 0.0 109.867 172.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -64.97 -51.24 62.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.664 176.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.76 HG12 ' O ' ' A' ' 60' ' ' GLN . 14.1 m -67.49 -27.06 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.251 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.499 HD12 ' HB2' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.48 -49.26 76.86 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 173.443 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -73.33 -34.16 65.53 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.144 -174.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.9 pt-20 -60.15 -42.15 94.3 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 120.034 -0.667 . . . . 0.0 110.068 -178.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.503 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.5 m -79.91 -36.67 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 CA-C-O 120.779 0.323 . . . . 0.0 111.796 179.193 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 96.0 m -71.98 -29.46 64.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.206 -175.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.94 -23.75 64.19 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.562 174.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.514 HG13 ' O ' ' A' ' 67' ' ' GLU . 18.6 mt -79.11 -26.02 13.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.323 0.582 . . . . 0.0 109.739 176.388 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.468 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 114.25 2.11 23.33 Favored Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 119.838 -1.172 . . . . 0.0 112.035 -177.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -96.03 107.31 33.89 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-O 120.555 0.217 . . . . 0.0 110.602 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.744 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 77.8 Cg_exo -56.74 134.65 65.82 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 123.257 2.638 . . . . 0.0 112.979 178.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.499 ' HB2' HD12 ' A' ' 65' ' ' LEU . . . -130.79 161.25 32.15 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.847 174.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -130.05 140.06 50.9 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.533 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.721 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 6.1 t -150.72 109.65 3.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.137 0.494 . . . . 0.0 109.793 173.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.3 p -136.43 172.3 13.22 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.321 -171.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.575 ' SG ' ' HD3' ' A' ' 41' ' ' ARG . 55.7 m -107.88 101.9 11.14 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.074 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.505 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 7.5 tp10 179.06 142.15 0.12 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -176.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.557 ' CB ' HD21 ' A' ' 82' ' ' LEU . 43.7 m-20 -62.9 137.95 58.41 Favored 'General case' 0 CA--C 1.505 -0.776 0 C-N-CA 118.278 -1.369 . . . . 0.0 109.349 177.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.557 HD21 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 62.68 21.75 12.92 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.902 175.292 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . 0.505 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 6.4 t -69.62 -31.17 69.14 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.68 -174.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.585 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 28.7 p-10 -79.21 73.56 5.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 122.202 1.001 . . . . 0.0 108.909 174.353 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.489 ' HB2' ' O ' ' A' ' 82' ' ' LEU . 20.3 ttm180 -116.9 154.19 31.25 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.496 -168.007 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.414 ' HB3' ' OE1' ' A' ' 51' ' ' GLU . 14.8 p -73.05 95.61 2.05 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.171 176.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.62 -32.54 11.03 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.635 -177.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 . . . . . 0 N--CA 1.472 0.647 0 O-C-N 123.935 0.772 . . . . 0.0 112.381 177.166 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.414 ' SD ' ' N ' ' A' ' 18' ' ' MET . 0.8 OUTLIER . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 120.829 0.347 . . . . 0.0 110.772 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.448 ' HB3' ' O ' ' A' ' 35' ' ' CYS . . . -52.36 132.04 33.91 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.537 176.32 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 35.6 tp -106.61 144.17 33.66 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -177.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.503 ' HG2' ' HB ' ' A' ' 34' ' ' THR . 33.4 mtmm -102.25 114.24 28.23 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.021 -178.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 18.0 m -113.46 173.42 6.42 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.603 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 46.2 m-85 -82.95 136.08 34.67 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 173.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.7 p -116.24 130.53 56.83 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 173.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.486 ' HA ' ' O ' ' A' ' 29' ' ' ASP . 7.8 tpt180 -97.04 110.99 23.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.536 -176.562 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -140.01 130.41 25.4 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 65.14 22.11 68.66 Favored Glycine 0 C--O 1.229 -0.214 0 C-N-CA 119.554 -1.308 . . . . 0.0 111.203 -173.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.1 t70 64.83 15.28 9.76 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.111 0.964 . . . . 0.0 111.224 -175.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.486 ' O ' ' HA ' ' A' ' 25' ' ' ARG . 11.9 t70 -94.33 150.18 20.53 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 171.119 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.406 ' HB3' ' OE1' ' A' ' 53' ' ' GLN . 30.2 ptt180 -114.83 111.7 21.62 Favored 'General case' 0 C--N 1.32 -0.681 0 C-N-CA 119.137 -1.025 . . . . 0.0 109.749 176.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -113.09 146.72 38.68 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.929 -173.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.404 HG13 HD12 ' A' ' 82' ' ' LEU . 94.4 t -80.96 108.11 13.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.029 175.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.1 p -119.4 148.37 43.29 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.853 0.359 . . . . 0.0 110.271 176.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.503 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 3.1 t -91.63 115.59 28.17 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.094 -0.642 . . . . 0.0 109.87 177.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.448 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 0.2 OUTLIER -87.98 160.44 17.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.41 -0.813 . . . . 0.0 109.186 -176.74 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.574 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -74.89 -179.19 4.1 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.243 -0.583 . . . . 0.0 112.423 -169.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -63.83 -37.26 86.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.377 -172.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.574 ' OE2' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -76.11 -25.84 55.81 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.254 -174.028 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.6 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 40.4 mt-30 -98.24 80.68 2.69 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.366 0.603 . . . . 0.0 110.392 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.54 21.29 9.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.261 -0.882 . . . . 0.0 112.103 -176.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.787 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 15.8 mmt85 -126.82 179.69 5.25 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 119.956 -0.698 . . . . 0.0 109.947 171.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.692 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 63.8 m -139.73 131.88 28.09 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.54 -173.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.488 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 1.0 OUTLIER -103.69 130.64 51.2 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.673 0.273 . . . . 0.0 111.081 -171.899 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.71 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 1.2 t80 -146.75 104.05 3.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.331 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.563 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 46.3 t -102.48 136.14 36.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.922 178.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.787 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 10.5 mm100 -76.59 140.24 40.97 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.962 0.41 . . . . 0.0 110.791 -178.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.509 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.0 mm? -132.09 153.95 81.51 Favored Pre-proline 0 C--N 1.321 -0.656 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 174.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -74.63 18.17 0.52 Allowed 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 122.941 2.427 . . . . 0.0 113.018 179.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -160.46 -48.31 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.929 0.395 . . . . 0.0 110.634 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.509 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 20.5 m -120.55 -153.17 0.53 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.74 178.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -155.64 144.61 20.63 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.71 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 69.1 mt -89.84 128.95 41.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.381 -0.527 . . . . 0.0 109.761 176.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.488 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 49.0 mt-30 -139.48 131.53 27.94 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -177.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.874 ' HG2' ' HE2' ' A' ' 56' ' ' LYS . 1.1 tp10 -170.42 153.89 4.51 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -168.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 4.9 m -93.17 128.41 39.11 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 119.689 -0.805 . . . . 0.0 108.895 173.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.874 ' HE2' ' HG2' ' A' ' 54' ' ' GLU . 57.8 mmtt -131.12 147.65 52.64 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.6 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 46.0 p -62.8 153.67 32.25 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 174.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.581 ' HA ' ' HG3' ' A' ' 41' ' ' ARG . 40.9 t -49.67 -48.15 21.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 123.238 0.336 . . . . 0.0 110.87 -176.184 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -65.83 -56.11 13.57 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.464 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.698 ' O ' HG12 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -58.43 -34.12 70.45 Favored 'General case' 0 C--O 1.21 -0.995 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.803 -175.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.54 ' HA ' HG22 ' A' ' 64' ' ' VAL . 4.3 t -72.6 -33.4 66.68 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.613 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.85 -36.76 73.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.276 0.56 . . . . 0.0 109.698 173.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.563 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 92.6 mt-10 -59.99 -52.8 63.83 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.459 175.614 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.698 HG12 ' O ' ' A' ' 60' ' ' GLN . 17.9 m -70.38 -27.41 31.56 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.618 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.615 -178.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.517 HD12 ' HB3' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -59.3 -50.63 73.24 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 175.847 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -73.85 -33.28 64.04 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.944 -173.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.592 ' O ' HG13 ' A' ' 71' ' ' ILE . 11.9 pt-20 -60.28 -43.31 96.35 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.097 -179.234 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.51 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.0 m -79.76 -35.86 16.77 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.738 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 99.4 m -71.84 -27.71 63.07 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.983 -176.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.18 -23.52 61.28 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.484 173.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.592 HG13 ' O ' ' A' ' 67' ' ' GLU . 43.6 mt -78.21 -32.49 17.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.342 0.592 . . . . 0.0 109.971 177.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.465 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 121.0 2.34 11.19 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.21 -0.995 . . . . 0.0 111.757 -176.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -97.86 106.61 35.18 Favored Pre-proline 0 N--CA 1.448 -0.53 0 CA-C-O 120.629 0.252 . . . . 0.0 110.824 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.787 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 79.2 Cg_exo -54.61 133.83 58.98 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 123.183 2.589 . . . . 0.0 112.846 177.219 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.517 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -130.49 157.13 43.5 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.234 -0.587 . . . . 0.0 110.937 174.248 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.1 mmtp -128.69 143.09 50.86 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.535 -179.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.787 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 8.4 t -156.27 112.29 3.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.919 0.39 . . . . 0.0 110.392 176.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 3.8 p -143.77 173.28 11.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.002 -174.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.574 ' SG ' ' HD3' ' A' ' 41' ' ' ARG . 57.6 m -108.07 104.09 13.45 Favored 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.514 -175.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.469 ' HG3' ' HB2' ' A' ' 83' ' ' CYS . 0.0 OUTLIER 177.22 161.72 0.46 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 173.557 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.539 ' C ' HD23 ' A' ' 82' ' ' LEU . 56.7 m-20 -68.22 135.24 51.7 Favored 'General case' 0 CA--C 1.501 -0.915 0 C-N-CA 117.023 -1.871 . . . . 0.0 109.558 -179.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.676 ' O ' ' HB2' ' A' ' 85' ' ' ARG . 0.2 OUTLIER 63.9 22.21 12.92 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.626 175.364 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . 0.469 ' HB2' ' HG3' ' A' ' 80' ' ' GLU . 4.3 t -64.5 -27.61 69.09 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.891 0.377 . . . . 0.0 111.049 -174.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.597 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 27.7 p-10 -78.27 70.07 4.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 122.419 1.104 . . . . 0.0 108.677 172.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.676 ' HB2' ' O ' ' A' ' 82' ' ' LEU . 30.4 ttp180 -117.94 133.87 55.5 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 113.963 -1.471 . . . . 0.0 111.088 -166.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.415 ' HA ' ' CZ ' ' A' ' 44' ' ' PHE . 0.9 OUTLIER -64.41 143.3 58.0 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.78 -1.1 . . . . 0.0 111.383 -176.2 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -70.75 -47.91 57.18 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 176.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 . . . . . 0 N--CA 1.471 0.614 0 O-C-N 124.341 1.026 . . . . 0.0 112.849 173.573 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 91.0 mtp . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 110.356 -0.238 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 35' ' ' CYS . . . -63.79 121.11 13.22 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 123.687 0.617 . . . . 0.0 110.9 176.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.592 HD21 ' H ' ' A' ' 80' ' ' GLU . 21.8 tp -103.24 117.51 34.68 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -177.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.582 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 28.8 mtmm -82.67 114.76 21.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.267 0.556 . . . . 0.0 111.403 -175.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.7 m -113.27 162.57 15.87 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.794 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.487 ' CD1' ' HB2' ' A' ' 85' ' ' ARG . 34.7 m-85 -79.33 138.87 37.88 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.618 176.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 32.2 m -129.0 131.83 47.46 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.3 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.697 HH11 ' HB2' ' A' ' 51' ' ' GLU . 30.8 mtp180 -88.52 111.44 21.85 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 119.923 -0.711 . . . . 0.0 111.749 -176.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -110.18 118.65 36.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.121 174.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.51 -77.1 2.01 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 119.618 -1.277 . . . . 0.0 110.958 -174.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -150.2 -45.16 0.13 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.656 0.265 . . . . 0.0 110.619 174.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.435 ' O ' ' HA ' ' A' ' 25' ' ' ARG . 2.1 p-10 -65.08 171.28 3.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.346 0.593 . . . . 0.0 110.725 -177.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -120.64 113.9 20.92 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 119.774 -0.771 . . . . 0.0 109.33 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.5 m -100.63 145.15 28.75 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.731 -175.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 96.8 t -72.46 106.93 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 31.2 p -104.26 137.4 42.23 Favored 'General case' 0 C--N 1.314 -0.955 0 C-N-CA 120.069 -0.652 . . . . 0.0 110.346 175.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.582 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.7 t -86.37 111.99 21.03 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 121.634 0.73 . . . . 0.0 109.404 176.14 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.513 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -89.28 172.88 8.72 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.089 -173.017 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.89 166.35 20.98 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.291 -0.564 . . . . 0.0 111.147 -175.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -51.98 -26.98 11.8 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.37 176.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.483 ' HG2' ' CG2' ' A' ' 57' ' ' THR . 27.6 tt0 -62.62 -39.68 94.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.012 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.461 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 16.5 mm-40 -82.04 100.66 9.86 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 118.904 -1.118 . . . . 0.0 109.675 -178.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.414 ' OG1' HG22 ' A' ' 58' ' ' VAL . 0.7 OUTLIER -101.58 21.71 13.9 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.591 0.71 . . . . 0.0 110.04 175.537 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.88 ' HG3' ' HB2' ' A' ' 77' ' ' CYS . 1.2 tpt180 -152.4 177.76 10.26 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.741 -176.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.592 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 79.4 m -141.34 131.88 25.41 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 179.537 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.412 HD22 HG22 ' A' ' 45' ' ' VAL . 0.3 OUTLIER -94.93 130.47 41.55 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 -178.881 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.488 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 18.6 t80 -139.54 113.51 8.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.86 170.318 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.617 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 22.0 t -108.72 133.84 52.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 176.634 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.873 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -90.03 132.36 35.42 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 119.397 -0.921 . . . . 0.0 110.455 177.296 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.5 mm? -121.06 152.03 56.12 Favored Pre-proline 0 C--N 1.319 -0.739 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -66.51 -17.25 53.04 Favored 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.46 2.106 . . . . 0.0 112.713 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -134.93 -2.43 2.6 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.526 -177.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.598 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 49.1 m -157.97 -168.61 2.56 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.188 -174.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.697 ' HB2' HH11 ' A' ' 25' ' ' ARG . 18.4 mt-10 -147.01 148.06 31.31 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 176.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.617 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 26.8 mm -109.28 129.18 64.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 175.484 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.518 ' NE2' ' HA ' ' A' ' 85' ' ' ARG . 51.2 mt-30 -140.93 130.27 23.7 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.171 -0.612 . . . . 0.0 110.203 179.37 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.426 ' CD ' ' HZ2' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -162.11 158.03 24.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.661 -179.328 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.488 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 8.3 m -80.42 118.34 21.96 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 166.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.488 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 12.1 mptt -124.25 147.88 47.76 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.605 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.483 ' CG2' ' HG2' ' A' ' 38' ' ' GLU . 18.2 p -68.34 164.3 21.14 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.414 HG22 ' OG1' ' A' ' 40' ' ' THR . 57.8 t -59.1 -43.27 88.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 119.261 -0.976 . . . . 0.0 110.33 177.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -64.09 -54.57 31.86 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.748 179.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.644 ' O ' HG12 ' A' ' 64' ' ' VAL . 33.6 tt0 -61.58 -32.8 72.91 Favored 'General case' 0 C--O 1.206 -1.219 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.247 -174.37 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.687 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 0.6 OUTLIER -66.12 -33.42 75.74 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.13 -0.628 . . . . 0.0 110.18 178.845 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.91 -41.54 74.55 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.043 0.449 . . . . 0.0 109.943 174.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.538 ' OE2' ' HA ' ' A' ' 60' ' ' GLN . 44.9 mt-10 -56.53 -53.34 58.65 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.545 176.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.644 HG12 ' O ' ' A' ' 60' ' ' GLN . 15.3 m -73.77 -27.63 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.656 0 CA-C-N 114.659 -1.155 . . . . 0.0 111.693 -176.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.687 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 6.7 tp -59.78 -50.5 73.58 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 179.144 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -74.72 -34.99 62.67 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.465 -0.788 . . . . 0.0 112.218 -176.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.602 ' HG3' ' N ' ' A' ' 68' ' ' VAL . 11.4 pt-20 -58.0 -47.27 83.52 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.529 -177.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.602 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 33.4 m -80.54 -34.13 14.2 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.833 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 32.5 m -72.16 -23.89 61.35 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 120.606 -0.438 . . . . 0.0 111.157 -177.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.39 -21.35 62.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.119 0.485 . . . . 0.0 110.099 174.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 67' ' ' GLU . 12.2 mt -86.99 -19.2 8.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.542 176.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 111.18 12.57 15.25 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.09 -1.052 . . . . 0.0 112.362 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -98.65 118.66 62.8 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 120.911 0.386 . . . . 0.0 111.289 -178.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.873 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 46.4 Cg_exo -64.23 123.3 11.62 Favored 'Trans proline' 0 CA--C 1.519 -0.232 0 C-N-CA 123.585 2.857 . . . . 0.0 112.569 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -135.59 155.76 49.95 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 120.481 -0.487 . . . . 0.0 111.509 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.546 ' HZ3' ' CD ' ' A' ' 87' ' ' GLU . 0.0 OUTLIER -139.75 152.06 46.31 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.348 0.594 . . . . 0.0 111.278 172.977 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.88 ' HB2' ' HG3' ' A' ' 41' ' ' ARG . 2.6 p -129.73 115.89 17.97 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.695 161.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.6 p -106.56 159.01 16.5 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.798 176.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.436 ' SG ' ' CD ' ' A' ' 41' ' ' ARG . 28.2 m -108.81 101.17 10.3 Favored 'General case' 0 CA--C 1.521 -0.135 0 C-N-CA 120.282 -0.567 . . . . 0.0 109.7 177.17 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.592 ' H ' HD21 ' A' ' 20' ' ' LEU . 9.0 tp10 173.74 144.16 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.557 ' CB ' HD21 ' A' ' 82' ' ' LEU . 58.5 m-20 -60.14 139.73 57.34 Favored 'General case' 0 CA--C 1.511 -0.519 0 C-N-CA 118.937 -1.105 . . . . 0.0 109.614 177.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.557 HD21 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 66.73 13.88 9.55 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.51 170.9 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . 0.485 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . 9.2 p -77.91 -32.33 51.64 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.268 -173.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.524 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 22.1 p-10 -80.03 18.64 0.8 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.935 0.397 . . . . 0.0 111.157 -174.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.518 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 9.6 ttm180 -92.56 -50.23 5.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.436 -176.197 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.4 p -157.04 120.12 4.07 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.379 -174.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.546 ' CD ' ' HZ3' ' A' ' 76' ' ' LYS . 11.8 pt-20 -87.86 -23.67 23.91 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.113 0.482 . . . . 0.0 110.465 178.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.175 178.362 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 27.0 ttt . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 110.381 -0.229 . . . . 0.0 110.381 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.93 124.95 24.42 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.864 176.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.0 tp -111.28 158.26 19.2 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.165 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.467 ' O ' HD12 ' A' ' 82' ' ' LEU . 9.4 mtmp? -113.45 109.12 18.16 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 119.643 -0.823 . . . . 0.0 111.056 175.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 19.6 m -112.29 154.67 25.3 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 175.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.562 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 11.6 m-85 -70.48 134.11 47.44 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.825 -0.75 . . . . 0.0 109.93 175.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.5 m -132.07 129.33 39.85 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.218 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.763 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 1.9 mtt-85 -83.44 109.77 17.61 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 119.579 -0.848 . . . . 0.0 109.747 175.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.402 HD22 HG22 ' A' ' 31' ' ' THR . 8.4 p30 -136.92 143.14 42.77 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 178.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 75.1 -71.73 1.7 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 119.217 -1.468 . . . . 0.0 109.6 -168.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -144.57 -87.45 0.12 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 166.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.419 ' HA ' ' NE ' ' A' ' 25' ' ' ARG . 2.9 t70 -86.02 178.42 7.26 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.676 0.751 . . . . 0.0 112.334 -172.191 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.763 ' HG3' ' HG3' ' A' ' 25' ' ' ARG . 0.8 OUTLIER -76.19 136.84 39.74 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.64 -1.164 . . . . 0.0 112.485 -171.798 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.483 HG21 HG23 ' A' ' 33' ' ' THR . 12.2 t -127.53 162.75 25.69 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 169.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 48.7 t -74.6 106.26 4.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.289 -0.564 . . . . 0.0 109.836 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.483 HG23 HG21 ' A' ' 31' ' ' THR . 27.1 p -115.69 147.78 40.47 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.152 0.501 . . . . 0.0 111.389 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.4 t -105.37 126.75 52.47 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.4 176.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 5.4 p -91.65 176.63 6.47 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 177.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.29 -176.81 6.3 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.154 -0.618 . . . . 0.0 111.793 -172.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 -61.66 -32.28 72.44 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -172.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.426 ' HG2' HG21 ' A' ' 57' ' ' THR . 10.2 pm0 -77.21 -23.32 51.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.834 0.349 . . . . 0.0 111.176 -176.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.571 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 69.0 mt-30 -92.93 109.06 20.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.141 0.496 . . . . 0.0 110.152 -178.353 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.34 5.16 10.22 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.768 -174.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.564 ' HG3' ' HA ' ' A' ' 58' ' ' VAL . 10.0 mmm180 -130.44 -179.68 5.41 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-O 121.617 0.722 . . . . 0.0 110.032 174.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.558 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 40.4 m -126.51 150.33 48.82 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.245 -177.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.493 ' HB2' ' CG ' ' A' ' 56' ' ' LYS . 0.2 OUTLIER -109.01 122.34 47.05 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.87 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.575 ' HB2' ' HB2' ' A' ' 84' ' ' ASN . 52.6 t80 -131.93 117.95 19.14 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.015 175.059 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.523 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 42.2 t -116.46 130.02 71.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 177.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.798 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 2.6 mm100 -75.63 141.25 42.86 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 119.73 -0.788 . . . . 0.0 109.932 178.442 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.491 HD23 HG12 ' A' ' 52' ' ' ILE . 2.5 mm? -138.86 155.82 72.96 Favored Pre-proline 0 C--N 1.318 -0.785 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 172.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -85.82 11.27 3.38 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.494 2.129 . . . . 0.0 111.37 171.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -128.38 -64.56 0.94 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.877 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.457 ' O ' HD21 ' A' ' 47' ' ' LEU . 20.6 t -152.94 132.22 12.79 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 177.006 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.4 ' HA ' HD21 ' A' ' 47' ' ' LEU . 0.9 OUTLIER -77.11 148.63 35.93 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.425 -173.783 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.523 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 38.5 mm -88.65 131.69 35.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.176 177.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.568 ' OE1' ' HD3' ' A' ' 30' ' ' ARG . 17.4 mt-30 -144.57 130.39 19.22 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.344 -0.543 . . . . 0.0 110.166 -178.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.406 ' HG3' ' HE2' ' A' ' 56' ' ' LYS . 10.7 pt-20 -175.79 170.74 2.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.423 -178.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.471 ' HB3' ' OE1' ' A' ' 39' ' ' GLN . 8.1 t -92.33 148.92 21.75 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 119.665 -0.814 . . . . 0.0 109.699 177.179 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.493 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 56.6 mmtt -142.08 162.41 35.53 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 176.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 29.3 p -72.34 160.32 32.56 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 172.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.564 ' HA ' ' HG3' ' A' ' 41' ' ' ARG . 22.0 t -59.12 -39.38 78.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 C-N-CA 120.029 -0.669 . . . . 0.0 109.637 -179.396 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.47 ' O ' ' HG3' ' A' ' 63' ' ' GLU . 41.3 tp60 -62.53 -56.12 20.99 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.697 177.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.58 ' O ' HG11 ' A' ' 64' ' ' VAL . 34.8 tt0 -69.75 -30.93 68.63 Favored 'General case' 0 C--O 1.203 -1.351 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.633 -173.097 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.484 ' HA ' ' CG2' ' A' ' 64' ' ' VAL . 2.7 p -65.15 -33.21 75.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 179.111 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.29 -45.87 65.46 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 173.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.538 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 75.7 mt-10 -54.91 -52.32 63.28 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.294 178.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.587 ' HA ' ' OE1' ' A' ' 67' ' ' GLU . 27.6 m -68.98 -30.42 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.528 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.481 -177.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.401 ' CD1' ' HB3' ' A' ' 75' ' ' ALA . 6.5 tp -62.59 -49.61 74.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.46 174.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -74.2 -31.44 62.64 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -176.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.587 ' OE1' ' HA ' ' A' ' 64' ' ' VAL . 11.6 pt-20 -63.35 -45.61 90.43 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.38 -177.006 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.559 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 29.3 m -79.34 -31.8 14.55 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 C-N-CA 120.279 -0.568 . . . . 0.0 111.335 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 85.5 m -66.41 -31.37 72.09 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 120.935 0.398 . . . . 0.0 110.484 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.0 -23.95 65.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.612 176.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 67' ' ' GLU . 16.0 mt -86.43 -20.63 7.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.959 178.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 114.95 -4.21 22.53 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.094 -1.05 . . . . 0.0 112.362 -178.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -91.91 114.71 62.9 Favored Pre-proline 0 N--CA 1.448 -0.554 0 CA-C-O 120.658 0.266 . . . . 0.0 110.926 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.798 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 51.6 Cg_exo -59.25 128.8 28.81 Favored 'Trans proline' 0 C--O 1.232 0.212 0 C-N-CA 123.177 2.585 . . . . 0.0 113.09 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.469 ' C ' ' HG2' ' A' ' 76' ' ' LYS . . . -126.53 165.56 18.9 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.451 173.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.563 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 0.9 OUTLIER -145.71 118.66 8.75 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.118 -178.115 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.558 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 1.4 t -104.31 106.79 17.42 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.248 0.547 . . . . 0.0 110.078 171.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 54.0 t -110.91 160.86 16.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.226 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.537 ' HB2' ' HD2' ' A' ' 41' ' ' ARG . 36.3 t -125.84 100.09 6.24 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 175.501 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.576 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 3.5 tm-20 171.53 149.79 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 105.681 -1.97 . . . . 0.0 105.681 -173.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.554 ' C ' HD23 ' A' ' 82' ' ' LEU . 35.3 m-20 -65.38 135.43 55.26 Favored 'General case' 0 CA--C 1.504 -0.793 0 C-N-CA 117.368 -1.733 . . . . 0.0 110.9 -172.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.76 ' O ' ' HD3' ' A' ' 85' ' ' ARG . 0.2 OUTLIER 65.82 1.95 2.0 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.839 173.603 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . 0.576 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 16.9 t -54.94 -18.71 5.34 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -167.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.575 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 27.9 p-10 -78.36 37.77 0.28 Allowed 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.469 175.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.76 ' HD3' ' O ' ' A' ' 82' ' ' LEU . 0.7 OUTLIER -67.62 159.95 28.87 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.23 174.189 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.5 m -72.62 91.0 1.4 Allowed 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 174.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 52.94 81.01 0.09 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.712 -174.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 . . . . . 0 C--O 1.235 0.297 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.713 -179.721 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 26.7 ptm . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.67 151.52 30.46 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.045 -176.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 55.5 tp -110.9 129.74 55.79 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 34' ' ' THR . 30.8 mtmm -89.46 139.04 30.92 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.986 -179.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.532 ' HA ' HD23 ' A' ' 82' ' ' LEU . 2.7 m -152.9 166.72 31.44 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.591 173.043 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -76.36 121.61 23.26 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.384 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 54' ' ' GLU . 67.6 m -115.26 144.0 44.4 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 174.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.487 HH12 ' CD ' ' A' ' 51' ' ' GLU . 3.5 tpt180 -83.4 110.33 18.06 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.89 0.376 . . . . 0.0 111.12 -174.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -97.82 85.57 3.57 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 174.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 68.96 -109.64 3.0 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 119.816 -1.183 . . . . 0.0 111.284 -173.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 -93.05 -34.97 13.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.634 0.254 . . . . 0.0 110.346 177.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -71.24 154.85 41.34 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.954 -177.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.599 ' HD2' ' OE1' ' A' ' 53' ' ' GLN . 69.3 mtm180 -116.05 112.69 22.13 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 175.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.5 m -108.36 138.49 44.57 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.535 -169.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.728 HG11 HD22 ' A' ' 82' ' ' LEU . 94.3 t -74.52 106.09 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 173.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.416 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 42.8 p -113.79 143.14 45.14 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.915 -178.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.9 t -93.05 111.95 23.75 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 175.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 37.0 m -108.0 155.99 19.73 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.742 -173.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.593 ' HB2' ' HG2' ' A' ' 38' ' ' GLU . . . -74.99 172.06 12.98 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -166.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -57.94 -27.44 63.39 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.419 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.593 ' HG2' ' HB2' ' A' ' 36' ' ' ALA . 4.8 pt-20 -52.47 -45.03 65.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.365 0.603 . . . . 0.0 110.203 173.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.629 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 41.9 mt-30 -102.44 72.78 1.28 Allowed 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.843 -177.242 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.11 9.73 18.94 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.318 -177.657 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.527 ' HB2' ' HA ' ' A' ' 58' ' ' VAL . 2.4 tpt180 -123.8 174.89 7.22 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 173.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.717 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 57.9 m -142.08 131.67 23.95 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 120.516 -0.474 . . . . 0.0 109.765 -175.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.544 HD22 HG23 ' A' ' 45' ' ' VAL . 0.3 OUTLIER -91.14 131.39 36.73 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.84 -174.985 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.762 ' HD2' ' HG3' ' A' ' 76' ' ' LYS . 77.8 t80 -138.28 121.15 16.52 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.367 169.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.578 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 30.1 t -122.43 141.75 41.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.384 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.716 ' CG ' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -81.41 142.51 32.91 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 176.193 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.541 HD21 ' C ' ' A' ' 46' ' ' GLN . 4.2 mm? -129.93 153.38 80.96 Favored Pre-proline 0 C--N 1.318 -0.792 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 174.291 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -72.18 18.39 0.32 Allowed 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 123.0 2.467 . . . . 0.0 113.154 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 28.9 p90 -168.87 -22.41 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.906 0.384 . . . . 0.0 110.797 -177.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.53 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 33.8 p -144.59 -157.4 0.78 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.34 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.487 ' CD ' HH12 ' A' ' 25' ' ' ARG . 0.0 OUTLIER -151.53 157.37 42.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.882 0.373 . . . . 0.0 110.945 176.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.578 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 29.1 mm -105.26 134.16 47.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.658 177.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.599 ' OE1' ' HD2' ' A' ' 30' ' ' ARG . 36.7 mt-30 -140.95 131.71 25.77 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.866 174.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.523 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 8.0 pt-20 -169.36 160.92 9.68 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.325 0.391 . . . . 0.0 110.842 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.418 ' O ' ' HE2' ' A' ' 56' ' ' LYS . 80.6 m -80.36 145.41 32.06 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 169.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.418 ' HE2' ' O ' ' A' ' 55' ' ' CYS . 4.6 tppt? -152.16 148.65 27.87 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.397 -0.521 . . . . 0.0 109.778 178.899 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.629 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 31.7 p -67.46 142.71 56.55 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.179 -0.608 . . . . 0.0 109.518 178.217 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.527 ' HA ' ' HB2' ' A' ' 41' ' ' ARG . 42.3 t -52.59 -46.34 48.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 120.694 0.283 . . . . 0.0 111.132 -175.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -58.48 -56.96 15.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.269 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.792 ' O ' HG13 ' A' ' 64' ' ' VAL . 53.4 mt-30 -71.05 -32.59 69.35 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.849 -174.115 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.523 ' HA ' HG21 ' A' ' 64' ' ' VAL . 2.9 t -66.33 -32.97 74.69 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.228 -178.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.07 -42.76 84.16 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.173 0.511 . . . . 0.0 110.177 172.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -57.68 -52.57 64.9 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.978 0.894 . . . . 0.0 111.042 176.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.792 HG13 ' O ' ' A' ' 60' ' ' GLN . 4.3 m -68.23 -26.45 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.862 0 CA-C-N 114.721 -1.127 . . . . 0.0 110.818 -179.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.521 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -55.18 -49.96 70.56 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 174.914 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -73.37 -35.41 65.93 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 119.721 -0.792 . . . . 0.0 112.134 -174.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.603 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.9 pt-20 -59.74 -42.89 94.19 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.042 -0.663 . . . . 0.0 110.447 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.51 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 28.5 m -78.13 -36.74 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.864 0.364 . . . . 0.0 111.212 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 97.6 m -71.08 -20.26 62.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.136 0.493 . . . . 0.0 110.798 -177.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -79.66 -25.12 41.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.388 175.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.562 HG13 ' O ' ' A' ' 67' ' ' GLU . 17.6 mt -79.55 -29.77 13.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.392 0.615 . . . . 0.0 109.648 177.103 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.423 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 120.03 13.53 5.93 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.396 -0.907 . . . . 0.0 111.897 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . 0.436 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 55.7 m-85 -104.48 102.47 33.94 Favored Pre-proline 0 N--CA 1.448 -0.528 0 CA-C-O 120.622 0.248 . . . . 0.0 110.89 179.459 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.716 ' HB2' ' CG ' ' A' ' 46' ' ' GLN . 81.7 Cg_exo -54.4 124.72 16.78 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.3 2.667 . . . . 0.0 112.767 176.221 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.521 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -128.05 154.24 45.89 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.279 -0.568 . . . . 0.0 111.165 176.616 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.762 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 1.5 mttt -138.72 112.44 8.35 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.106 179.099 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.717 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 59.3 m -102.09 102.22 12.67 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 119.834 -0.746 . . . . 0.0 109.797 173.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 40.6 t -107.61 160.0 16.02 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.365 -178.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.468 ' HB2' ' HD2' ' A' ' 41' ' ' ARG . 49.0 t -122.72 100.47 6.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.304 0.573 . . . . 0.0 109.996 178.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.81 ' HG2' ' H ' ' A' ' 81' ' ' ASP . 2.7 tt0 -173.98 166.5 4.31 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 105.892 -1.892 . . . . 0.0 105.892 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.81 ' H ' ' HG2' ' A' ' 80' ' ' GLU . 9.4 t70 -69.29 109.12 3.97 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.155 -174.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.728 HD22 HG11 ' A' ' 32' ' ' VAL . 30.5 mt 69.27 31.35 3.95 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.983 -177.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . 0.608 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 3.3 t -70.82 -6.76 40.34 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -173.1 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.42 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 29.7 p-10 -84.31 24.62 0.95 Allowed 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.135 177.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.438 ' H ' ' C ' ' A' ' 83' ' ' CYS . 24.4 ptt180 -90.3 130.32 36.43 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.516 174.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.418 ' HB3' ' HZ1' ' A' ' 76' ' ' LYS . 55.9 m -156.94 159.34 38.01 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 121.319 -0.152 . . . . 0.0 111.021 -179.094 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 56.22 44.54 24.78 Favored 'General case' 0 C--O 1.232 0.139 0 O-C-N 124.168 0.918 . . . . 0.0 111.275 176.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.72 178.875 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.484 1.266 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.96 131.04 36.2 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.993 -178.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.3 tp -124.25 152.49 42.92 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.527 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 31.4 mtmm -106.47 108.25 19.67 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.14 0.495 . . . . 0.0 111.415 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 12.4 m -111.33 153.29 26.2 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.678 ' HB3' ' HB2' ' A' ' 30' ' ' ARG . 63.2 m-85 -70.66 137.31 49.76 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.212 176.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.7 p -116.37 144.51 44.19 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.346 175.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.422 HH12 ' NH2' ' A' ' 30' ' ' ARG . 10.8 tpt180 -83.3 110.29 17.98 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -129.41 116.94 19.77 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -175.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 71.09 -76.14 0.6 Allowed Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 -171.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -140.0 -85.62 0.22 Allowed 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 166.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.415 ' CG ' ' H ' ' A' ' 30' ' ' ARG . 5.1 t70 -62.14 174.97 0.78 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.806 0.812 . . . . 0.0 112.823 -169.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.678 ' HB2' ' HB3' ' A' ' 23' ' ' PHE . 1.0 OUTLIER -80.62 136.42 36.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.216 -0.902 . . . . 0.0 112.41 -167.751 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 27.2 m -108.04 132.01 53.99 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.007 174.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 95.5 t -73.14 107.79 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 176.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 19.4 p -123.74 134.7 53.63 Favored 'General case' 0 C--N 1.317 -0.848 0 C-N-CA 120.103 -0.639 . . . . 0.0 111.582 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.527 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.5 t -79.65 113.49 17.85 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 170.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.3 m -87.88 166.07 14.81 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.373 -170.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.504 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -61.81 157.5 17.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.051 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -81.28 -12.28 59.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -164.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.504 ' OE2' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -78.83 -27.53 44.31 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.511 0.672 . . . . 0.0 109.522 175.566 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.564 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 12.7 mt-30 -88.06 88.06 7.52 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.43 177.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 p -97.15 5.11 50.77 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.253 -175.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.777 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 17.7 mmt85 -117.51 178.89 4.22 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 119.376 -0.929 . . . . 0.0 110.036 172.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.543 ' HB3' ' HB3' ' A' ' 84' ' ' ASN . 86.0 m -135.61 131.12 35.43 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.649 -1.16 . . . . 0.0 109.407 -174.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.486 ' HB2' ' CG ' ' A' ' 56' ' ' LYS . 1.6 tm? -100.23 128.21 46.35 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.667 -173.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.578 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 52.3 t80 -142.17 114.85 8.54 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.768 174.022 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.546 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 41.4 t -101.61 128.88 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 175.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.72 ' HB3' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -90.04 114.22 26.06 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.27 -178.576 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.547 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.5 mm? -109.69 153.33 43.02 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.039 179.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -80.15 27.18 0.55 Allowed 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 122.737 2.291 . . . . 0.0 112.724 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 39.0 p90 -170.63 -23.38 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.829 -177.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.547 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 45.2 m -148.09 -160.95 1.24 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.421 ' HA ' HD23 ' A' ' 47' ' ' LEU . 16.3 pt-20 -158.01 150.47 22.37 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.816 179.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.578 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 37.8 mt -112.38 137.97 43.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 177.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.472 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 45.3 mt-30 -144.5 128.95 17.97 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -178.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -150.84 174.98 12.45 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 -179.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 3.6 m -107.72 127.2 53.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 167.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.51 ' HB2' ' SG ' ' A' ' 61' ' ' CYS . 71.9 mmtt -133.5 148.38 51.68 Favored 'General case' 0 C--N 1.314 -0.954 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.599 -174.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.564 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 43.9 p -66.18 154.72 39.01 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 172.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.57 ' HA ' ' HG3' ' A' ' 41' ' ' ARG . 21.7 t -50.1 -45.66 23.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.453 -176.545 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -66.01 -56.53 11.15 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.648 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.688 ' O ' HG12 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -58.45 -33.42 69.71 Favored 'General case' 0 C--O 1.211 -0.937 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -176.239 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.534 ' HA ' HG21 ' A' ' 64' ' ' VAL . 2.7 t -72.68 -33.5 66.57 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.623 -179.264 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.45 -36.85 71.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.238 0.542 . . . . 0.0 109.684 173.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.572 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 92.5 mt-10 -59.5 -52.36 65.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.547 175.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.688 HG12 ' O ' ' A' ' 60' ' ' GLN . 19.8 m -71.77 -27.67 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.659 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.523 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.511 HD11 ' HG1' ' A' ' 69' ' ' THR . 0.2 OUTLIER -60.52 -49.44 77.55 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 175.382 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -73.88 -32.32 63.54 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.834 -174.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.607 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.2 pt-20 -61.13 -41.86 97.48 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.744 -0.783 . . . . 0.0 109.895 -179.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.463 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 28.6 m -81.07 -37.57 16.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 178.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.511 ' HG1' HD11 ' A' ' 65' ' ' LEU . 97.8 m -78.15 -25.73 47.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.532 -172.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.38 -19.74 63.83 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.426 173.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 9.5 mt -80.56 -22.17 11.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.745 177.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 112.27 2.08 26.37 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 119.884 -1.15 . . . . 0.0 112.17 -177.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -88.69 126.55 59.39 Favored Pre-proline 0 N--CA 1.448 -0.553 0 O-C-N 122.819 -0.224 . . . . 0.0 110.909 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.72 ' HB2' ' HB3' ' A' ' 46' ' ' GLN . 78.8 Cg_exo -56.64 131.27 44.61 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 123.319 2.68 . . . . 0.0 112.723 176.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -146.93 155.13 42.04 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 119.154 -1.018 . . . . 0.0 111.641 174.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.422 ' HD3' ' CD2' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -141.26 151.54 43.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.772 176.012 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.777 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 37.4 t -145.76 92.76 2.25 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.92 173.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 3.9 p -107.13 166.13 10.85 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.956 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.55 ' HB2' ' HD3' ' A' ' 41' ' ' ARG . 47.3 t -109.46 105.01 14.18 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.533 -173.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 172.13 151.82 0.07 Allowed 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.537 ' CB ' HD21 ' A' ' 82' ' ' LEU . 62.0 m-20 -57.79 138.97 55.07 Favored 'General case' 0 CA--C 1.512 -0.492 0 C-N-CA 119.429 -0.908 . . . . 0.0 109.764 176.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.537 HD21 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 63.85 17.18 10.35 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.065 172.2 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 4.8 t -78.53 -6.7 56.19 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.058 0.456 . . . . 0.0 111.21 -174.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.543 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 29.5 p-10 -103.58 37.69 1.97 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.401 0.62 . . . . 0.0 110.36 178.108 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.81 167.61 13.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.239 179.036 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.63 132.67 48.67 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.245 178.381 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.06 -36.9 40.16 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 179.043 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 . . . . . 0 N--CA 1.471 0.606 0 O-C-N 124.375 1.047 . . . . 0.0 112.535 176.881 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.593 ' O ' ' HB3' ' A' ' 37' ' ' GLU . 26.0 ptm . . . . . 0 N--CA 1.483 1.186 0 CA-C-O 120.63 0.252 . . . . 0.0 110.371 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.477 ' HB3' ' O ' ' A' ' 35' ' ' CYS . . . -77.95 152.57 33.11 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.717 -175.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.8 tp -115.89 142.53 46.65 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.521 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 28.8 mtmm -110.37 106.13 15.37 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.807 -173.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.47 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 17.2 m -106.23 156.01 18.9 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 175.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.609 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 16.2 m-85 -67.58 115.32 7.04 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.72 175.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.9 m -96.09 133.45 40.33 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.076 -0.712 . . . . 0.0 109.076 171.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.402 ' HE ' ' HA ' ' A' ' 28' ' ' ASP . 22.9 ttt180 -91.63 111.23 22.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.991 0.424 . . . . 0.0 111.627 -175.507 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -90.87 90.64 8.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.329 174.696 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 73.27 -81.93 0.68 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.281 -0.961 . . . . 0.0 111.099 -174.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.402 ' HA ' ' HE ' ' A' ' 25' ' ' ARG . 10.4 t70 -123.84 -41.54 2.23 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 174.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -52.48 140.86 21.46 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.375 -179.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -111.39 111.38 22.38 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 179.195 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -106.8 143.97 34.13 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.329 -0.549 . . . . 0.0 111.464 -169.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.473 HG11 HD12 ' A' ' 82' ' ' LEU . 85.1 t -75.32 106.49 5.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.834 174.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.408 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 32.6 p -122.08 139.22 53.98 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.324 -0.55 . . . . 0.0 110.845 178.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.521 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.8 t -89.12 112.24 23.18 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.18 177.864 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.502 ' HB3' ' OE1' ' A' ' 39' ' ' GLN . 44.9 m -101.45 161.71 13.43 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.833 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.67 158.16 28.11 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.251 -175.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.593 ' HB3' ' O ' ' A' ' 18' ' ' MET . 3.4 pt-20 -66.9 -17.45 64.91 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.297 0.57 . . . . 0.0 110.768 177.576 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.523 ' HG2' HG22 ' A' ' 57' ' ' THR . 10.7 tt0 -45.18 -48.01 12.43 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.574 -1.194 . . . . 0.0 108.884 163.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.559 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 41.3 mt-30 -98.06 73.17 2.22 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 114.423 -1.262 . . . . 0.0 109.686 -176.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.16 18.56 3.05 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.518 -177.044 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.638 HH21 HG13 ' A' ' 58' ' ' VAL . 1.6 tpp85 -136.38 168.8 18.76 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.698 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 21.7 m -129.92 137.51 50.41 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -178.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.596 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.0 OUTLIER -98.83 123.36 43.03 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.529 0.204 . . . . 0.0 110.507 -176.501 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.648 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 50.7 t80 -131.24 105.27 7.55 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.062 171.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.563 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 42.1 t -98.0 138.12 23.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 120.391 -0.524 . . . . 0.0 109.818 177.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.78 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 2.1 mm100 -79.75 139.15 37.39 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 119.666 -0.813 . . . . 0.0 109.303 175.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.713 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.9 mm? -134.14 149.06 70.42 Favored Pre-proline 0 C--N 1.314 -0.942 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.631 178.119 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 5.1 Cg_exo -79.9 13.23 2.2 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.93 2.42 . . . . 0.0 112.134 174.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -138.63 -43.75 0.49 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.079 0.466 . . . . 0.0 110.71 -176.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.713 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 38.8 m -147.72 -156.71 0.74 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -178.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -139.56 135.88 33.85 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.954 -0.698 . . . . 0.0 110.279 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.648 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 73.7 mt -89.92 126.62 42.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.546 177.602 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.596 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 17.9 mt-30 -139.74 130.77 26.34 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 175.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -172.52 163.97 5.5 Favored 'General case' 0 C--N 1.33 -0.279 0 O-C-N 123.473 0.483 . . . . 0.0 110.509 -177.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.47 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 73.5 m -87.91 135.85 33.22 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.052 0.453 . . . . 0.0 111.109 -179.418 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.524 ' HB2' ' HB2' ' A' ' 61' ' ' CYS . 68.2 mmtt -138.23 157.28 46.59 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.559 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 5.3 p -70.96 152.18 43.88 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 118.969 -1.092 . . . . 0.0 108.061 173.122 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.638 HG13 HH21 ' A' ' 41' ' ' ARG . 55.4 t -48.67 -51.92 10.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 120.648 0.261 . . . . 0.0 110.745 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.551 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 17.6 tt0 -63.26 -55.69 22.75 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.19 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.769 ' O ' HG13 ' A' ' 64' ' ' VAL . 29.3 tt0 -58.24 -37.31 74.65 Favored 'General case' 0 C--O 1.209 -1.052 0 CA-C-N 116.541 -0.299 . . . . 0.0 110.961 -174.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.537 ' HA ' HG21 ' A' ' 64' ' ' VAL . 2.7 t -70.94 -32.97 70.03 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.38 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.91 -39.35 87.36 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.93 172.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.551 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 20.1 mm-40 -58.68 -52.66 64.73 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.492 176.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.769 HG13 ' O ' ' A' ' 60' ' ' GLN . 7.4 m -69.77 -26.43 30.47 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.705 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.107 -178.63 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.496 HD12 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -57.11 -50.47 72.7 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 175.698 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -73.82 -34.68 64.67 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 120.215 -0.594 . . . . 0.0 111.98 -174.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.603 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.1 pt-20 -59.43 -42.74 92.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.17 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.504 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 34.4 m -79.68 -38.51 19.35 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.13 0 CA-C-O 120.738 0.304 . . . . 0.0 111.663 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.8 m -74.03 -19.92 60.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.83 0.347 . . . . 0.0 111.341 -175.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.23 -23.47 59.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.999 0.428 . . . . 0.0 110.181 173.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 67' ' ' GLU . 6.1 mt -83.83 -21.86 8.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.355 0.598 . . . . 0.0 109.623 177.295 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.433 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 115.43 9.33 13.09 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.13 -1.033 . . . . 0.0 112.224 -178.136 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -101.51 107.11 49.79 Favored Pre-proline 0 N--CA 1.45 -0.43 0 CA-C-O 120.739 0.304 . . . . 0.0 110.966 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.78 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 52.2 Cg_exo -60.54 137.45 73.88 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 123.116 2.544 . . . . 0.0 112.682 175.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.496 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -138.3 160.13 40.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.715 0.293 . . . . 0.0 110.327 174.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.3 mmtp -136.25 114.86 11.92 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.032 -178.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.698 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 39.0 m -114.13 98.48 6.98 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.946 173.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 7.9 p -111.13 167.69 10.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.692 -0.231 . . . . 0.0 110.727 -178.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 37.7 m -109.63 106.04 15.56 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.839 -176.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.484 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 23.2 tt0 178.1 153.71 0.32 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.564 ' CB ' HD21 ' A' ' 82' ' ' LEU . 49.7 m-20 -65.27 139.32 58.6 Favored 'General case' 0 CA--C 1.507 -0.708 0 C-N-CA 117.919 -1.512 . . . . 0.0 108.738 172.806 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.609 ' HB3' ' CE2' ' A' ' 23' ' ' PHE . 0.2 OUTLIER 61.37 23.72 13.93 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.084 174.556 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . 0.484 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 5.7 t -69.98 -34.26 73.13 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.619 -171.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.569 ' OD1' ' HB3' ' A' ' 42' ' ' CYS . 0.4 OUTLIER -74.95 109.51 8.48 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 118.756 -1.177 . . . . 0.0 109.402 174.623 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.444 ' HG2' ' O ' ' A' ' 83' ' ' CYS . 10.2 ptt180 -155.49 153.6 30.52 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.125 -171.064 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.1 m -64.67 114.49 4.46 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.213 177.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -85.01 -17.9 36.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.228 0.537 . . . . 0.0 110.606 -177.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.575 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.873 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 90.0 mtp . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 110.397 -0.223 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.61 ' HA ' ' O ' ' A' ' 35' ' ' CYS . . . 71.45 114.03 0.05 Allowed 'General case' 0 N--CA 1.465 0.325 0 O-C-N 124.338 1.024 . . . . 0.0 112.697 175.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 27.2 tp -109.53 146.33 34.81 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 176.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.644 ' HG2' ' HB ' ' A' ' 34' ' ' THR . 27.6 mtmm -114.61 114.9 26.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.244 0.545 . . . . 0.0 112.072 -174.318 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 17.2 m -129.41 168.58 16.1 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.044 175.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -75.27 132.27 40.93 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.259 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 61.8 m -129.55 135.29 48.41 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 175.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 51.5 ttt180 -84.31 110.44 18.58 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.909 -176.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -91.16 86.5 6.21 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.934 177.267 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 81.02 -81.89 1.58 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.315 -174.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -127.24 -51.59 1.41 Allowed 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 176.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -56.91 148.65 20.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.214 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.668 ' HD2' ' OE1' ' A' ' 53' ' ' GLN . 77.6 mtm180 -126.04 114.2 18.12 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.181 -0.607 . . . . 0.0 110.65 -178.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.8 t -120.09 176.11 5.6 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.852 -178.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 76.9 t -90.08 116.75 32.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.498 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.477 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 64.4 p -106.76 143.37 34.96 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.69 175.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.644 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 1.5 t -98.43 112.32 24.38 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.479 175.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.61 ' O ' ' HA ' ' A' ' 19' ' ' ALA . 57.9 m -110.54 164.97 12.18 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.241 -172.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.2 -175.98 4.41 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -170.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -67.05 -32.6 73.91 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.44 -0.8 . . . . 0.0 113.009 -167.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.541 ' CD ' ' H ' ' A' ' 38' ' ' GLU . 1.1 mp0 -55.11 -44.16 74.73 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 122.159 0.98 . . . . 0.0 108.619 177.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.69 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 2.2 mm-40 -90.98 49.19 1.61 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 113.694 -1.594 . . . . 0.0 110.411 -172.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.74 3.65 11.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.204 0.526 . . . . 0.0 110.906 178.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.604 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 19.4 mmt85 -120.07 -179.44 3.93 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.704 0.764 . . . . 0.0 109.367 169.078 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.584 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 35.9 m -144.41 156.1 44.06 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.344 -172.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.418 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.0 OUTLIER -114.77 135.62 53.98 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 120.922 0.392 . . . . 0.0 110.247 -177.799 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.565 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 70.3 t80 -141.73 119.97 12.22 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.36 -0.836 . . . . 0.0 108.984 170.46 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.603 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 25.3 t -119.43 140.58 42.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.426 -178.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.982 HE21 ' HA ' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -84.48 133.33 34.48 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.122 0.487 . . . . 0.0 110.694 176.302 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.677 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.5 mm? -130.24 146.05 59.95 Favored Pre-proline 0 C--N 1.318 -0.799 0 CA-C-N 115.471 -0.786 . . . . 0.0 108.894 176.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -76.15 15.08 1.01 Allowed 'Trans proline' 0 CA--C 1.528 0.212 0 C-N-CA 122.797 2.331 . . . . 0.0 112.193 177.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -143.45 -39.42 0.31 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.633 -176.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.677 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 49.0 m -149.11 -156.83 0.76 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.428 ' CD ' HH12 ' A' ' 30' ' ' ARG . 22.3 mt-10 -138.65 149.56 45.31 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 177.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.603 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 27.9 mm -104.74 129.27 57.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.193 174.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.668 ' OE1' ' HD2' ' A' ' 30' ' ' ARG . 50.9 mt-30 -142.86 131.85 22.99 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.58 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -168.2 160.26 11.51 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 123.556 0.535 . . . . 0.0 111.107 -178.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 64.7 m -78.32 132.63 37.52 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 170.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.429 ' HG2' HG23 ' A' ' 64' ' ' VAL . 8.7 tppt? -137.95 135.33 35.94 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 -178.553 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.69 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 6.1 p -59.09 156.45 11.96 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 119.509 -0.876 . . . . 0.0 109.827 -178.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.542 HG21 ' HG2' ' A' ' 41' ' ' ARG . 37.3 t -54.81 -46.63 75.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.091 0.472 . . . . 0.0 111.296 -175.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.632 ' HG3' ' N ' ' A' ' 60' ' ' GLN . 8.5 pt20 -65.82 -45.36 82.61 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.881 -179.543 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.632 ' N ' ' HG3' ' A' ' 59' ' ' GLN . 70.9 mt-30 -72.87 -26.71 61.55 Favored 'General case' 0 C--O 1.2 -1.528 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.884 -175.404 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.514 ' HA ' ' CG2' ' A' ' 64' ' ' VAL . 9.1 p -69.43 -33.05 72.39 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.45 -40.75 73.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 0.0 109.997 172.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.21 -52.01 66.61 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.174 178.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.614 HG13 ' O ' ' A' ' 60' ' ' GLN . 30.6 m -67.77 -29.39 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.375 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.637 -178.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.479 HD12 ' HB3' ' A' ' 75' ' ' ALA . 18.4 tp -57.81 -50.79 72.08 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.804 176.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -75.25 -32.38 61.07 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -176.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.59 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -61.1 -46.91 88.7 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.615 -175.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.582 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.6 m -79.76 -31.32 13.72 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 C-N-CA 120.74 -0.384 . . . . 0.0 111.299 -179.577 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 96.3 m -68.41 -29.06 67.65 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.559 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.76 -22.78 63.32 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.541 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.424 HG13 ' O ' ' A' ' 67' ' ' GLU . 20.1 mt -85.1 -20.61 8.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.337 0.589 . . . . 0.0 109.729 177.654 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 111.2 11.97 16.77 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.187 -1.006 . . . . 0.0 112.453 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -106.47 113.39 63.19 Favored Pre-proline 0 N--CA 1.448 -0.559 0 CA-C-O 120.612 0.244 . . . . 0.0 111.212 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.667 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 90.6 Cg_exo -52.36 129.78 33.09 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 123.577 2.851 . . . . 0.0 113.088 177.41 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.487 ' HA ' ' O ' ' A' ' 44' ' ' PHE . . . -132.4 161.21 34.2 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.236 -0.585 . . . . 0.0 111.0 174.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.54 ' HG3' ' HB3' ' A' ' 44' ' ' PHE . 14.9 ptmt -145.2 124.33 12.88 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.017 0.437 . . . . 0.0 111.409 175.025 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.604 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 0.6 OUTLIER -100.44 96.66 7.56 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.602 -0.727 . . . . 0.0 109.122 168.714 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 42.7 t -106.81 152.45 23.85 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.579 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.467 ' HB2' ' CD ' ' A' ' 41' ' ' ARG . 41.9 t -115.22 100.28 8.02 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.334 -178.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.487 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 42.8 tt0 169.68 155.1 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.553 ' CB ' HD21 ' A' ' 82' ' ' LEU . 69.5 m-20 -63.31 135.2 56.88 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 119.038 -1.065 . . . . 0.0 110.001 177.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.553 HD21 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 66.72 6.8 4.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.032 170.843 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . 0.487 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 42.6 t -75.88 -13.15 60.26 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 120.336 -0.545 . . . . 0.0 111.387 -175.182 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 19.3 p-10 -88.02 16.81 5.55 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.111 -0.635 . . . . 0.0 110.599 178.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 26.0 ttp180 -71.16 161.48 31.04 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 176.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.528 ' HA ' ' CZ ' ' A' ' 44' ' ' PHE . 2.1 p -64.38 139.98 58.82 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.767 0.317 . . . . 0.0 110.977 177.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -63.17 -56.39 17.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.174 -178.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 . . . . . 0 C--N 1.323 -0.572 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.22 -178.824 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.462 ' H ' ' CD ' ' A' ' 37' ' ' GLU . 26.9 ttt . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 110.425 -0.213 . . . . 0.0 110.425 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -74.5 101.45 4.16 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.924 175.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 26.1 tp -93.5 155.3 17.41 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 177.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.518 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 33.1 mtmm -108.58 106.88 17.16 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 119.63 -0.828 . . . . 0.0 111.632 -179.577 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.516 ' HA ' HD22 ' A' ' 84' ' ' ASN . 8.1 m -110.05 166.26 11.08 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.016 177.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -80.75 132.35 35.52 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 119.929 -0.708 . . . . 0.0 110.415 178.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.1 p -101.97 130.9 48.61 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 171.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.2 tpt85 -83.29 109.43 17.25 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.446 -0.502 . . . . 0.0 109.741 -176.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -118.82 90.38 3.32 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.266 -0.424 . . . . 0.0 109.89 -179.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 68.84 -118.54 9.01 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 119.949 -1.119 . . . . 0.0 111.587 -176.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -89.8 -18.76 25.67 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.592 0.234 . . . . 0.0 110.631 179.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -91.57 157.08 17.2 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.442 0.639 . . . . 0.0 111.941 -177.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.468 HH11 ' HD3' ' A' ' 30' ' ' ARG . 1.1 ptt-85 -125.26 113.05 17.12 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 169.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.9 m -97.14 133.48 41.73 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.615 -168.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 95.5 t -72.72 106.84 3.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 173.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.1 p -122.3 138.36 54.53 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.557 -0.457 . . . . 0.0 111.513 -177.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.518 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.9 t -77.66 115.92 17.79 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 173.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.2 m -89.17 178.21 6.42 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.709 -170.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.5 161.04 30.31 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.072 0.463 . . . . 0.0 112.181 -174.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.462 ' CD ' ' H ' ' A' ' 18' ' ' MET . 31.9 mm-40 -56.45 -33.32 65.79 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.791 -177.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -74.25 -29.57 61.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.133 0.492 . . . . 0.0 111.093 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.494 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 22.7 mt-30 -83.96 90.4 7.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.457 0.646 . . . . 0.0 110.114 -172.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.492 ' OG1' HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -102.48 14.5 31.8 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.52 -176.658 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.619 ' HD3' HG21 ' A' ' 58' ' ' VAL . 1.6 tpt180 -135.11 172.44 13.0 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 121.168 0.509 . . . . 0.0 109.724 175.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.595 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 70.1 m -131.0 131.64 44.49 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.511 -0.768 . . . . 0.0 108.943 179.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.492 ' HB3' ' HG2' ' A' ' 54' ' ' GLU . 0.7 OUTLIER -96.33 123.71 40.07 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.059 -177.151 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.52 ' HD2' ' HG3' ' A' ' 76' ' ' LYS . 71.9 t80 -131.64 109.37 10.16 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.853 170.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.622 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 39.9 t -99.42 134.22 39.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 172.044 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 1.024 ' HB3' ' HB2' ' A' ' 74' ' ' PRO . 1.9 tp-100 -93.4 114.78 27.28 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.856 -175.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.538 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.6 mm? -107.8 156.71 37.59 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.909 -179.029 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_exo -70.9 14.93 0.32 Allowed 'Trans proline' 0 CA--C 1.535 0.562 0 C-N-CA 123.23 2.62 . . . . 0.0 114.019 -176.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -171.02 -30.94 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.879 -178.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.538 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 23.8 p -124.31 -168.4 1.79 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.828 179.015 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.771 ' HG3' ' HG ' ' A' ' 86' ' ' SER . 0.1 OUTLIER -150.48 149.73 30.37 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 119.584 -0.846 . . . . 0.0 111.285 178.118 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.622 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 25.9 mm -98.78 129.49 49.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.777 175.255 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.413 ' OE1' ' HD3' ' A' ' 30' ' ' ARG . 48.5 mt-30 -140.31 130.25 24.69 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 119.811 -0.756 . . . . 0.0 110.565 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.494 ' CD ' ' HZ3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -163.4 163.86 24.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.733 -179.189 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.558 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.3 m -94.86 126.43 40.18 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 168.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.558 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 14.0 mptt -128.05 170.86 12.43 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 119.926 -0.71 . . . . 0.0 109.144 175.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.494 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 30.9 p -80.68 159.63 25.23 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 118.471 -1.292 . . . . 0.0 107.96 174.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.619 HG21 ' HD3' ' A' ' 41' ' ' ARG . 83.4 t -55.3 -43.75 72.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.53 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -66.54 -56.74 9.41 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.053 -178.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.717 ' O ' HG13 ' A' ' 64' ' ' VAL . 74.5 mt-30 -56.44 -44.38 80.38 Favored 'General case' 0 C--O 1.207 -1.178 0 O-C-N 123.456 0.473 . . . . 0.0 110.21 -177.309 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.573 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 0.5 OUTLIER -66.35 -31.6 72.48 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.852 -178.108 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.78 -41.18 75.45 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.189 -0.604 . . . . 0.0 110.141 173.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.475 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 45.3 mt-10 -56.32 -53.33 58.53 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.981 0.896 . . . . 0.0 110.655 175.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.717 HG13 ' O ' ' A' ' 60' ' ' GLN . 5.7 m -72.73 -26.36 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.735 0 CA-C-N 114.532 -1.213 . . . . 0.0 111.081 -178.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.573 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 19.8 tp -56.85 -47.71 79.74 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 176.267 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.531 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 38.7 tt0 -73.98 -37.63 64.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.462 -176.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.599 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -58.3 -43.74 88.24 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.611 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.53 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 29.9 m -79.66 -31.75 14.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 120.599 -0.44 . . . . 0.0 112.06 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.531 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 21.0 p -73.87 -26.27 60.47 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.105 -178.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.87 -20.21 63.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.183 0.515 . . . . 0.0 110.493 176.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 67' ' ' GLU . 22.6 mt -82.07 -19.6 10.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.605 176.678 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 108.65 1.84 32.56 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.18 -1.01 . . . . 0.0 112.398 179.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 49.5 m-85 -87.43 134.53 35.97 Favored Pre-proline 0 N--CA 1.45 -0.469 0 CA-C-O 120.787 0.327 . . . . 0.0 111.385 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 1.024 ' HB2' ' HB3' ' A' ' 46' ' ' GLN . 54.4 Cg_exo -59.55 130.82 37.16 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 123.394 2.729 . . . . 0.0 111.897 175.163 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -147.03 151.23 36.59 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.2 -0.6 . . . . 0.0 111.508 178.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.52 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 1.1 ptmt -151.01 119.57 6.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.549 179.312 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.595 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 65.7 m -113.57 97.97 6.77 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.358 -0.537 . . . . 0.0 109.893 168.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 3.5 p -108.46 157.42 18.45 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.069 177.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . 0.45 ' O ' ' HG2' ' A' ' 80' ' ' GLU . 14.5 t -108.42 100.95 10.17 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.354 -175.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 79' ' ' CYS . 3.0 mm-40 178.9 151.01 0.3 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.553 ' CB ' HD22 ' A' ' 82' ' ' LEU . 70.0 m-20 -63.02 135.9 57.52 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 118.819 -1.152 . . . . 0.0 109.772 178.722 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.553 HD22 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 65.51 10.08 6.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.583 171.636 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . 0.419 ' C ' ' H ' ' A' ' 85' ' ' ARG . 42.7 t -69.65 -20.69 63.58 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.726 0.774 . . . . 0.0 110.313 -179.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.516 HD22 ' HA ' ' A' ' 22' ' ' CYS . 6.0 p30 -82.22 20.34 1.06 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.366 178.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.419 ' H ' ' C ' ' A' ' 83' ' ' CYS . 22.2 ttp180 -57.54 138.06 55.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.302 178.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.771 ' HG ' ' HG3' ' A' ' 51' ' ' GLU . 3.0 m -80.95 107.17 13.54 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.068 176.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -90.66 -27.54 18.96 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.903 178.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 19.3 mm-40 . . . . . 0 C--N 1.325 -0.483 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.282 179.08 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 110.378 -0.231 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 63.22 92.12 0.07 Allowed 'General case' 0 N--CA 1.464 0.275 0 O-C-N 123.92 0.763 . . . . 0.0 110.739 -173.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.7 tp -90.64 156.04 18.41 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 -176.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.498 ' HB3' HG11 ' A' ' 32' ' ' VAL . 23.0 mtpp -115.33 101.17 8.68 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 119.219 -0.992 . . . . 0.0 111.867 178.63 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.409 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 8.4 m -100.71 158.38 15.99 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 173.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -76.37 142.21 41.24 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.35 -0.54 . . . . 0.0 109.779 174.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 88.9 m -133.64 129.57 37.06 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 173.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.607 ' NH1' ' HA ' ' A' ' 28' ' ' ASP . 16.5 mtm180 -91.66 114.38 26.89 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 119.576 -0.85 . . . . 0.0 112.223 -173.698 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -79.29 86.39 5.04 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.341 172.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 71.48 -108.86 2.62 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 119.173 -1.489 . . . . 0.0 109.909 -168.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.607 ' HA ' ' NH1' ' A' ' 25' ' ' ARG . 10.4 m-20 -109.07 -7.18 15.38 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.433 172.446 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -69.63 152.86 44.23 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.511 173.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.5 mtt-85 -126.16 113.36 16.92 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 119.376 -0.93 . . . . 0.0 111.073 -175.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 m -115.29 139.24 50.14 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.065 -178.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.498 HG11 ' HB3' ' A' ' 21' ' ' LYS . 6.3 t -88.6 104.59 14.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 C-N-CA 119.789 -0.764 . . . . 0.0 109.846 177.526 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.2 p -87.61 150.24 23.79 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.858 -173.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 t -90.15 112.25 23.68 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 171.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.1 140.87 35.8 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.894 0.378 . . . . 0.0 110.499 -173.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.44 172.23 10.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.258 -171.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -56.19 -38.53 71.08 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.107 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -52.07 -46.13 65.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.793 175.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.621 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 38.2 mt-30 -103.07 72.54 1.18 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.237 -177.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.09 15.57 11.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.302 -179.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.686 ' HG2' ' SG ' ' A' ' 61' ' ' CYS . 1.7 tpt180 -119.68 171.13 8.6 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.299 -0.56 . . . . 0.0 109.494 173.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.714 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.3 m -130.42 131.0 45.02 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.504 -179.636 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.516 HD11 ' HE3' ' A' ' 56' ' ' LYS . 0.7 OUTLIER -94.95 130.73 41.47 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.835 0.35 . . . . 0.0 110.507 -176.596 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.627 ' HE2' ' OE1' ' A' ' 46' ' ' GLN . 54.4 t80 -143.69 119.23 10.36 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.468 174.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 57.5 t -122.49 138.8 51.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -179.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.832 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 7.1 mm100 -75.58 142.0 42.8 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.663 178.421 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.603 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.4 mm? -130.55 158.57 74.22 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 169.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -76.27 13.82 1.26 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.761 2.308 . . . . 0.0 112.39 176.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -140.43 -54.48 0.51 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.467 0.651 . . . . 0.0 109.69 -179.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.603 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 6.7 p -137.83 -151.5 0.39 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.675 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.454 ' HA ' HD22 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -147.14 161.01 41.74 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.297 176.347 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.611 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 67.3 mt -92.92 133.96 32.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.524 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -135.1 130.51 35.62 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 120.345 -0.542 . . . . 0.0 109.544 176.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -169.99 162.24 9.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.06 177.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 4.4 m -86.81 140.8 29.33 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 170.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.516 ' HE3' HD11 ' A' ' 43' ' ' LEU . 5.0 tppt? -143.72 153.3 42.3 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.136 -0.626 . . . . 0.0 109.647 -178.139 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.621 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 29.3 p -69.45 142.82 53.72 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 176.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.655 HG21 ' HD3' ' A' ' 41' ' ' ARG . 39.9 t -54.96 -35.97 36.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-O 121.079 0.466 . . . . 0.0 110.794 -176.348 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.449 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 13.2 tt0 -69.1 -56.55 7.37 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.548 179.463 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.797 HE21 ' HA ' ' A' ' 60' ' ' GLN . 0.0 OUTLIER -67.55 -29.32 68.67 Favored 'General case' 0 C--O 1.209 -1.053 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.615 -175.543 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.686 ' SG ' ' HG2' ' A' ' 41' ' ' ARG . 2.5 p -67.25 -32.93 74.29 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.148 178.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.13 -44.79 75.32 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 173.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 49.6 mm-40 -53.74 -53.14 56.44 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.769 177.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.603 HG11 ' O ' ' A' ' 60' ' ' GLN . 16.1 m -73.31 -26.84 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.626 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.315 -177.3 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.642 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 4.3 tp -62.67 -50.9 69.34 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.591 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 49.1 mt-10 -76.05 -29.61 58.09 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -176.173 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.593 ' OE1' ' HA ' ' A' ' 64' ' ' VAL . 11.3 pt-20 -61.94 -45.17 94.87 Favored 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.095 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.569 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 34.4 m -80.29 -31.06 12.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.591 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 15.7 p -71.15 -28.35 64.2 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.857 -179.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.76 -21.26 63.45 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.453 175.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 67' ' ' GLU . 28.4 mt -84.71 -26.37 6.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.794 176.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.426 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 121.33 -1.91 11.42 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.111 -1.042 . . . . 0.0 112.507 -179.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -88.19 112.77 51.7 Favored Pre-proline 0 N--CA 1.451 -0.38 0 CA-C-O 120.516 0.198 . . . . 0.0 111.099 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.832 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 32.4 Cg_exo -62.91 130.96 30.97 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.997 2.464 . . . . 0.0 112.059 176.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -145.19 155.19 43.12 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.35 -178.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.443 ' HZ1' ' CD ' ' A' ' 87' ' ' GLU . 0.9 OUTLIER -148.03 131.67 16.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.575 177.348 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.714 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 24.4 p -119.29 102.24 8.56 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.537 0.684 . . . . 0.0 109.723 165.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 2.5 p -107.49 163.46 13.04 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.298 178.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 7.1 p -108.55 101.33 10.5 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.405 -175.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.552 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 24.3 tt0 177.84 146.44 0.13 Allowed 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 -177.254 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.575 ' CB ' HD23 ' A' ' 82' ' ' LEU . 17.6 m-20 -60.47 138.15 58.05 Favored 'General case' 0 CA--C 1.506 -0.723 0 C-N-CA 119.471 -0.892 . . . . 0.0 109.793 177.01 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.575 HD23 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 63.13 18.58 11.06 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.664 173.613 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . 0.552 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 12.1 t -75.03 -23.95 58.23 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.096 0.474 . . . . 0.0 111.299 -173.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.533 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 29.6 p-10 -85.07 31.41 0.55 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.589 0.709 . . . . 0.0 109.951 177.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.439 ' H ' ' C ' ' A' ' 83' ' ' CYS . 9.5 ptt-85 -70.19 162.2 28.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.714 173.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.485 ' HA ' ' CE1' ' A' ' 44' ' ' PHE . 32.2 t -90.42 113.81 25.81 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.879 0.371 . . . . 0.0 110.486 179.498 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.443 ' CD ' ' HZ1' ' A' ' 76' ' ' LYS . 1.7 pm0 -100.95 9.19 42.56 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.618 176.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.697 -177.001 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' MET . . . . . 0.501 ' O ' ' HB3' ' A' ' 37' ' ' GLU . 16.8 ptm . . . . . 0 N--CA 1.484 1.265 0 CA-C-O 121.228 0.537 . . . . 0.0 111.228 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.557 ' HB3' ' O ' ' A' ' 35' ' ' CYS . . . -81.58 160.12 23.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.62 -174.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.0 tp -121.12 143.9 48.85 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -178.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.535 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 30.8 mtmm -106.44 113.32 26.77 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.911 -0.315 . . . . 0.0 111.181 -177.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.609 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 34.7 m -116.47 138.11 51.64 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.729 178.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.652 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 11.8 m-85 -57.23 105.6 0.25 Allowed 'General case' 0 N--CA 1.465 0.309 0 O-C-N 123.118 0.261 . . . . 0.0 111.333 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.1 m -91.37 129.03 37.41 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 175.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.437 ' HD2' ' HA ' ' A' ' 28' ' ' ASP . 12.9 ttp180 -90.49 110.57 21.68 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 119.768 -0.773 . . . . 0.0 111.196 -175.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -93.56 96.79 10.08 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.094 176.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 76.34 -79.25 1.22 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 119.467 -1.349 . . . . 0.0 110.219 -171.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.437 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 14.0 t70 -146.4 -21.83 0.43 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 168.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -55.77 132.78 50.15 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 171.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.484 ' NH1' ' HG ' ' A' ' 86' ' ' SER . 1.7 mtt180 -114.48 111.26 21.13 Favored 'General case' 0 C--N 1.313 -1.022 0 C-N-CA 119.16 -1.016 . . . . 0.0 109.131 -178.373 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.8 m -99.41 147.17 25.52 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.282 -170.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.502 HG11 HD12 ' A' ' 82' ' ' LEU . 58.0 t -78.07 105.67 7.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 172.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.5 p -125.09 140.21 53.09 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 120.07 -0.652 . . . . 0.0 111.172 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.535 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 2.2 t -88.39 111.67 22.02 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.637 176.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . 0.557 ' O ' ' HB3' ' A' ' 19' ' ' ALA . 81.7 m -95.57 161.3 14.11 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.685 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.72 153.9 27.0 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.234 -175.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.501 ' HB3' ' O ' ' A' ' 18' ' ' MET . 2.7 pt-20 -66.84 -19.95 65.84 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.365 0.602 . . . . 0.0 110.914 178.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.552 ' HG2' HG22 ' A' ' 57' ' ' THR . 8.4 tt0 -46.72 -44.82 19.1 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.178 164.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.644 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 2.1 mt-30 -99.14 70.73 1.79 Allowed 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.541 -1.208 . . . . 0.0 109.567 -176.298 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.74 14.87 4.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.472 -0.786 . . . . 0.0 112.211 -173.544 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ARG . . . . . 0.673 ' CG ' ' HA ' ' A' ' 58' ' ' VAL . 13.6 mmt85 -131.77 177.4 7.55 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.374 0.606 . . . . 0.0 109.993 172.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.662 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 8.6 m -133.56 139.56 46.65 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.085 -0.961 . . . . 0.0 108.68 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.536 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -99.33 122.99 43.24 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.717 0.294 . . . . 0.0 110.341 -177.035 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.656 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 56.3 t80 -131.7 107.28 8.69 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.953 171.229 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.54 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 43.9 t -102.62 138.65 26.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 120.411 -0.516 . . . . 0.0 109.681 177.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.796 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 3.7 mm100 -77.9 139.27 39.22 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 176.009 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.653 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.1 mm? -135.03 153.0 78.2 Favored Pre-proline 0 C--N 1.317 -0.846 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.896 178.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -87.77 8.75 4.07 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.463 2.109 . . . . 0.0 112.221 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -133.92 -24.8 1.67 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.967 0.413 . . . . 0.0 110.95 -179.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.653 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 68.0 m -162.31 -157.83 0.49 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 -175.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -140.81 135.92 31.92 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 172.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.656 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 59.6 mt -88.96 127.05 41.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.621 178.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.468 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 24.2 mt-30 -139.35 130.46 26.55 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 123.499 0.499 . . . . 0.0 109.917 177.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -173.4 172.32 3.76 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.671 0.607 . . . . 0.0 110.198 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.609 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 34.7 m -98.82 138.24 36.25 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.683 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.536 ' HE3' HD12 ' A' ' 43' ' ' LEU . 66.0 mmtt -137.66 156.05 48.46 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.644 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 7.8 p -69.77 152.74 44.26 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 172.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.673 ' HA ' ' CG ' ' A' ' 41' ' ' ARG . 40.3 t -49.7 -55.33 5.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.799 0.333 . . . . 0.0 110.513 -176.568 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.574 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 39.0 tt0 -61.82 -55.14 33.02 Favored 'General case' 0 C--O 1.217 -0.624 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.371 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.791 ' O ' HG13 ' A' ' 64' ' ' VAL . 3.8 tt0 -54.46 -38.84 66.83 Favored 'General case' 0 C--O 1.206 -1.197 0 O-C-N 123.11 0.256 . . . . 0.0 111.202 -175.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.531 ' O ' HG21 ' A' ' 64' ' ' VAL . 2.4 t -69.68 -32.8 71.62 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 120.069 -0.652 . . . . 0.0 110.382 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.8 -39.35 87.73 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.038 171.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.574 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 14.5 mm-40 -57.79 -52.54 65.05 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.96 0.886 . . . . 0.0 110.217 176.306 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.791 HG13 ' O ' ' A' ' 60' ' ' GLN . 4.7 m -69.83 -26.41 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.759 0 CA-C-N 114.591 -1.186 . . . . 0.0 111.053 -178.669 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.511 HD11 ' HB2' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -55.75 -49.36 73.32 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 174.787 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -73.26 -36.39 66.36 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.535 -0.466 . . . . 0.0 112.102 -174.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.604 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.3 pt-20 -59.41 -43.35 93.05 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.292 -179.205 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . 0.502 HG22 ' O ' ' A' ' 64' ' ' VAL . 34.6 m -79.37 -34.95 16.57 Favored 'Isoleucine or valine' 0 C--O 1.231 0.096 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.488 -179.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 95.7 m -74.67 -20.54 59.83 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 0.0 110.882 -176.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.3 -23.34 57.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.021 0.439 . . . . 0.0 110.015 173.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.506 HG13 ' O ' ' A' ' 67' ' ' GLU . 14.3 mt -82.8 -25.86 8.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.723 176.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.437 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 115.52 7.67 15.66 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.279 -0.962 . . . . 0.0 112.017 -178.256 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -101.03 106.21 43.22 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-O 120.701 0.286 . . . . 0.0 111.063 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.796 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 74.8 Cg_exo -57.2 130.63 40.47 Favored 'Trans proline' 0 N--CA 1.471 0.173 0 C-N-CA 123.383 2.722 . . . . 0.0 113.043 177.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.511 ' HB2' HD11 ' A' ' 65' ' ' LEU . . . -126.16 159.32 33.23 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.034 175.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -135.46 120.98 19.31 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.836 -178.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.662 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 70.1 m -123.27 92.45 3.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.178 0.513 . . . . 0.0 110.721 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.7 p -110.29 159.87 17.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.763 -176.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 41.8 t -109.71 102.79 11.57 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.04 -178.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.554 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 9.9 tt0 -175.02 146.99 0.9 Allowed 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 -178.279 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.556 ' CB ' HD21 ' A' ' 82' ' ' LEU . 58.2 m-20 -63.78 135.18 56.43 Favored 'General case' 0 CA--C 1.504 -0.818 0 C-N-CA 117.878 -1.529 . . . . 0.0 109.313 177.031 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.652 ' HB3' ' CE2' ' A' ' 23' ' ' PHE . 0.2 OUTLIER 64.76 20.37 12.11 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.166 174.116 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' CYS . . . . . 0.554 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.7 t -65.24 -45.78 83.24 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.397 -173.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.502 ' N ' HD21 ' A' ' 84' ' ' ASN . 0.0 OUTLIER -70.79 110.37 5.53 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 119.517 -0.873 . . . . 0.0 109.443 174.738 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.469 ' HG2' ' O ' ' A' ' 83' ' ' CYS . 4.8 ptt180 -151.36 171.29 17.72 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.65 -172.145 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.484 ' HG ' ' NH1' ' A' ' 30' ' ' ARG . 17.6 m -55.96 121.84 10.21 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 123.885 0.74 . . . . 0.0 111.297 -179.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -118.26 -56.91 2.12 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.059 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.303 -178.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.514 HD23 HG22 ' A' ' 40' ' ' THR . 2.3 mm? . . . . . 0 CA--C 1.519 -0.239 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 33' ' ' THR . 30.5 mtmm -115.02 98.61 6.9 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 119.552 -0.859 . . . . 0.0 111.323 -178.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 27.9 m -123.1 165.98 15.93 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.12 175.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.451 ' HA ' ' O ' ' A' ' 31' ' ' THR . 76.8 m-85 -72.01 131.55 43.06 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.145 -176.65 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.1 m -116.82 128.02 54.88 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 167.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.492 ' NH1' ' HG2' ' A' ' 51' ' ' GLU . 18.6 ttt180 . . . . . 0 C--N 1.319 -0.756 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.441 -173.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 51.2 mtp85 . . . . . 0 N--CA 1.45 -0.453 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.451 ' O ' ' HA ' ' A' ' 23' ' ' PHE . 97.1 m -130.88 133.41 45.87 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.324 -175.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 59.3 t -73.9 106.5 3.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.868 175.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.579 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 38.4 p -106.46 148.16 28.49 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.607 178.127 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.524 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -107.3 112.51 25.39 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.458 -179.526 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.468 ' HB2' ' HB2' ' A' ' 39' ' ' GLN . 2.5 p -95.1 166.11 12.09 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.037 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.27 174.77 9.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.511 -176.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.08 -28.27 66.33 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.368 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.595 ' O ' HG23 ' A' ' 57' ' ' THR . 3.3 pt-20 -54.91 -56.78 15.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.645 175.015 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.741 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 54.9 mt-30 -86.96 53.6 2.89 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.774 -172.521 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.514 HG22 HD23 ' A' ' 20' ' ' LEU . 0.1 OUTLIER -73.67 -0.36 15.25 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -173.283 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.627 ' CG ' ' HA ' ' A' ' 58' ' ' VAL . 3.7 mmp_? -110.75 178.84 4.23 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 119.943 -0.703 . . . . 0.0 109.91 173.515 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.654 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 61.2 m -135.73 131.93 36.22 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.066 -177.065 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.51 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.5 OUTLIER -93.12 128.72 39.16 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.288 -176.815 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.616 ' HB2' ' HB2' ' A' ' 84' ' ' ASN . 80.7 t80 -140.16 117.3 11.21 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.147 172.334 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.59 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 40.5 t -115.11 136.05 53.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 178.67 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.795 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 8.2 mm100 -74.22 139.73 44.57 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.141 177.356 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.569 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.8 mm? -132.19 147.86 67.47 Favored Pre-proline 0 C--N 1.316 -0.862 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 172.474 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 11.6 Cg_exo -72.84 8.98 1.44 Allowed 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.682 2.255 . . . . 0.0 112.479 177.139 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -139.02 -59.35 0.59 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.394 0.616 . . . . 0.0 109.566 -177.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.569 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 13.1 m -121.62 -150.08 0.44 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.436 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HG2' ' NH1' ' A' ' 25' ' ' ARG . 2.7 pt-20 -151.21 147.8 27.45 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 177.389 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.59 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 22.5 mm -91.44 129.42 42.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.259 176.434 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.446 ' HB3' ' ND2' ' A' ' 84' ' ' ASN . 45.7 mt-30 -139.09 130.22 26.66 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.102 -178.473 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -173.6 160.56 3.81 Favored 'General case' 0 N--CA 1.463 0.21 0 O-C-N 123.403 0.439 . . . . 0.0 111.146 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.516 ' O ' ' HE2' ' A' ' 56' ' ' LYS . 1.3 m -79.27 147.25 32.6 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 168.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.516 ' HE2' ' O ' ' A' ' 55' ' ' CYS . 7.1 tppt? -156.96 132.5 9.31 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.154 -179.062 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.741 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 38.1 m -54.28 143.17 23.97 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.753 178.257 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.627 ' HA ' ' CG ' ' A' ' 41' ' ' ARG . 20.1 t -44.84 -61.46 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 123.796 0.685 . . . . 0.0 111.511 -173.138 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -57.51 -52.36 65.71 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.161 178.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.675 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 6.8 tp60 -54.56 -47.48 73.19 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.86 -176.625 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.66 ' HA ' HG22 ' A' ' 64' ' ' VAL . 4.2 t -65.9 -32.8 74.52 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.382 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.36 -41.35 85.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.217 0.532 . . . . 0.0 110.835 176.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.675 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 9.1 pt-20 -74.52 -38.07 62.9 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.552 -176.89 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.66 HG22 ' HA ' ' A' ' 61' ' ' CYS . 13.5 m -72.23 -26.32 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-O 121.428 0.632 . . . . 0.0 110.414 174.222 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.66 HD23 ' SG ' ' A' ' 77' ' ' CYS . 0.2 OUTLIER -56.02 -47.64 77.42 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 174.059 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -72.7 -36.56 67.87 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.054 -174.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.64 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.5 pt-20 -59.6 -43.68 93.64 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.236 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.54 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 35.0 m -79.17 -34.42 16.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.951 0.405 . . . . 0.0 111.552 -178.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 97.8 m -78.42 -15.67 58.42 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.165 0.507 . . . . 0.0 110.861 -176.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.64 -19.56 45.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.082 173.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.514 HG13 ' O ' ' A' ' 67' ' ' GLU . 29.9 mt -81.0 -27.11 10.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.864 177.872 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 119.76 4.18 11.84 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 119.891 -1.147 . . . . 0.0 112.306 -178.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -97.82 112.4 61.52 Favored Pre-proline 0 N--CA 1.449 -0.499 0 CA-C-O 120.536 0.208 . . . . 0.0 110.797 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.795 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 54.4 Cg_exo -58.29 134.98 65.13 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.11 2.54 . . . . 0.0 112.306 177.348 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -143.29 160.92 39.6 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 119.983 -0.687 . . . . 0.0 111.427 178.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.412 ' HE3' ' HB3' ' A' ' 76' ' ' LYS . 7.6 ptpp? -142.19 147.58 36.82 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.917 175.226 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.66 ' SG ' HD23 ' A' ' 65' ' ' LEU . 76.6 m -130.24 87.08 2.46 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.151 173.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 15.4 p -106.95 171.02 7.6 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 119.943 -0.703 . . . . 0.0 111.475 -175.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' CYS . . . . . 0.508 ' HB3' ' CZ ' ' A' ' 41' ' ' ARG . 10.0 p -115.35 107.08 14.77 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.085 0.469 . . . . 0.0 111.486 -174.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.536 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 23.7 tt0 177.63 153.17 0.27 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.697 ' HB3' HD22 ' A' ' 82' ' ' LEU . 62.2 m-20 -64.43 137.31 57.81 Favored 'General case' 0 CA--C 1.505 -0.765 0 C-N-CA 117.563 -1.655 . . . . 0.0 108.66 173.505 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.697 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.99 15.8 10.19 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.607 175.12 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 83' ' ' CYS . . . . . 0.536 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.2 t -64.83 -23.42 67.23 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.654 -172.497 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.616 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 19.5 p-10 . . . . . 0 N--CA 1.45 -0.429 0 CA-C-O 122.03 0.919 . . . . 0.0 110.606 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 46.2 tp . . . . . 0 C--O 1.235 0.303 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.512 ' HA ' ' O ' ' A' ' 33' ' ' THR . 9.9 mtmp? -91.44 102.9 15.58 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 120.449 -0.5 . . . . 0.0 111.306 178.776 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 30.4 m -111.26 139.34 46.73 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 178.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.666 ' N ' HD21 ' A' ' 84' ' ' ASN . 19.0 m-85 -54.24 123.86 14.07 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.893 175.248 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -100.61 167.36 10.39 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 171.287 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.569 ' HG3' ' HB2' ' A' ' 53' ' ' GLN . 7.2 mtp180 . . . . . 0 C--N 1.324 -0.528 0 C-N-CA 120.062 -0.655 . . . . 0.0 112.241 178.206 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.2 mmt85 . . . . . 0 N--CA 1.446 -0.666 0 CA-C-O 121.351 0.596 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.3 m -114.28 114.9 26.58 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.53 -169.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.4 HG22 ' CE1' ' A' ' 23' ' ' PHE . 48.6 t -80.01 106.37 11.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 174.05 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.512 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 47.2 p -128.48 142.74 50.99 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.313 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 t -85.43 121.73 28.56 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 165.296 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.4 t -87.66 -163.39 0.93 Allowed 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.536 -172.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.27 168.67 12.52 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.65 -0.42 . . . . 0.0 111.04 -176.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -60.21 -18.68 50.05 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.042 178.101 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.812 ' HG2' HG22 ' A' ' 57' ' ' THR . 19.1 tt0 -63.63 -40.94 98.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.44 176.767 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.406 ' OE1' ' HB3' ' A' ' 38' ' ' GLU . 22.0 mp0 -96.98 120.88 38.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.656 0.741 . . . . 0.0 112.741 -169.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.428 ' OG1' HG23 ' A' ' 58' ' ' VAL . 1.1 p -124.92 12.53 8.43 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.552 -1.204 . . . . 0.0 110.582 177.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.512 ' CG ' ' HB3' ' A' ' 77' ' ' CYS . 8.2 tpp85 -138.18 173.4 11.66 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.489 177.511 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.651 ' HB3' ' OD1' ' A' ' 84' ' ' ASN . 18.1 m -126.36 149.31 49.28 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.557 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.3 OUTLIER -110.1 122.03 46.64 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 123.147 0.279 . . . . 0.0 110.298 -176.231 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.618 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 50.2 t80 -133.12 104.06 6.32 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.487 173.688 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.531 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 61.8 t -101.48 134.36 42.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.118 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.746 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 1.6 mm100 -76.78 138.07 39.66 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 119.777 -0.769 . . . . 0.0 109.637 177.626 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.48 HD22 ' C ' ' A' ' 46' ' ' GLN . 2.9 mm? -138.51 152.38 70.96 Favored Pre-proline 0 C--N 1.314 -0.978 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.762 176.177 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -86.32 9.42 4.04 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 122.438 2.092 . . . . 0.0 111.424 172.022 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -125.0 -65.39 1.03 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.842 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.3 m -151.85 132.24 13.75 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.13 149.85 37.29 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.79 0.329 . . . . 0.0 110.542 -172.683 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.618 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 65.8 mt -90.95 124.91 43.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.377 178.172 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.569 ' HB2' ' HG3' ' A' ' 25' ' ' ARG . 48.5 mt-30 -135.85 129.96 33.16 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -176.25 163.69 2.6 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 123.419 0.449 . . . . 0.0 110.979 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 2.0 p -85.88 135.87 33.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.724 0.297 . . . . 0.0 110.585 177.539 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.559 ' HB2' ' HB2' ' A' ' 61' ' ' CYS . 68.1 mmtt -138.71 158.76 43.64 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 176.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.812 HG22 ' HG2' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -69.54 155.2 40.85 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.605 -1.258 . . . . 0.0 107.605 171.722 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.478 ' HA ' ' HB2' ' A' ' 41' ' ' ARG . 85.3 t -52.76 -46.09 50.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.254 -0.579 . . . . 0.0 109.92 179.077 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.582 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 37.5 tt0 -66.87 -55.56 14.2 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.117 178.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.806 ' O ' HG13 ' A' ' 64' ' ' VAL . 7.8 tt0 -54.84 -40.23 69.4 Favored 'General case' 0 C--O 1.212 -0.887 0 O-C-N 123.331 0.394 . . . . 0.0 110.594 -175.527 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.668 ' HA ' HG22 ' A' ' 64' ' ' VAL . 3.8 t -69.93 -32.19 70.35 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.711 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.37 -38.75 85.24 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.059 171.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.582 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 11.5 mm-40 -57.61 -52.71 64.3 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 122.114 0.959 . . . . 0.0 110.202 175.729 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.806 HG13 ' O ' ' A' ' 60' ' ' GLN . 4.2 m -71.06 -26.06 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.79 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.84 -178.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.662 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -56.09 -49.33 74.13 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 175.23 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -72.88 -37.11 67.43 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 120.562 -0.455 . . . . 0.0 112.011 -174.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.645 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 12.1 pt-20 -59.25 -42.95 92.33 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.109 -0.637 . . . . 0.0 110.355 -179.615 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.499 HG22 ' O ' ' A' ' 64' ' ' VAL . 34.8 m -79.3 -36.37 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-O 120.827 0.346 . . . . 0.0 111.691 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 98.3 m -74.75 -20.74 59.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.994 -175.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.61 -23.7 58.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.152 0.501 . . . . 0.0 110.149 174.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.497 HG13 ' O ' ' A' ' 67' ' ' GLU . 12.1 mt -81.03 -23.85 10.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.666 177.378 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.463 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 112.87 5.82 23.41 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.979 -178.122 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -98.66 107.94 45.61 Favored Pre-proline 0 N--CA 1.449 -0.475 0 CA-C-O 120.777 0.322 . . . . 0.0 111.081 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.746 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 74.9 Cg_exo -55.38 130.75 42.26 Favored 'Trans proline' 0 C--N 1.34 0.118 0 C-N-CA 123.478 2.785 . . . . 0.0 113.262 177.61 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.662 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -128.38 154.51 45.92 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.889 174.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -134.61 118.81 17.62 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.885 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.592 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 45.9 m -114.34 93.85 4.53 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.187 173.699 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 17.8 p -109.33 155.1 21.6 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.944 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 49.6 t -109.48 103.44 12.34 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 119.991 -0.684 . . . . 0.0 110.469 -174.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.511 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 14.4 tt0 -173.87 152.67 2.01 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 -179.36 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.722 ' HB3' HD22 ' A' ' 82' ' ' LEU . 28.7 m-20 -63.48 136.43 57.58 Favored 'General case' 0 CA--C 1.504 -0.812 0 C-N-CA 117.878 -1.529 . . . . 0.0 109.389 176.654 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.722 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 62.38 21.53 12.61 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.114 174.654 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 83' ' ' CYS . . . . . 0.511 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.1 t -68.43 -37.03 79.91 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.559 -172.166 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.666 HD21 ' N ' ' A' ' 23' ' ' PHE . 0.3 OUTLIER . . . . . 0 N--CA 1.453 -0.324 0 C-N-CA 119.085 -1.046 . . . . 0.0 109.528 175.454 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.627 HD23 HG22 ' A' ' 40' ' ' THR . 2.6 mm? . . . . . 0 N--CA 1.453 -0.297 0 CA-C-O 120.758 0.313 . . . . 0.0 110.829 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.761 ' HE3' ' N ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -83.92 124.49 31.05 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 171.689 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.624 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 12.3 t -147.47 153.54 39.67 Favored 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 119.399 -0.921 . . . . 0.0 109.972 -177.284 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.695 ' HD2' HD22 ' A' ' 84' ' ' ASN . 92.1 m-85 -84.55 123.13 29.96 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 119.179 -1.009 . . . . 0.0 109.354 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.5 m -113.78 131.42 56.22 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 175.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 25' ' ' ARG . 1.8 tpp180 . . . . . 0 C--N 1.322 -0.594 0 CA-C-O 121.059 0.457 . . . . 0.0 110.379 -178.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 30' ' ' ARG . 27.4 mtp-105 . . . . . 0 N--CA 1.452 -0.365 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.499 ' O ' ' HA ' ' A' ' 23' ' ' PHE . 9.1 t -140.15 163.97 31.3 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.753 -173.094 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.413 HG13 ' HB3' ' A' ' 21' ' ' LYS . 94.8 t -79.12 120.78 30.98 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.236 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.396 178.194 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.3 p -113.21 141.49 46.9 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.171 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.7 t -87.11 111.93 21.42 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 174.4 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.1 m -107.2 157.54 17.8 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.924 -171.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.12 170.99 10.39 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -167.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -52.68 -39.06 61.54 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.449 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 39' ' ' GLN . 4.5 pt-20 -56.85 -40.81 76.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.828 177.307 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.622 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 70.5 mt-30 -97.21 64.96 1.96 Allowed 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.797 -174.186 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.627 HG22 HD23 ' A' ' 20' ' ' LEU . 0.7 OUTLIER -89.71 27.28 1.56 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.433 0.635 . . . . 0.0 110.427 177.461 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.61 ' HD3' HG22 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -136.23 177.78 7.57 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.979 178.253 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.8 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.0 m -137.21 131.28 32.22 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.809 179.458 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.456 ' HG ' ' SG ' ' A' ' 61' ' ' CYS . 0.5 OUTLIER -94.01 118.43 31.5 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 176.87 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.558 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 91.5 t80 -134.76 118.83 17.49 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.226 175.415 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.569 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 58.8 t -125.29 141.59 44.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.982 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.651 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 12.9 mm-40 -83.52 137.1 34.02 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.138 0.494 . . . . 0.0 110.901 177.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.581 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.7 mm? -131.9 154.02 81.6 Favored Pre-proline 0 C--N 1.319 -0.744 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 175.639 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.91 18.72 1.43 Allowed 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.28 1.986 . . . . 0.0 112.267 177.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -138.35 -44.43 0.5 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.461 0.648 . . . . 0.0 109.747 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.581 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 48.1 m -150.77 -151.39 0.39 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 178.414 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.29 153.78 42.37 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.264 175.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.569 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 14.3 mm -87.65 127.01 41.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.491 177.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.533 ' HB3' ' O ' ' A' ' 23' ' ' PHE . 25.7 mt-30 -140.69 129.11 22.57 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 123.556 0.535 . . . . 0.0 110.232 176.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.48 ' OE2' HG23 ' A' ' 52' ' ' ILE . 0.5 OUTLIER -174.03 146.1 1.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.936 -177.314 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.624 ' SG ' ' HB3' ' A' ' 22' ' ' CYS . 88.2 m -79.91 118.67 21.87 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 119.984 -0.687 . . . . 0.0 109.223 169.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -124.0 156.18 36.92 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 174.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.622 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 15.6 p -67.34 153.8 42.84 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 119.405 -0.918 . . . . 0.0 109.435 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.61 HG22 ' HD3' ' A' ' 41' ' ' ARG . 58.7 t -53.31 -46.67 57.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 121.221 -0.192 . . . . 0.0 111.105 -175.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -62.3 -55.82 24.48 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 120.903 0.382 . . . . 0.0 111.234 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.6 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 58.5 tt0 -64.14 -42.86 96.64 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.59 -172.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.652 ' HA ' HG22 ' A' ' 64' ' ' VAL . 4.7 t -64.52 -31.5 72.73 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.5 -0.48 . . . . 0.0 109.84 178.277 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.436 ' O ' ' HB3' ' A' ' 65' ' ' LEU . . . -69.68 -40.07 76.6 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.546 -0.462 . . . . 0.0 111.209 176.445 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.6 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 12.4 pt-20 -72.85 -38.47 67.06 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.95 0.405 . . . . 0.0 110.653 -178.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.652 HG22 ' HA ' ' A' ' 61' ' ' CYS . 12.8 m -73.56 -26.39 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.366 0 CA-C-O 121.638 0.732 . . . . 0.0 110.446 174.22 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.558 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 25.6 tp -54.94 -47.46 74.42 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 174.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.555 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 40.0 tt0 -73.98 -39.84 63.39 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.486 -175.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.644 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.0 pt-20 -55.24 -45.28 76.03 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.549 -177.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.591 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 33.0 m -80.16 -32.93 13.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.555 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 13.9 p -70.19 -27.98 64.94 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.217 -178.207 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.32 -19.74 63.87 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.629 176.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 11.3 mt -87.85 -20.31 7.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.827 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 114.51 -1.88 23.5 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 119.935 -1.126 . . . . 0.0 112.648 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.419 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 80.4 m-85 -78.71 123.51 85.36 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.663 0.232 . . . . 0.0 111.155 -178.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.651 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 52.8 Cg_exo -62.0 117.68 4.53 Favored 'Trans proline' 0 CA--C 1.516 -0.394 0 C-N-CA 123.045 2.497 . . . . 0.0 111.973 175.31 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.476 ' HA ' ' O ' ' A' ' 44' ' ' PHE . . . -135.22 149.4 49.87 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.811 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 ptmt -150.15 112.64 4.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.483 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.8 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 29.6 m -103.23 92.56 4.56 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.569 170.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.3 p -107.84 160.39 15.78 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.654 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 7.9 p -109.42 101.36 10.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.991 0.424 . . . . 0.0 111.029 -175.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.569 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 3.4 tt0 179.64 152.04 0.41 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -179.513 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.671 ' HB3' HD22 ' A' ' 82' ' ' LEU . 78.0 m-20 -64.37 132.54 50.4 Favored 'General case' 0 CA--C 1.506 -0.714 0 C-N-CA 118.388 -1.325 . . . . 0.0 109.981 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.671 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.54 16.84 10.53 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.531 172.883 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 83' ' ' CYS . . . . . 0.569 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 39.6 t -61.37 -18.54 59.22 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -172.71 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.695 HD22 ' HD2' ' A' ' 23' ' ' PHE . 3.0 p-10 . . . . . 0 CA--C 1.541 0.599 0 CA-C-O 119.234 -0.412 . . . . 0.0 110.474 -179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 mm? . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.508 ' HG2' ' HB ' ' A' ' 34' ' ' THR . 29.0 mtmm -120.9 98.57 6.06 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 119.471 -0.892 . . . . 0.0 110.808 176.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.2 m -107.17 151.62 25.17 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.262 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -73.28 153.56 40.53 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.823 179.335 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.4 m -142.11 127.91 19.32 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.41 177.323 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.758 HH11 ' HG2' ' A' ' 51' ' ' GLU . 63.0 mtp180 . . . . . 0 C--N 1.327 -0.392 0 C-N-CA 119.379 -0.929 . . . . 0.0 111.161 -178.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.552 ' HB3' ' HG2' ' A' ' 25' ' ' ARG . 15.0 ptp180 . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 121.096 0.474 . . . . 0.0 110.562 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 19.1 p -94.99 157.02 16.08 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.199 -178.017 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 61.8 t -99.31 112.81 32.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 176.114 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.484 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 41.3 p -107.64 148.01 29.9 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.394 176.424 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.508 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 1.7 t -101.92 112.28 24.85 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.753 176.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 39' ' ' GLN . 1.6 p -95.12 162.55 13.66 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.4 -175.63 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.53 178.04 7.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.749 -173.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -51.23 -33.07 26.28 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.494 0.664 . . . . 0.0 110.343 174.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.51 ' HG2' HG22 ' A' ' 57' ' ' THR . 39.8 tt0 -51.3 -49.61 60.95 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.387 -1.278 . . . . 0.0 110.939 175.653 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.564 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 34.8 mm-40 -96.76 94.29 7.19 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 119.715 -0.794 . . . . 0.0 109.67 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.8 18.87 20.82 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.591 177.654 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.741 ' HG2' ' SG ' ' A' ' 61' ' ' CYS . 2.8 tpt180 -131.29 174.45 10.04 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.502 174.663 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.669 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.1 m -134.01 131.07 38.47 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.338 -0.847 . . . . 0.0 108.739 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.562 HD22 HG23 ' A' ' 45' ' ' VAL . 0.2 OUTLIER -91.79 128.91 37.81 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -179.328 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.553 ' HB2' ' HB2' ' A' ' 84' ' ' ASN . 24.9 t80 -138.36 102.14 4.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.323 172.838 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.606 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 31.8 t -105.35 133.95 48.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 175.396 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.881 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -97.68 134.01 41.44 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.013 -179.118 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.519 HD23 ' HA ' ' A' ' 51' ' ' GLU . 3.7 mm? -119.48 157.85 50.58 Favored Pre-proline 0 C--N 1.319 -0.734 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.38 -28.41 87.51 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.473 2.115 . . . . 0.0 113.013 -178.335 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -135.31 9.76 3.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.822 0.344 . . . . 0.0 111.021 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.452 ' C ' ' HB2' ' A' ' 47' ' ' LEU . 37.2 m -156.58 -166.63 2.18 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.528 -0.469 . . . . 0.0 109.97 -175.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.758 ' HG2' HH11 ' A' ' 25' ' ' ARG . 7.7 pt-20 -165.6 151.05 9.07 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 175.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.606 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 24.7 mm -105.87 128.39 60.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.457 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.435 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 17.7 mt-30 -139.2 130.56 26.94 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.999 -0.68 . . . . 0.0 110.124 -179.327 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -165.74 158.73 15.55 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.678 -178.498 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.422 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 6.3 m -77.98 117.51 19.38 Favored 'General case' 0 CA--C 1.507 -0.687 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 163.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.422 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 11.1 mptt -123.86 144.93 49.45 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 176.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.564 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 21.9 p -63.01 156.86 23.44 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 118.925 -1.11 . . . . 0.0 108.127 -178.105 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.56 HG22 ' HD3' ' A' ' 41' ' ' ARG . 57.6 t -58.17 -37.04 60.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.033 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -65.52 -55.68 16.48 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.981 177.065 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.633 ' O ' HG13 ' A' ' 64' ' ' VAL . 34.1 tt0 -64.06 -28.59 69.89 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.23 -175.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.741 ' SG ' ' HG2' ' A' ' 41' ' ' ARG . 0.5 OUTLIER -67.86 -33.84 75.54 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.997 178.975 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.12 -40.41 78.31 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 174.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.567 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 88.1 mt-10 -58.45 -53.2 61.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.647 177.195 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.637 HG22 ' HA ' ' A' ' 61' ' ' CYS . 17.7 m -72.8 -28.89 28.14 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.569 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.661 -177.076 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.607 HD12 ' HB3' ' A' ' 75' ' ' ALA . 52.5 tp -58.93 -50.79 72.71 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.617 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -75.21 -36.38 61.39 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.331 -176.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.625 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.4 pt-20 -56.33 -47.65 78.32 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.59 -176.02 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.599 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.6 m -80.67 -34.97 14.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 C-N-CA 120.809 -0.357 . . . . 0.0 111.806 -179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 89.7 m -67.76 -28.61 67.77 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.855 0.36 . . . . 0.0 110.955 -177.418 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.58 -21.52 62.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.992 0.425 . . . . 0.0 110.682 176.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 67' ' ' GLU . 8.9 mt -87.22 -20.13 7.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.269 0.557 . . . . 0.0 109.753 178.07 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 115.49 -1.12 22.04 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.015 -1.088 . . . . 0.0 112.494 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.518 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 63.1 m-85 -87.58 116.88 67.57 Favored Pre-proline 0 N--CA 1.448 -0.529 0 CA-C-O 120.596 0.236 . . . . 0.0 110.547 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.881 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 46.6 Cg_exo -63.08 129.08 24.63 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 123.193 2.595 . . . . 0.0 112.616 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.607 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -138.34 162.4 34.47 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.079 -0.649 . . . . 0.0 111.796 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.77 154.36 38.35 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.317 168.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.669 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 9.4 p -129.62 111.64 12.9 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-O 121.759 0.79 . . . . 0.0 109.912 164.006 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 2.5 p -106.08 153.21 22.39 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.174 179.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' CYS . . . . . 0.444 ' HB3' ' HD2' ' A' ' 41' ' ' ARG . 7.7 p -109.64 100.23 9.3 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.424 -0.51 . . . . 0.0 109.893 177.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 173.45 145.08 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -177.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.686 ' HB3' HD22 ' A' ' 82' ' ' LEU . 70.8 m-20 -61.65 139.24 58.31 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.328 -0.949 . . . . 0.0 110.593 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.686 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 62.82 17.81 10.21 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.582 171.738 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 14.7 p -79.58 -37.62 35.92 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.011 -175.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.553 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 20.4 p-10 . . . . . 0 N--CA 1.465 0.305 0 CA-C-O 121.149 0.499 . . . . 0.0 110.607 -177.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 30.2 tp . . . . . 0 C--O 1.235 0.294 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -118.08 109.58 16.6 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 119.556 -0.858 . . . . 0.0 111.273 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 38.7 m -128.81 163.27 25.57 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.674 -0.411 . . . . 0.0 110.679 175.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.474 ' HB3' ' HB3' ' A' ' 30' ' ' ARG . 98.8 m-85 -78.51 124.97 28.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.925 -177.44 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.468 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 48.2 m -125.14 125.44 43.72 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 172.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.576 ' HA ' ' HA ' ' A' ' 30' ' ' ARG . 39.9 ttp85 . . . . . 0 C--N 1.322 -0.622 0 C-N-CA 119.924 -0.71 . . . . 0.0 110.821 -175.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.576 ' HA ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 121.147 0.499 . . . . 0.0 111.965 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 35.2 p -100.45 144.38 29.52 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.911 174.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.9 t -76.05 105.69 5.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 120.258 -0.577 . . . . 0.0 109.938 178.248 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.5 p -97.44 149.67 21.89 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.207 -176.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.9 t -89.51 112.48 23.66 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 174.14 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.73 147.22 23.55 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.603 -174.224 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.88 176.99 8.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.234 -0.439 . . . . 0.0 112.072 -174.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -56.21 -39.55 72.65 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.539 -177.645 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.831 ' HG3' ' HG3' ' A' ' 39' ' ' GLN . 9.5 pt-20 -61.7 -34.06 75.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.929 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.831 ' HG3' ' HG3' ' A' ' 38' ' ' GLU . 29.2 mt-30 -95.5 59.31 2.13 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.421 -173.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.405 ' O ' ' HD2' ' A' ' 41' ' ' ARG . 0.2 OUTLIER -83.97 7.21 19.08 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.062 0.458 . . . . 0.0 111.484 -178.963 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 1.004 ' HD3' HG22 ' A' ' 58' ' ' VAL . 7.3 mpt_? -120.24 177.38 5.04 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 168.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.778 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 59.8 m -145.62 130.15 17.88 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 119.741 -0.784 . . . . 0.0 110.284 -176.265 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.409 ' HA ' HD23 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -88.52 135.96 33.22 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.082 0.467 . . . . 0.0 110.933 -175.075 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.517 ' O ' ' HA ' ' A' ' 75' ' ' ALA . 20.1 t80 -139.71 109.23 6.21 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.979 -1.009 . . . . 0.0 108.673 170.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.585 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 27.8 t -115.04 123.79 71.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 173.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -94.32 116.28 28.64 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.436 0.636 . . . . 0.0 110.162 -178.074 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.616 ' HB2' ' O ' ' A' ' 50' ' ' SER . 2.3 mm? -111.15 156.37 41.12 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.59 -178.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -75.31 15.34 0.81 Allowed 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.01 2.473 . . . . 0.0 112.829 178.349 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -141.15 -45.98 0.38 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.539 0.685 . . . . 0.0 110.175 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.616 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 54.2 m -146.45 -163.08 1.66 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 177.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.498 ' HA ' HD23 ' A' ' 47' ' ' LEU . 29.7 mt-10 -142.88 152.04 41.69 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 119.928 -0.709 . . . . 0.0 111.025 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.585 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 49.8 mt -103.28 102.63 13.92 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.583 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.019 176.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.468 ' O ' ' HA ' ' A' ' 24' ' ' THR . 54.0 mt-30 -124.75 130.61 52.74 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 119.799 -0.761 . . . . 0.0 109.878 178.22 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -168.7 167.75 11.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.91 -176.049 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 16.3 m -90.99 119.49 31.22 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.692 -0.803 . . . . 0.0 108.9 171.103 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -121.23 139.99 52.64 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.493 -174.117 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.59 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 30.5 p -64.3 147.24 52.92 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 119.891 -0.723 . . . . 0.0 109.852 -178.722 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 1.004 HG22 ' HD3' ' A' ' 41' ' ' ARG . 25.0 t -51.65 -50.02 32.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 O-C-N 123.439 0.462 . . . . 0.0 112.145 -171.172 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.6 ' HG3' ' HG2' ' A' ' 60' ' ' GLN . 17.6 pt20 -63.03 -48.44 78.74 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 120.874 0.369 . . . . 0.0 111.872 -176.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.624 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 10.8 mm-40 -69.5 -38.49 77.63 Favored 'General case' 0 C--O 1.212 -0.919 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 -176.696 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.633 ' HA ' HG22 ' A' ' 64' ' ' VAL . 0.8 OUTLIER -60.96 -33.15 72.75 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.404 -178.728 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.63 -47.46 75.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.972 0.415 . . . . 0.0 110.454 177.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.624 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 8.2 pt-20 -72.16 -36.85 69.41 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.032 -176.032 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.633 HG22 ' HA ' ' A' ' 61' ' ' CYS . 14.4 m -74.41 -27.21 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 CA-C-O 121.524 0.678 . . . . 0.0 110.553 177.012 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 58.3 tp -59.08 -49.42 77.94 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 174.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.561 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 44.0 mt-10 -74.1 -32.04 63.05 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.556 -175.417 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.629 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.5 pt-20 -61.4 -44.96 96.24 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 120.159 -0.617 . . . . 0.0 109.929 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.557 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 33.6 m -80.21 -32.47 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.561 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 27.7 p -73.77 -25.29 60.07 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 120.201 -0.6 . . . . 0.0 111.203 -178.357 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.07 -21.45 63.15 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.061 0.458 . . . . 0.0 110.275 175.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 67' ' ' GLU . 16.4 mt -82.47 -18.43 10.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.515 176.338 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 105.48 9.06 34.17 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.197 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -89.76 122.52 67.96 Favored Pre-proline 0 N--CA 1.448 -0.561 0 CA-C-O 120.974 0.416 . . . . 0.0 111.749 -178.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_exo -51.95 124.93 15.77 Favored 'Trans proline' 0 N--CA 1.471 0.174 0 C-N-CA 123.929 3.086 . . . . 0.0 112.566 174.18 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.517 ' HA ' ' O ' ' A' ' 44' ' ' PHE . . . -151.93 157.85 42.36 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 119.955 -0.698 . . . . 0.0 112.09 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -155.5 147.07 22.98 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.956 172.033 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.778 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 27.6 p -130.84 94.51 3.63 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.536 0.684 . . . . 0.0 109.513 165.32 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 6.0 p -106.98 166.92 10.25 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.932 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 9.2 p -109.26 105.33 14.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.932 0.396 . . . . 0.0 110.991 -175.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.585 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 4.3 tt0 175.25 147.36 0.08 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 -176.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.702 ' HB3' HD22 ' A' ' 82' ' ' LEU . 16.5 m-20 -61.84 135.71 57.69 Favored 'General case' 0 CA--C 1.504 -0.825 0 C-N-CA 118.979 -1.088 . . . . 0.0 109.312 175.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.702 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 63.6 19.42 11.7 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.238 175.427 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 83' ' ' CYS . . . . . 0.585 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.2 t -73.57 -31.58 63.68 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.666 -176.038 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.416 ' HB3' ' CB ' ' A' ' 42' ' ' CYS . 22.0 p-10 . . . . . 0 C--N 1.322 -0.605 0 C-N-CA 120.164 -0.615 . . . . 0.0 110.012 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 30.2 tp . . . . . 0 C--O 1.234 0.246 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt -111.26 98.67 7.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.099 0.476 . . . . 0.0 111.205 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.441 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 18.0 m -108.02 153.44 23.1 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 175.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -71.87 134.98 46.4 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.089 -0.645 . . . . 0.0 110.287 175.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.5 p -115.45 118.32 32.85 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 172.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.512 ' HD3' ' O ' ' A' ' 51' ' ' GLU . 32.5 ttt85 . . . . . 0 C--N 1.322 -0.591 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.071 -178.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.443 HH11 ' HD3' ' A' ' 30' ' ' ARG . 9.4 ptp180 . . . . . 0 N--CA 1.446 -0.635 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -103.83 136.37 43.64 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.478 -172.167 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.2 t -75.47 106.63 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 169.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 40.2 p -121.25 131.75 54.4 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 119.841 -0.743 . . . . 0.0 110.938 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.415 HG22 ' H ' ' A' ' 34' ' ' THR . 1.5 t -72.84 116.57 13.5 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 169.791 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.83 177.9 7.15 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -174.48 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.523 ' HB3' ' OE1' ' A' ' 38' ' ' GLU . . . -66.36 161.09 23.27 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 119.267 -0.973 . . . . 0.0 109.257 178.254 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -80.44 -6.81 58.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -165.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.523 ' OE1' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -80.19 -30.42 38.76 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.118 173.089 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.65 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 30.3 mt-30 -80.46 97.25 7.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.119 179.323 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.26 11.31 33.09 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.411 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.839 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 18.0 mmt85 -129.33 179.37 5.82 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.437 0.637 . . . . 0.0 110.676 175.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.63 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 82.9 m -136.48 132.88 35.93 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.738 -171.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.401 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.3 OUTLIER -104.14 125.68 50.64 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.007 -172.185 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.828 ' HD2' ' HD3' ' A' ' 76' ' ' LYS . 49.7 t80 -141.15 124.88 16.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.572 172.435 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.513 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 41.4 t -121.54 140.53 45.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.366 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.743 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 10.0 mm100 -72.72 134.07 44.86 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.095 0.247 . . . . 0.0 110.875 178.552 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.503 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.2 mm? -129.95 143.93 51.03 Favored Pre-proline 0 C--N 1.326 -0.437 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 174.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 7.2 Cg_exo -75.19 28.54 0.37 Allowed 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 123.294 2.663 . . . . 0.0 113.226 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -172.13 -26.02 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.04 0.448 . . . . 0.0 111.088 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.503 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 70.2 m -149.7 -153.31 0.48 Allowed 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.512 ' O ' ' HD3' ' A' ' 25' ' ' ARG . 10.2 pt-20 -149.11 151.96 35.31 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.703 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 68.1 mt -101.93 131.09 50.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.049 175.24 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.401 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 39.1 mt-30 -138.87 130.73 27.78 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.737 ' HG2' ' HE2' ' A' ' 56' ' ' LYS . 2.9 tp10 -168.58 157.24 8.54 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 123.396 0.435 . . . . 0.0 109.863 -168.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 60.6 m -94.84 139.25 31.55 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 173.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.737 ' HE2' ' HG2' ' A' ' 54' ' ' GLU . 18.6 mmtt -147.0 149.41 33.09 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 176.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.65 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 68.3 p -66.48 153.16 43.6 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 175.779 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.687 HG22 ' HG2' ' A' ' 41' ' ' ARG . 19.9 t -48.67 -49.49 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 120.863 0.363 . . . . 0.0 110.63 -175.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -64.09 -57.08 10.65 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.766 -178.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.706 ' O ' HG13 ' A' ' 64' ' ' VAL . 96.2 mt-30 -63.75 -28.96 70.24 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.191 -175.079 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.674 ' HA ' HG22 ' A' ' 64' ' ' VAL . 5.4 t -71.36 -33.02 69.19 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.59 -35.95 70.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.079 0.466 . . . . 0.0 109.951 173.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.404 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 48.7 mt-10 -62.38 -52.28 64.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.573 175.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.706 HG13 ' O ' ' A' ' 60' ' ' GLN . 15.2 m -69.47 -26.65 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.615 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.417 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.576 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -58.08 -49.03 78.34 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 174.077 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -73.19 -33.87 65.65 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.009 -174.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.659 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.0 pt-20 -59.92 -42.7 94.49 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 119.826 -0.749 . . . . 0.0 110.132 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.503 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.2 m -80.01 -36.16 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 99.1 m -74.52 -29.19 61.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.34 -174.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.64 -21.95 64.44 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.561 174.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 67' ' ' GLU . 14.8 mt -79.14 -25.49 12.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 121.283 0.563 . . . . 0.0 109.91 177.134 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.437 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 113.88 11.39 12.69 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 119.811 -1.185 . . . . 0.0 111.972 -176.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -102.26 105.1 41.18 Favored Pre-proline 0 N--CA 1.451 -0.401 0 CA-C-O 120.658 0.266 . . . . 0.0 111.014 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.743 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 87.4 Cg_exo -52.18 128.56 27.7 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 123.377 2.718 . . . . 0.0 113.001 177.16 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.576 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -136.29 161.88 34.54 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.018 -0.673 . . . . 0.0 111.193 176.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.828 ' HD3' ' HD2' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -138.27 152.51 48.62 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.24 177.277 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.839 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 9.3 t -145.71 89.78 1.94 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.998 174.425 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 7.2 p -107.55 162.95 13.49 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.942 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' CYS . . . . . 0.482 ' HB2' ' HD3' ' A' ' 41' ' ' ARG . 45.4 t -109.15 107.94 18.41 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.421 -174.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.486 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 9.7 tp10 171.26 150.79 0.05 OUTLIER 'General case' 0 C--O 1.237 0.444 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -178.745 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.65 ' HB3' HD22 ' A' ' 82' ' ' LEU . 96.4 m-20 -59.66 138.64 57.68 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 119.24 -0.984 . . . . 0.0 109.674 175.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.65 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.58 13.72 8.46 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.963 172.556 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 83' ' ' CYS . . . . . 0.486 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 7.8 t -71.86 -30.39 65.38 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.33 -173.283 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.565 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 28.2 p-10 . . . . . 0 C--N 1.329 -0.311 0 CA-C-O 121.52 0.676 . . . . 0.0 110.362 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.451 HD23 HG22 ' A' ' 40' ' ' THR . 3.3 mm? . . . . . 0 C--O 1.235 0.333 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.442 ' HB3' ' CG1' ' A' ' 32' ' ' VAL . 19.0 mtpp -120.95 116.39 25.02 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 119.605 -0.838 . . . . 0.0 111.075 177.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.3 m -140.13 170.09 16.48 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.577 176.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -76.84 132.2 39.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.825 -176.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.3 m -130.07 158.29 40.03 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 175.321 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 15.1 mmm180 . . . . . 0 C--N 1.325 -0.472 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.94 -179.052 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 45.1 mtt180 . . . . . 0 N--CA 1.448 -0.556 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.5 m -113.49 131.44 56.04 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.098 -170.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.442 ' CG1' ' HB3' ' A' ' 21' ' ' LYS . 98.7 t -73.04 105.38 2.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 174.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.5 p -94.82 149.88 20.78 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.622 0.725 . . . . 0.0 111.479 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -72.56 127.16 31.71 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 161.52 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.401 ' HB3' ' OE1' ' A' ' 39' ' ' GLN . 0.8 OUTLIER -110.04 153.25 24.89 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 119.804 -0.758 . . . . 0.0 109.622 -179.252 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.82 164.99 11.33 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -172.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -58.21 -34.24 70.17 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.451 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.641 ' HG3' ' HG3' ' A' ' 39' ' ' GLN . 4.1 pt-20 -60.91 -38.57 86.19 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.42 0.629 . . . . 0.0 110.491 175.258 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.641 ' HG3' ' HG3' ' A' ' 38' ' ' GLU . 75.4 mt-30 -88.16 74.89 8.72 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.53 -174.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.451 HG22 HD23 ' A' ' 20' ' ' LEU . 0.9 OUTLIER -95.56 16.51 16.94 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.568 0.699 . . . . 0.0 110.33 177.734 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.877 ' HD3' HG22 ' A' ' 58' ' ' VAL . 0.6 OUTLIER -128.35 177.6 6.85 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.471 173.502 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.778 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.9 m -142.3 131.04 22.76 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.095 -178.225 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.498 HD22 HG23 ' A' ' 45' ' ' VAL . 0.2 OUTLIER -95.37 136.73 35.37 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.005 0.431 . . . . 0.0 110.722 -177.231 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.645 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 1.6 t80 -145.16 109.42 4.87 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.196 -0.911 . . . . 0.0 108.781 171.603 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.549 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 46.0 t -110.09 133.76 54.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.839 179.46 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.817 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 52.6 mm-40 -77.81 140.82 39.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.877 0.37 . . . . 0.0 110.431 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.2 mm? -128.23 152.17 77.43 Favored Pre-proline 0 C--N 1.319 -0.759 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.649 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -70.87 -11.18 29.03 Favored 'Trans proline' 0 CA--C 1.529 0.258 0 C-N-CA 122.391 2.061 . . . . 0.0 112.622 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -135.86 -0.56 2.55 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.52 0.2 . . . . 0.0 111.434 -177.102 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.598 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 32.6 p -169.57 -163.92 0.41 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -175.154 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -148.5 152.45 36.9 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 177.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.645 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 74.7 mt -105.61 130.4 57.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.368 176.4 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -139.28 131.32 27.93 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 177.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -167.71 162.07 13.75 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 123.376 0.423 . . . . 0.0 110.706 -178.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 13.3 m -89.12 134.07 34.15 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.128 -0.629 . . . . 0.0 109.465 172.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.4 tppt? -138.46 153.05 48.81 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -176.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.568 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 10.9 p -73.62 152.12 40.63 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 119.468 -0.893 . . . . 0.0 109.154 178.561 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.877 HG22 ' HD3' ' A' ' 41' ' ' ARG . 50.7 t -59.19 -41.54 84.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 120.653 0.263 . . . . 0.0 111.517 -175.424 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.611 ' HG3' ' N ' ' A' ' 60' ' ' GLN . 12.3 pt20 -69.05 -48.0 63.92 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.663 -177.407 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.627 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 10.7 mm-40 -69.33 -37.49 77.73 Favored 'General case' 0 C--O 1.211 -0.94 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -176.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.672 ' SG ' ' HG2' ' A' ' 41' ' ' ARG . 1.9 p -61.65 -32.7 72.88 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.485 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.9 -47.19 75.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.917 0.389 . . . . 0.0 110.567 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.627 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 8.9 pt-20 -71.55 -37.76 71.07 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.9 -176.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.653 HG22 ' HA ' ' A' ' 61' ' ' CYS . 12.1 m -73.59 -26.52 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 121.566 0.698 . . . . 0.0 110.479 176.684 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.579 HD12 ' HB3' ' A' ' 75' ' ' ALA . 50.4 tp -58.33 -49.75 76.07 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.108 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.543 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 41.7 mt-10 -74.33 -33.1 63.06 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.432 -175.335 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.623 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.4 pt-20 -60.31 -45.85 91.95 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 120.254 -0.578 . . . . 0.0 110.139 -179.374 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.586 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 35.0 m -79.9 -32.62 14.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 C-N-CA 120.743 -0.383 . . . . 0.0 111.944 -178.661 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.543 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 21.3 p -71.27 -26.23 62.8 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 120.394 -0.522 . . . . 0.0 110.875 -178.555 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.64 -22.76 61.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.488 175.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 67' ' ' GLU . 19.0 mt -83.6 -25.68 7.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.767 177.45 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 121.39 -0.61 11.39 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 119.858 -1.163 . . . . 0.0 112.508 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.407 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 90.6 m-85 -85.93 115.27 61.1 Favored Pre-proline 0 N--CA 1.451 -0.385 0 CA-C-N 116.519 0.159 . . . . 0.0 110.863 -179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.817 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 33.6 Cg_exo -63.65 133.16 38.21 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.768 2.312 . . . . 0.0 111.402 174.423 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.579 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -146.89 163.32 36.48 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.343 -0.543 . . . . 0.0 111.59 -179.068 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.472 ' CG ' ' HB3' ' A' ' 44' ' ' PHE . 15.5 ptpt -143.99 150.11 37.77 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.638 174.256 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.778 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 27.7 p -139.92 98.21 3.41 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.79 0.805 . . . . 0.0 109.182 161.046 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.2 p -107.61 164.41 12.25 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.782 -178.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 7.5 p -107.93 100.77 10.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.349 0.595 . . . . 0.0 109.517 -178.369 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.534 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 24.8 tt0 175.13 137.64 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 -172.772 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.653 ' CB ' HD22 ' A' ' 82' ' ' LEU . 16.5 m-20 -62.06 139.02 58.46 Favored 'General case' 0 CA--C 1.505 -0.758 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.952 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.653 HD22 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.65 13.99 8.71 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.862 174.362 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 83' ' ' CYS . . . . . 0.534 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 47.4 t -71.43 -19.85 62.19 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.823 0.344 . . . . 0.0 111.59 -174.006 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.475 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 22.8 p-10 . . . . . 0 C--N 1.324 -0.509 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.596 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.6 tp . . . . . 0 CA--C 1.517 -0.289 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.5 mttt -82.22 141.27 33.13 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.972 178.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.567 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 6.6 t -161.66 153.89 19.7 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.602 -0.439 . . . . 0.0 109.851 -178.269 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -81.5 128.64 34.11 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.741 -0.383 . . . . 0.0 111.208 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 42.8 m -111.0 134.46 52.58 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 174.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.561 ' HD2' ' HB3' ' A' ' 30' ' ' ARG . 22.9 mmm-85 . . . . . 0 C--N 1.329 -0.291 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.827 -177.109 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.561 ' HB3' ' HD2' ' A' ' 25' ' ' ARG . 2.2 ptt180 . . . . . 0 N--CA 1.453 -0.289 0 CA-C-O 120.826 0.346 . . . . 0.0 110.125 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 94.2 m -99.12 138.4 36.27 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.827 -178.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 66.0 t -72.12 106.74 2.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 172.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.0 p -118.75 148.11 43.15 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.886 0.374 . . . . 0.0 111.266 -178.098 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.6 t -88.0 119.99 28.91 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 175.453 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.73 147.05 24.75 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 -177.379 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.82 166.57 19.09 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -172.422 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -55.75 -36.54 67.39 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.51 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.495 ' HG3' ' H ' ' A' ' 39' ' ' GLN . 2.9 pt-20 -50.57 -48.31 57.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.741 175.146 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.691 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 36.6 mt-30 -101.1 78.54 1.92 Allowed 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.141 -176.237 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.67 12.62 22.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.713 -175.601 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 1.011 ' HD3' ' SG ' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -121.51 177.94 5.01 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.377 0.608 . . . . 0.0 110.142 173.908 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.586 ' HB3' ' HB3' ' A' ' 84' ' ' ASN . 66.7 m -129.22 172.83 11.07 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.123 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.57 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.4 OUTLIER -127.98 113.34 15.71 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.533 176.508 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.665 ' HD2' ' HD2' ' A' ' 76' ' ' LYS . 2.6 t80 -124.8 99.52 6.19 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 172.056 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.608 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 19.2 t -104.34 133.0 49.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.054 -0.976 . . . . 0.0 108.741 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.822 ' CG ' ' HB2' ' A' ' 74' ' ' PRO . 0.8 OUTLIER -83.42 141.04 32.0 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 120.006 -0.677 . . . . 0.0 110.001 179.592 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.777 HD21 HG12 ' A' ' 52' ' ' ILE . 3.7 mm? -133.62 152.02 78.24 Favored Pre-proline 0 C--N 1.317 -0.817 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.29 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -78.57 3.22 7.43 Favored 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 122.755 2.303 . . . . 0.0 111.583 171.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -124.25 -31.99 3.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.875 -176.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.683 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 11.4 p -169.36 -154.95 0.13 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.636 -173.454 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.79 131.83 26.23 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.409 176.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.777 HG12 HD21 ' A' ' 47' ' ' LEU . 26.5 mm -82.54 129.12 37.99 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.204 176.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.629 ' HB3' ' ND2' ' A' ' 84' ' ' ASN . 6.5 mt-30 -135.84 131.85 35.87 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -167.25 150.21 6.26 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 123.529 0.518 . . . . 0.0 109.781 -170.037 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.567 ' SG ' ' HB3' ' A' ' 22' ' ' CYS . 6.4 m -93.01 132.39 37.15 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 172.353 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.453 ' HD3' ' HA ' ' A' ' 56' ' ' LYS . 3.3 tppt? -138.94 156.22 47.43 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 119.027 -1.069 . . . . 0.0 110.686 -178.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.691 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 35.4 p -66.28 153.41 42.67 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 177.551 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.622 ' HA ' ' HG3' ' A' ' 41' ' ' ARG . 20.9 t -59.29 -47.58 89.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 120.997 0.427 . . . . 0.0 110.663 -175.068 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -56.94 -55.72 30.9 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.054 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.59 ' O ' HG13 ' A' ' 64' ' ' VAL . 71.3 mt-30 -68.66 -25.56 64.87 Favored 'General case' 0 C--O 1.2 -1.552 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.605 -174.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.596 ' HA ' HG22 ' A' ' 64' ' ' VAL . 0.6 OUTLIER -63.35 -33.88 76.51 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.115 -0.634 . . . . 0.0 109.891 178.519 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.56 -39.62 73.84 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.091 0.472 . . . . 0.0 110.225 174.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -62.46 -52.42 63.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.834 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.633 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 16.2 m -68.71 -28.15 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.397 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 28.8 tp -58.02 -49.74 75.82 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 176.162 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.58 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 39.7 tt0 -73.88 -36.03 64.76 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.363 -175.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.633 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -58.24 -43.68 87.91 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.276 -177.182 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.544 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.0 m -79.7 -31.73 14.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 C-N-CA 120.48 -0.488 . . . . 0.0 111.714 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.58 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 37.7 p -72.98 -21.29 60.88 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.995 -179.235 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.09 -19.99 59.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.088 0.47 . . . . 0.0 110.27 176.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 10.7 mt -86.24 -15.92 9.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.334 176.478 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 108.9 -0.31 31.85 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.366 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -90.72 116.56 66.67 Favored Pre-proline 0 N--CA 1.448 -0.525 0 CA-C-O 120.692 0.282 . . . . 0.0 111.221 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.822 ' HB2' ' CG ' ' A' ' 46' ' ' GLN . 52.8 Cg_exo -58.24 140.66 95.13 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 123.169 2.579 . . . . 0.0 112.124 175.611 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.464 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -148.79 168.62 22.46 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.614 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.665 ' HD2' ' HD2' ' A' ' 44' ' ' PHE . 6.0 ptpp? -154.34 139.08 17.05 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.749 171.155 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 31.0 p -116.81 104.86 11.75 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 166.5 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.2 p -106.72 162.27 13.92 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 119.929 -0.708 . . . . 0.0 112.089 -178.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' CYS . . . . . 1.011 ' SG ' ' HD3' ' A' ' 41' ' ' ARG . 33.6 m -109.24 101.57 10.58 Favored 'General case' 0 CA--C 1.523 -0.076 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.909 175.009 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.588 ' HB3' ' HB3' ' A' ' 83' ' ' CYS . 16.0 tt0 176.85 141.46 0.07 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -177.858 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.748 ' HB3' HD22 ' A' ' 82' ' ' LEU . 15.9 m-20 -58.64 129.55 42.62 Favored 'General case' 0 CA--C 1.503 -0.828 0 C-N-CA 119.641 -0.824 . . . . 0.0 110.095 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.748 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.3 OUTLIER 64.77 15.81 10.03 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.927 173.278 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 83' ' ' CYS . . . . . 0.588 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . 9.9 p -63.24 -22.33 66.8 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.896 0.379 . . . . 0.0 111.701 -171.78 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.629 ' ND2' ' HB3' ' A' ' 53' ' ' GLN . 35.9 p-10 . . . . . 0 CA--C 1.536 0.419 0 CA-C-O 121.039 0.447 . . . . 0.0 111.116 -177.161 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.428 ' HG ' ' N ' ' A' ' 21' ' ' LYS . 32.1 tp . . . . . 0 N--CA 1.455 -0.192 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.428 ' N ' ' HG ' ' A' ' 20' ' ' LEU . 11.5 mtpt -125.89 114.15 18.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.04 177.149 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.599 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 12.9 m -128.43 158.5 38.15 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 174.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.43 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 15.6 m-85 -72.41 120.76 18.46 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.659 -0.416 . . . . 0.0 109.971 173.652 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 88.2 m -111.15 142.75 42.92 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 176.222 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 . . . . . 0 C--N 1.324 -0.524 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.883 -177.647 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 . . . . . 0 N--CA 1.456 -0.17 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 p -129.48 169.33 15.09 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.565 -178.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 53.8 t -72.11 121.24 22.01 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.408 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.2 p -123.14 132.59 54.13 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 119.994 -0.683 . . . . 0.0 110.674 174.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 t -76.42 113.97 14.6 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 170.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.76 170.23 11.4 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.878 -170.543 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.413 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -66.81 166.35 13.43 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.502 -179.335 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.06 -19.94 56.46 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.723 -166.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.42 ' HG2' HG22 ' A' ' 57' ' ' THR . 3.2 pm0 -81.96 -22.85 36.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.284 0.564 . . . . 0.0 109.611 176.153 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.455 ' OE1' ' HB2' ' A' ' 55' ' ' CYS . 8.3 mt-30 -72.89 121.55 20.2 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.193 176.506 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.541 ' OG1' HG23 ' A' ' 58' ' ' VAL . 0.5 OUTLIER -134.51 4.83 3.41 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.327 -0.852 . . . . 0.0 111.597 -170.39 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.763 ' CG ' ' HA ' ' A' ' 58' ' ' VAL . 6.1 mmm180 -138.49 178.48 7.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.633 0.73 . . . . 0.0 110.09 175.578 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.545 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 8.8 m -132.36 131.5 41.94 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 114.437 -1.256 . . . . 0.0 109.044 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.495 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.2 OUTLIER -91.75 130.44 37.54 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 121.031 -0.267 . . . . 0.0 110.306 179.504 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.798 ' HD2' ' HG3' ' A' ' 76' ' ' LYS . 57.1 t80 -128.45 100.9 5.96 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.28 170.416 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.613 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 16.8 t -99.44 129.95 49.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 174.735 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.896 ' HB3' ' HB2' ' A' ' 74' ' ' PRO . 3.0 tp60 -99.04 116.77 32.04 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.197 -178.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.67 HD21 HG12 ' A' ' 52' ' ' ILE . 1.8 mm? -114.94 156.93 44.5 Favored Pre-proline 0 C--N 1.327 -0.38 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 -176.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -75.49 18.98 0.55 Allowed 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 122.877 2.385 . . . . 0.0 112.391 175.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -136.55 -55.75 0.74 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.517 0.675 . . . . 0.0 109.44 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.607 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 41.5 p -148.26 -162.58 1.58 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.968 -1.015 . . . . 0.0 108.283 176.825 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.539 ' HA ' HD23 ' A' ' 47' ' ' LEU . 2.3 mp0 -131.14 147.32 52.59 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 118.434 -1.306 . . . . 0.0 110.9 177.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.67 HG12 HD21 ' A' ' 47' ' ' LEU . 52.0 mm -93.77 132.11 38.83 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.909 176.014 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.495 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 14.9 mt-30 -141.67 130.88 23.45 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 120.04 -0.664 . . . . 0.0 109.406 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.434 ' HB2' ' HZ2' ' A' ' 56' ' ' LYS . 2.6 pt-20 -163.03 153.87 16.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.245 -176.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.737 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 79.1 m -82.04 125.22 30.56 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.294 169.454 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.737 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 11.3 mptt -132.71 -179.17 5.3 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 173.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.516 ' HA ' ' H ' ' A' ' 40' ' ' THR . 16.1 p -86.06 169.05 13.52 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 119.274 -0.971 . . . . 0.0 108.744 177.402 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.763 ' HA ' ' CG ' ' A' ' 41' ' ' ARG . 66.8 t -61.16 -50.25 81.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 C-N-CA 119.583 -0.847 . . . . 0.0 110.102 178.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -56.53 -54.37 46.61 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.863 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.589 ' O ' HG22 ' A' ' 64' ' ' VAL . 17.9 mm-40 -58.91 -34.91 72.24 Favored 'General case' 0 C--O 1.204 -1.326 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.964 -177.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.563 ' HA ' HG22 ' A' ' 64' ' ' VAL . 0.5 OUTLIER -68.22 -34.21 75.82 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.055 -175.921 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.71 -35.8 67.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.347 0.594 . . . . 0.0 109.611 176.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.559 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 74.8 mt-10 -65.91 -52.02 53.64 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.814 -1.084 . . . . 0.0 110.943 178.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.624 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 33.4 m -68.44 -28.7 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.54 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.277 178.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.459 HD12 ' HB3' ' A' ' 75' ' ' ALA . 46.5 tp -58.03 -50.9 71.83 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 176.075 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.591 ' HA ' ' HG1' ' A' ' 69' ' ' THR . 40.8 tt0 -74.2 -33.88 63.55 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.183 -174.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.624 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -60.19 -44.61 94.95 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.313 -177.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.541 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 28.4 m -80.37 -28.42 11.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.938 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.591 ' HG1' ' HA ' ' A' ' 66' ' ' GLU . 31.0 p -75.48 -22.47 57.19 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.842 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.15 -18.43 61.88 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.184 0.516 . . . . 0.0 110.285 176.168 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 19.2 mt -86.37 -18.34 8.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.504 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 107.67 3.76 34.61 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.182 -1.008 . . . . 0.0 112.498 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 55.9 m-85 -90.24 134.11 32.02 Favored Pre-proline 0 N--CA 1.447 -0.603 0 CA-C-O 120.808 0.337 . . . . 0.0 111.478 -178.252 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.896 ' HB2' ' HB3' ' A' ' 46' ' ' GLN . 79.7 Cg_exo -56.17 130.79 42.06 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.598 2.865 . . . . 0.0 112.054 173.217 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.52 ' C ' ' HG2' ' A' ' 76' ' ' LYS . . . -149.16 156.63 42.46 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.711 -0.796 . . . . 0.0 111.861 179.166 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.798 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -153.85 155.52 35.91 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.243 174.943 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 26.9 p -137.46 115.72 11.79 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.627 0.727 . . . . 0.0 109.901 166.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.1 p -108.17 172.48 6.81 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.891 -176.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' CYS . . . . . 0.435 ' HB2' ' CD ' ' A' ' 41' ' ' ARG . 52.9 t -131.14 100.97 5.39 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.13 178.158 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.599 ' HB3' ' HB3' ' A' ' 83' ' ' CYS . 14.1 tt0 174.81 148.73 0.08 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 -175.469 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.647 ' HB3' HD22 ' A' ' 82' ' ' LEU . 1.0 OUTLIER -55.93 124.02 16.27 Favored 'General case' 0 CA--C 1.509 -0.598 0 C-N-CA 119.805 -0.758 . . . . 0.0 110.365 179.079 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.647 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.1 OUTLIER 66.02 16.06 10.31 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.752 169.713 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 83' ' ' CYS . . . . . 0.599 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . 21.3 p -64.53 -29.57 70.6 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -171.385 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.454 ' ND2' ' HB3' ' A' ' 53' ' ' GLN . 29.5 p-10 . . . . . 0 C--N 1.329 -0.286 0 CA-C-O 121.17 0.51 . . . . 0.0 110.773 -178.348 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.6 tp . . . . . 0 N--CA 1.453 -0.308 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.541 ' HE2' HG12 ' A' ' 32' ' ' VAL . 36.6 mtpt -107.0 104.36 14.01 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 118.867 -1.133 . . . . 0.0 111.685 -177.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.5 m -103.47 152.46 21.63 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 176.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.499 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 58.5 m-85 -71.65 149.67 45.34 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.565 176.526 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -121.29 132.03 54.55 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.052 172.194 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 . . . . . 0 C--N 1.323 -0.58 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.574 -175.383 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.425 ' HD3' HH11 ' A' ' 30' ' ' ARG . 8.7 ptp180 . . . . . 0 N--CA 1.441 -0.878 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.9 m -93.98 127.95 40.04 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.645 -172.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.541 HG12 ' HE2' ' A' ' 21' ' ' LYS . 25.0 t -75.93 104.02 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 176.186 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.43 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 1.3 p -115.82 149.24 38.9 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.652 -174.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.7 t -90.4 136.43 33.06 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.851 178.128 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -127.37 148.85 50.26 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 -178.117 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.526 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -82.89 -176.75 6.47 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -168.409 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.36 -43.83 92.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.597 -1.183 . . . . 0.0 112.715 -173.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.601 ' OE2' ' HG3' ' A' ' 39' ' ' GLN . 4.2 pm0 -62.63 -24.47 67.61 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.019 0.438 . . . . 0.0 110.027 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.734 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 37.4 mt-30 -110.1 52.39 0.73 Allowed 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.876 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -79.85 25.64 0.35 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.145 0.498 . . . . 0.0 111.445 178.031 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.76 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 16.1 mmt85 -131.34 179.52 5.98 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.752 172.223 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.733 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 62.7 m -142.95 131.49 22.4 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.625 -174.008 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.423 HD23 ' SG ' ' A' ' 61' ' ' CYS . 0.5 OUTLIER -100.39 127.68 46.64 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.983 0.421 . . . . 0.0 111.103 -175.697 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.658 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 40.7 t80 -142.35 115.6 8.92 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.588 174.097 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.438 ' HA ' ' HA ' ' A' ' 75' ' ' ALA . 58.2 t -105.92 138.04 33.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 C-N-CA 120.452 -0.499 . . . . 0.0 109.895 179.095 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.732 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 7.4 mm100 -74.93 137.45 41.67 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 120.094 -0.642 . . . . 0.0 109.944 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.525 ' HB2' ' C ' ' A' ' 50' ' ' SER . 3.3 mm? -131.85 143.13 47.79 Favored Pre-proline 0 C--N 1.312 -1.03 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.015 171.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 12.0 Cg_exo -72.12 -3.33 13.09 Favored 'Trans proline' 0 CA--C 1.529 0.254 0 C-N-CA 122.836 2.357 . . . . 0.0 112.776 -179.068 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 28.4 p90 -149.65 5.91 0.62 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.951 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.525 ' C ' ' HB2' ' A' ' 47' ' ' LEU . 66.8 m -161.67 -162.09 0.84 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -176.193 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -163.8 147.34 10.01 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 174.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.658 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 67.5 mt -106.07 136.85 38.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 177.722 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -146.83 129.9 16.42 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -177.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.553 ' HG3' ' HE2' ' A' ' 56' ' ' LYS . 7.0 pt-20 -179.26 157.26 0.8 Allowed 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.558 0.536 . . . . 0.0 109.965 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 2.8 m -81.34 141.4 34.06 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 119.809 -0.756 . . . . 0.0 109.121 175.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.553 ' HE2' ' HG3' ' A' ' 54' ' ' GLU . 69.6 mmtt -135.87 155.09 50.85 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.734 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 27.7 p -68.83 146.09 53.16 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 118.697 -1.201 . . . . 0.0 108.792 176.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.573 HG22 ' HG2' ' A' ' 41' ' ' ARG . 29.8 t -46.37 -54.73 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 O-C-N 123.461 0.476 . . . . 0.0 111.377 -173.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -63.09 -55.85 21.89 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.586 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.747 ' O ' HG13 ' A' ' 64' ' ' VAL . 99.1 mt-30 -64.51 -26.58 68.49 Favored 'General case' 0 C--O 1.204 -1.317 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.495 -174.278 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.691 ' HA ' HG22 ' A' ' 64' ' ' VAL . 8.7 t -71.77 -33.63 68.78 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 177.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.07 -34.5 73.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.085 0.469 . . . . 0.0 109.867 172.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -64.97 -51.24 62.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.664 176.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.747 HG13 ' O ' ' A' ' 60' ' ' GLN . 14.1 m -67.49 -27.06 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.251 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.691 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.48 -49.26 76.86 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 173.443 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -73.33 -34.16 65.53 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.144 -174.27 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.646 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.9 pt-20 -60.15 -42.15 94.3 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 120.034 -0.667 . . . . 0.0 110.068 -178.726 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.506 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.5 m -79.91 -36.67 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 CA-C-O 120.779 0.323 . . . . 0.0 111.796 179.193 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 96.0 m -71.98 -29.46 64.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.206 -175.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.94 -23.75 64.19 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.562 174.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.515 HG13 ' O ' ' A' ' 67' ' ' GLU . 18.6 mt -79.11 -26.02 13.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.323 0.582 . . . . 0.0 109.739 176.388 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.486 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 114.25 2.11 23.33 Favored Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 119.838 -1.172 . . . . 0.0 112.035 -177.139 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -96.03 107.31 33.89 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-O 120.555 0.217 . . . . 0.0 110.602 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.732 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 77.8 Cg_exo -56.74 134.65 65.82 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 123.257 2.638 . . . . 0.0 112.979 178.583 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.691 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -130.79 161.25 32.15 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.847 174.14 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -130.05 140.06 50.9 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.533 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.76 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 6.1 t -150.72 109.65 3.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.137 0.494 . . . . 0.0 109.793 173.459 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.3 p -136.43 172.3 13.22 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.321 -171.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' CYS . . . . . 0.584 ' SG ' ' HD3' ' A' ' 41' ' ' ARG . 55.7 m -107.88 101.9 11.14 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.074 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.484 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 7.5 tp10 179.06 142.15 0.12 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -176.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.714 ' HB3' HD22 ' A' ' 82' ' ' LEU . 43.7 m-20 -62.9 137.95 58.41 Favored 'General case' 0 CA--C 1.505 -0.776 0 C-N-CA 118.278 -1.369 . . . . 0.0 109.349 177.103 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.714 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 62.68 21.75 12.92 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.902 175.292 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 83' ' ' CYS . . . . . 0.484 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 6.4 t -69.62 -31.17 69.14 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.68 -174.574 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.634 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 28.7 p-10 . . . . . 0 C--N 1.328 -0.35 0 CA-C-O 122.202 1.001 . . . . 0.0 108.909 174.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 35.6 tp . . . . . 0 N--CA 1.454 -0.264 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.523 ' HG2' ' HB ' ' A' ' 34' ' ' THR . 33.4 mtmm -102.25 114.24 28.23 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.021 -178.636 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 18.0 m -113.46 173.42 6.42 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.612 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 46.2 m-85 -82.95 136.08 34.67 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 173.604 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.7 p -116.24 130.53 56.83 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 173.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.8 tpt180 . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.536 -176.562 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.424 ' HB3' ' OE1' ' A' ' 53' ' ' GLN . 30.2 ptt180 . . . . . 0 N--CA 1.447 -0.592 0 CA-C-O 121.466 0.65 . . . . 0.0 109.749 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -113.09 146.72 38.68 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.929 -173.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.408 HG13 HD11 ' A' ' 82' ' ' LEU . 94.4 t -80.96 108.11 13.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.029 175.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.1 p -119.4 148.37 43.29 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.853 0.359 . . . . 0.0 110.271 176.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.523 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 3.1 t -91.63 115.59 28.17 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.094 -0.642 . . . . 0.0 109.87 177.647 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -87.98 160.44 17.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.41 -0.813 . . . . 0.0 109.186 -176.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.546 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -74.89 -179.19 4.1 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.243 -0.583 . . . . 0.0 112.423 -169.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -63.83 -37.26 86.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.377 -172.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.546 ' OE2' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -76.11 -25.84 55.81 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.254 -174.028 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.641 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 40.4 mt-30 -98.24 80.68 2.69 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.366 0.603 . . . . 0.0 110.392 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.54 21.29 9.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.261 -0.882 . . . . 0.0 112.103 -176.407 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.827 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 15.8 mmt85 -126.82 179.69 5.25 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 119.956 -0.698 . . . . 0.0 109.947 171.126 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.699 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 63.8 m -139.73 131.88 28.09 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.54 -173.774 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.498 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 1.0 OUTLIER -103.69 130.64 51.2 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.673 0.273 . . . . 0.0 111.081 -171.899 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.725 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 1.2 t80 -146.75 104.05 3.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.331 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.584 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 46.3 t -102.48 136.14 36.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.922 178.547 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.782 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 10.5 mm100 -76.59 140.24 40.97 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.962 0.41 . . . . 0.0 110.791 -178.766 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.519 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.0 mm? -132.09 153.95 81.51 Favored Pre-proline 0 C--N 1.321 -0.656 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 174.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -74.63 18.17 0.52 Allowed 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 122.941 2.427 . . . . 0.0 113.018 179.347 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -160.46 -48.31 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.929 0.395 . . . . 0.0 110.634 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.519 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 20.5 m -120.55 -153.17 0.53 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.74 178.668 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -155.64 144.61 20.63 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.725 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 69.1 mt -89.84 128.95 41.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.381 -0.527 . . . . 0.0 109.761 176.495 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.498 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 49.0 mt-30 -139.48 131.53 27.94 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -177.759 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.909 ' HG2' ' HE2' ' A' ' 56' ' ' LYS . 1.1 tp10 -170.42 153.89 4.51 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -168.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 4.9 m -93.17 128.41 39.11 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 119.689 -0.805 . . . . 0.0 108.895 173.834 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.909 ' HE2' ' HG2' ' A' ' 54' ' ' GLU . 57.8 mmtt -131.12 147.65 52.64 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.641 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 46.0 p -62.8 153.67 32.25 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 174.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.634 HG22 ' HG2' ' A' ' 41' ' ' ARG . 40.9 t -49.67 -48.15 21.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 123.238 0.336 . . . . 0.0 110.87 -176.184 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -65.83 -56.11 13.57 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.464 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.7 ' O ' HG13 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -58.43 -34.12 70.45 Favored 'General case' 0 C--O 1.21 -0.995 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.803 -175.998 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.697 ' HA ' HG22 ' A' ' 64' ' ' VAL . 4.3 t -72.6 -33.4 66.68 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.613 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.85 -36.76 73.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.276 0.56 . . . . 0.0 109.698 173.465 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.565 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 92.6 mt-10 -59.99 -52.8 63.83 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.459 175.614 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.7 HG13 ' O ' ' A' ' 60' ' ' GLN . 17.9 m -70.38 -27.41 31.56 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.618 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.615 -178.81 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.683 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -59.3 -50.63 73.24 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 175.847 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -73.85 -33.28 64.04 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.944 -173.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.607 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.9 pt-20 -60.28 -43.31 96.35 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.097 -179.234 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.514 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.0 m -79.76 -35.86 16.77 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.738 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 99.4 m -71.84 -27.71 63.07 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.983 -176.186 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.18 -23.52 61.28 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.484 173.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.597 HG13 ' O ' ' A' ' 67' ' ' GLU . 43.6 mt -78.21 -32.49 17.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.342 0.592 . . . . 0.0 109.971 177.035 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.486 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 121.0 2.34 11.19 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.21 -0.995 . . . . 0.0 111.757 -176.437 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -97.86 106.61 35.18 Favored Pre-proline 0 N--CA 1.448 -0.53 0 CA-C-O 120.629 0.252 . . . . 0.0 110.824 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.782 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 79.2 Cg_exo -54.61 133.83 58.98 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 123.183 2.589 . . . . 0.0 112.846 177.219 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.683 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -130.49 157.13 43.5 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.234 -0.587 . . . . 0.0 110.937 174.248 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.1 mmtp -128.69 143.09 50.86 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.535 -179.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.827 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 8.4 t -156.27 112.29 3.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.919 0.39 . . . . 0.0 110.392 176.432 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 3.8 p -143.77 173.28 11.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.002 -174.681 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' CYS . . . . . 0.582 ' SG ' ' HD3' ' A' ' 41' ' ' ARG . 57.6 m -108.07 104.09 13.45 Favored 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.514 -175.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.475 ' HG3' ' HB2' ' A' ' 83' ' ' CYS . 0.0 OUTLIER 177.22 161.72 0.46 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 173.557 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.699 ' HB3' HD22 ' A' ' 82' ' ' LEU . 56.7 m-20 -68.22 135.24 51.7 Favored 'General case' 0 CA--C 1.501 -0.915 0 C-N-CA 117.023 -1.871 . . . . 0.0 109.558 -179.651 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.699 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 63.9 22.21 12.92 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.626 175.364 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 83' ' ' CYS . . . . . 0.475 ' HB2' ' HG3' ' A' ' 80' ' ' GLU . 4.3 t -64.5 -27.61 69.09 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.891 0.377 . . . . 0.0 111.049 -174.795 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.653 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 27.7 p-10 . . . . . 0 C--N 1.328 -0.354 0 CA-C-O 122.419 1.104 . . . . 0.0 108.677 172.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.652 HD21 ' H ' ' A' ' 80' ' ' GLU . 21.8 tp . . . . . 0 N--CA 1.452 -0.359 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.615 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 28.8 mtmm -82.67 114.76 21.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.267 0.556 . . . . 0.0 111.403 -175.741 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.7 m -113.27 162.57 15.87 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.794 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.42 ' HE1' ' HB3' ' A' ' 82' ' ' LEU . 34.7 m-85 -79.33 138.87 37.88 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.618 176.581 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 32.2 m -129.0 131.83 47.46 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.3 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.71 HH11 ' HB2' ' A' ' 51' ' ' GLU . 30.8 mtp180 . . . . . 0 C--N 1.329 -0.321 0 C-N-CA 119.923 -0.711 . . . . 0.0 111.749 -176.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 . . . . . 0 N--CA 1.445 -0.684 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.5 m -100.63 145.15 28.75 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.731 -175.006 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 96.8 t -72.46 106.93 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 31.2 p -104.26 137.4 42.23 Favored 'General case' 0 C--N 1.314 -0.955 0 C-N-CA 120.069 -0.652 . . . . 0.0 110.346 175.475 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.615 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.7 t -86.37 111.99 21.03 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 121.634 0.73 . . . . 0.0 109.404 176.14 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -89.28 172.88 8.72 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.089 -173.017 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.89 166.35 20.98 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.291 -0.564 . . . . 0.0 111.147 -175.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -51.98 -26.98 11.8 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.37 176.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.485 ' HG2' ' CG2' ' A' ' 57' ' ' THR . 27.6 tt0 -62.62 -39.68 94.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.012 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.47 ' HG3' ' CB ' ' A' ' 55' ' ' CYS . 16.5 mm-40 -82.04 100.66 9.86 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 118.904 -1.118 . . . . 0.0 109.675 -178.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.422 ' OG1' HG23 ' A' ' 58' ' ' VAL . 0.7 OUTLIER -101.58 21.71 13.9 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.591 0.71 . . . . 0.0 110.04 175.537 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.903 ' HG3' ' HB2' ' A' ' 77' ' ' CYS . 1.2 tpt180 -152.4 177.76 10.26 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.741 -176.524 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.611 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 79.4 m -141.34 131.88 25.41 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 179.537 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.406 HD22 HG23 ' A' ' 45' ' ' VAL . 0.3 OUTLIER -94.93 130.47 41.55 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 -178.881 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.493 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 18.6 t80 -139.54 113.51 8.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.86 170.318 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.645 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 22.0 t -108.72 133.84 52.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 176.634 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.882 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -90.03 132.36 35.42 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 119.397 -0.921 . . . . 0.0 110.455 177.296 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.63 HD21 HG12 ' A' ' 52' ' ' ILE . 3.5 mm? -121.06 152.03 56.12 Favored Pre-proline 0 C--N 1.319 -0.739 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -66.51 -17.25 53.04 Favored 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.46 2.106 . . . . 0.0 112.713 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -134.93 -2.43 2.6 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.526 -177.182 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.604 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 49.1 m -157.97 -168.61 2.56 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.188 -174.77 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.71 ' HB2' HH11 ' A' ' 25' ' ' ARG . 18.4 mt-10 -147.01 148.06 31.31 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 176.1 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.645 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 26.8 mm -109.28 129.18 64.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 175.484 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -140.93 130.27 23.7 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.171 -0.612 . . . . 0.0 110.203 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.11 158.03 24.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.661 -179.328 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.512 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 8.3 m -80.42 118.34 21.96 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 166.589 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.512 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 12.1 mptt -124.25 147.88 47.76 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.605 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.485 ' CG2' ' HG2' ' A' ' 38' ' ' GLU . 18.2 p -68.34 164.3 21.14 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.422 HG23 ' OG1' ' A' ' 40' ' ' THR . 57.8 t -59.1 -43.27 88.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 119.261 -0.976 . . . . 0.0 110.33 177.76 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -64.09 -54.57 31.86 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.748 179.165 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.646 ' O ' HG13 ' A' ' 64' ' ' VAL . 33.6 tt0 -61.58 -32.8 72.91 Favored 'General case' 0 C--O 1.206 -1.219 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.247 -174.37 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.693 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 0.6 OUTLIER -66.12 -33.42 75.74 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.13 -0.628 . . . . 0.0 110.18 178.845 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.91 -41.54 74.55 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.043 0.449 . . . . 0.0 109.943 174.633 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.538 ' OE2' ' HA ' ' A' ' 60' ' ' GLN . 44.9 mt-10 -56.53 -53.34 58.65 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.545 176.503 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.646 HG13 ' O ' ' A' ' 60' ' ' GLN . 15.3 m -73.77 -27.63 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.656 0 CA-C-N 114.659 -1.155 . . . . 0.0 111.693 -176.431 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.693 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 6.7 tp -59.78 -50.5 73.58 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 179.144 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -74.72 -34.99 62.67 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.465 -0.788 . . . . 0.0 112.218 -176.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.632 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.4 pt-20 -58.0 -47.27 83.52 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.529 -177.754 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.602 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 33.4 m -80.54 -34.13 14.2 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.833 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 32.5 m -72.16 -23.89 61.35 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 120.606 -0.438 . . . . 0.0 111.157 -177.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.39 -21.35 62.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.119 0.485 . . . . 0.0 110.099 174.073 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 67' ' ' GLU . 12.2 mt -86.99 -19.2 8.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.542 176.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 111.18 12.57 15.25 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.09 -1.052 . . . . 0.0 112.362 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 52.5 m-85 -98.65 118.66 62.8 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 120.911 0.386 . . . . 0.0 111.289 -178.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.882 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 46.4 Cg_exo -64.23 123.3 11.62 Favored 'Trans proline' 0 CA--C 1.519 -0.232 0 C-N-CA 123.585 2.857 . . . . 0.0 112.569 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -135.59 155.76 49.95 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 120.481 -0.487 . . . . 0.0 111.509 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.541 ' HD3' HE22 ' A' ' 46' ' ' GLN . 0.0 OUTLIER -139.75 152.06 46.31 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.348 0.594 . . . . 0.0 111.278 172.977 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.903 ' HB2' ' HG3' ' A' ' 41' ' ' ARG . 2.6 p -129.73 115.89 17.97 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.695 161.311 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.6 p -106.56 159.01 16.5 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.798 176.331 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' CYS . . . . . 0.436 ' SG ' ' CD ' ' A' ' 41' ' ' ARG . 28.2 m -108.81 101.17 10.3 Favored 'General case' 0 CA--C 1.521 -0.135 0 C-N-CA 120.282 -0.567 . . . . 0.0 109.7 177.17 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.652 ' H ' HD21 ' A' ' 20' ' ' LEU . 9.0 tp10 173.74 144.16 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.669 ' HB3' HD22 ' A' ' 82' ' ' LEU . 58.5 m-20 -60.14 139.73 57.34 Favored 'General case' 0 CA--C 1.511 -0.519 0 C-N-CA 118.937 -1.105 . . . . 0.0 109.614 177.064 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.669 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 66.73 13.88 9.55 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.51 170.9 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 83' ' ' CYS . . . . . 0.499 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . 9.2 p -77.91 -32.33 51.64 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.268 -173.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.555 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 22.1 p-10 . . . . . 0 N--CA 1.465 0.285 0 CA-C-O 120.935 0.397 . . . . 0.0 111.157 -174.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.0 tp . . . . . 0 N--CA 1.453 -0.313 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.476 ' O ' HD13 ' A' ' 82' ' ' LEU . 9.4 mtmp? -113.45 109.12 18.16 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 119.643 -0.823 . . . . 0.0 111.056 175.767 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 19.6 m -112.29 154.67 25.3 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 175.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.571 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 11.6 m-85 -70.48 134.11 47.44 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.825 -0.75 . . . . 0.0 109.93 175.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.5 m -132.07 129.33 39.85 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.218 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.801 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 1.9 mtt-85 . . . . . 0 C--N 1.327 -0.379 0 C-N-CA 119.579 -0.848 . . . . 0.0 109.747 175.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.801 ' HG3' ' HG3' ' A' ' 25' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.493 HG23 HG23 ' A' ' 33' ' ' THR . 12.2 t -127.53 162.75 25.69 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 169.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 48.7 t -74.6 106.26 4.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.289 -0.564 . . . . 0.0 109.836 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.493 HG23 HG23 ' A' ' 31' ' ' THR . 27.1 p -115.69 147.78 40.47 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.152 0.501 . . . . 0.0 111.389 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.4 t -105.37 126.75 52.47 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.4 176.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 5.4 p -91.65 176.63 6.47 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 177.354 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.29 -176.81 6.3 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.154 -0.618 . . . . 0.0 111.793 -172.396 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 -61.66 -32.28 72.44 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -172.573 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.453 ' HG2' HG22 ' A' ' 57' ' ' THR . 10.2 pm0 -77.21 -23.32 51.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.834 0.349 . . . . 0.0 111.176 -176.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.606 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 69.0 mt-30 -92.93 109.06 20.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.141 0.496 . . . . 0.0 110.152 -178.353 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.34 5.16 10.22 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.768 -174.785 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.617 ' HG2' HG22 ' A' ' 58' ' ' VAL . 10.0 mmm180 -130.44 -179.68 5.41 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-O 121.617 0.722 . . . . 0.0 110.032 174.577 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.568 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 40.4 m -126.51 150.33 48.82 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.245 -177.454 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.503 ' HB2' ' CG ' ' A' ' 56' ' ' LYS . 0.2 OUTLIER -109.01 122.34 47.05 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.87 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.613 ' HB2' ' HB2' ' A' ' 84' ' ' ASN . 52.6 t80 -131.93 117.95 19.14 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.015 175.059 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.544 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 42.2 t -116.46 130.02 71.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 177.765 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.781 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 2.6 mm100 -75.63 141.25 42.86 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 119.73 -0.788 . . . . 0.0 109.932 178.442 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.531 HD21 HG12 ' A' ' 52' ' ' ILE . 2.5 mm? -138.86 155.82 72.96 Favored Pre-proline 0 C--N 1.318 -0.785 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 172.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -85.82 11.27 3.38 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.494 2.129 . . . . 0.0 111.37 171.502 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -128.38 -64.56 0.94 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.877 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.451 ' O ' HD23 ' A' ' 47' ' ' LEU . 20.6 t -152.94 132.22 12.79 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 177.006 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.457 ' HA ' HD23 ' A' ' 47' ' ' LEU . 0.9 OUTLIER -77.11 148.63 35.93 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.425 -173.783 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.544 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 38.5 mm -88.65 131.69 35.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.176 177.52 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.585 ' OE1' ' HD3' ' A' ' 30' ' ' ARG . 17.4 mt-30 -144.57 130.39 19.22 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.344 -0.543 . . . . 0.0 110.166 -178.901 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.429 ' HG3' ' HE2' ' A' ' 56' ' ' LYS . 10.7 pt-20 -175.79 170.74 2.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.423 -178.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.453 ' HB3' ' OE1' ' A' ' 39' ' ' GLN . 8.1 t -92.33 148.92 21.75 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 119.665 -0.814 . . . . 0.0 109.699 177.179 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.503 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 56.6 mmtt -142.08 162.41 35.53 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 176.395 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.606 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 29.3 p -72.34 160.32 32.56 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 172.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.617 HG22 ' HG2' ' A' ' 41' ' ' ARG . 22.0 t -59.12 -39.38 78.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 C-N-CA 120.029 -0.669 . . . . 0.0 109.637 -179.396 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.469 ' O ' ' HG3' ' A' ' 63' ' ' GLU . 41.3 tp60 -62.53 -56.12 20.99 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.697 177.832 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.57 ' O ' HG13 ' A' ' 64' ' ' VAL . 34.8 tt0 -69.75 -30.93 68.63 Favored 'General case' 0 C--O 1.203 -1.351 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.633 -173.097 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.492 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.7 p -65.15 -33.21 75.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 179.111 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.29 -45.87 65.46 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 173.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.542 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 75.7 mt-10 -54.91 -52.32 63.28 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.294 178.604 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.64 ' HA ' ' HG2' ' A' ' 67' ' ' GLU . 27.6 m -68.98 -30.42 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.528 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.481 -177.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.5 tp -62.59 -49.61 74.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.46 174.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -74.2 -31.44 62.64 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -176.552 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.64 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.6 pt-20 -63.35 -45.61 90.43 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.38 -177.006 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.56 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 29.3 m -79.34 -31.8 14.55 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 C-N-CA 120.279 -0.568 . . . . 0.0 111.335 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 85.5 m -66.41 -31.37 72.09 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 120.935 0.398 . . . . 0.0 110.484 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.0 -23.95 65.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.612 176.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.416 HG13 ' O ' ' A' ' 67' ' ' GLU . 16.0 mt -86.43 -20.63 7.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.959 178.639 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 114.95 -4.21 22.53 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.094 -1.05 . . . . 0.0 112.362 -178.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -91.91 114.71 62.9 Favored Pre-proline 0 N--CA 1.448 -0.554 0 CA-C-O 120.658 0.266 . . . . 0.0 110.926 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.781 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 51.6 Cg_exo -59.25 128.8 28.81 Favored 'Trans proline' 0 C--O 1.232 0.212 0 C-N-CA 123.177 2.585 . . . . 0.0 113.09 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.489 ' C ' ' HG2' ' A' ' 76' ' ' LYS . . . -126.53 165.56 18.9 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.451 173.783 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.563 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 0.9 OUTLIER -145.71 118.66 8.75 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.118 -178.115 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.568 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 1.4 t -104.31 106.79 17.42 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.248 0.547 . . . . 0.0 110.078 171.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 54.0 t -110.91 160.86 16.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.226 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' CYS . . . . . 0.541 ' HB2' ' HD2' ' A' ' 41' ' ' ARG . 36.3 t -125.84 100.09 6.24 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 175.501 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.587 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 3.5 tm-20 171.53 149.79 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 105.681 -1.97 . . . . 0.0 105.681 -173.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.765 ' HB3' HD22 ' A' ' 82' ' ' LEU . 35.3 m-20 -65.38 135.43 55.26 Favored 'General case' 0 CA--C 1.504 -0.793 0 C-N-CA 117.368 -1.733 . . . . 0.0 110.9 -172.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.765 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 65.82 1.95 2.0 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.839 173.603 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 83' ' ' CYS . . . . . 0.587 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 16.9 t -54.94 -18.71 5.34 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -167.296 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.613 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 27.9 p-10 . . . . . 0 C--N 1.321 -0.661 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.469 175.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 55.5 tp . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 34' ' ' THR . 30.8 mtmm -89.46 139.04 30.92 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.986 -179.392 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.563 ' HA ' HD23 ' A' ' 82' ' ' LEU . 2.7 m -152.9 166.72 31.44 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.591 173.043 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -76.36 121.61 23.26 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.384 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' A' ' 54' ' ' GLU . 67.6 m -115.26 144.0 44.4 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 174.35 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.488 HH12 ' CD ' ' A' ' 51' ' ' GLU . 3.5 tpt180 . . . . . 0 C--N 1.325 -0.475 0 CA-C-O 120.89 0.376 . . . . 0.0 111.12 -174.445 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.599 ' HD2' ' OE1' ' A' ' 53' ' ' GLN . 69.3 mtm180 . . . . . 0 CA--C 1.512 -0.51 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.5 m -108.36 138.49 44.57 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.535 -169.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.695 HG13 HD21 ' A' ' 82' ' ' LEU . 94.3 t -74.52 106.09 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 173.093 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.42 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 42.8 p -113.79 143.14 45.14 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.915 -178.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.424 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.9 t -93.05 111.95 23.75 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 175.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 37.0 m -108.0 155.99 19.73 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.742 -173.285 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.59 ' HB3' ' HG2' ' A' ' 38' ' ' GLU . . . -74.99 172.06 12.98 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -166.536 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -57.94 -27.44 63.39 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.419 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.59 ' HG2' ' HB3' ' A' ' 36' ' ' ALA . 4.8 pt-20 -52.47 -45.03 65.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.365 0.603 . . . . 0.0 110.203 173.558 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.653 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 41.9 mt-30 -102.44 72.78 1.28 Allowed 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.843 -177.242 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.11 9.73 18.94 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.318 -177.657 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.547 ' HB2' ' HA ' ' A' ' 58' ' ' VAL . 2.4 tpt180 -123.8 174.89 7.22 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 173.526 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.725 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 57.9 m -142.08 131.67 23.95 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 120.516 -0.474 . . . . 0.0 109.765 -175.902 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.526 HD22 HG23 ' A' ' 45' ' ' VAL . 0.3 OUTLIER -91.14 131.39 36.73 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.84 -174.985 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.772 ' HD2' ' HG3' ' A' ' 76' ' ' LYS . 77.8 t80 -138.28 121.15 16.52 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.367 169.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.601 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 30.1 t -122.43 141.75 41.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.384 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.735 ' CG ' ' HB2' ' A' ' 74' ' ' PRO . 11.2 mm-40 -81.41 142.51 32.91 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 176.193 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.618 HD21 HG12 ' A' ' 52' ' ' ILE . 4.2 mm? -129.93 153.38 80.96 Favored Pre-proline 0 C--N 1.318 -0.792 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 174.291 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -72.18 18.39 0.32 Allowed 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 123.0 2.467 . . . . 0.0 113.154 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 28.9 p90 -168.87 -22.41 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.906 0.384 . . . . 0.0 110.797 -177.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.538 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 33.8 p -144.59 -157.4 0.78 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.34 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.488 ' CD ' HH12 ' A' ' 25' ' ' ARG . 0.0 OUTLIER -151.53 157.37 42.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.882 0.373 . . . . 0.0 110.945 176.973 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.618 HG12 HD21 ' A' ' 47' ' ' LEU . 29.1 mm -105.26 134.16 47.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.658 177.764 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.599 ' OE1' ' HD2' ' A' ' 30' ' ' ARG . 36.7 mt-30 -140.95 131.71 25.77 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.866 174.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.549 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 8.0 pt-20 -169.36 160.92 9.68 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.325 0.391 . . . . 0.0 110.842 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 80.6 m -80.36 145.41 32.06 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 169.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.414 ' HE3' HD12 ' A' ' 43' ' ' LEU . 4.6 tppt? -152.16 148.65 27.87 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.397 -0.521 . . . . 0.0 109.778 178.899 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.653 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 31.7 p -67.46 142.71 56.55 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.179 -0.608 . . . . 0.0 109.518 178.217 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.547 ' HA ' ' HB2' ' A' ' 41' ' ' ARG . 42.3 t -52.59 -46.34 48.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 120.694 0.283 . . . . 0.0 111.132 -175.139 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 38.5 tp60 -58.48 -56.96 15.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.269 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.793 ' O ' HG13 ' A' ' 64' ' ' VAL . 53.4 mt-30 -71.05 -32.59 69.35 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.849 -174.115 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.655 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.9 t -66.33 -32.97 74.69 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.228 -178.347 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.07 -42.76 84.16 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.173 0.511 . . . . 0.0 110.177 172.771 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -57.68 -52.57 64.9 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.978 0.894 . . . . 0.0 111.042 176.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.793 HG13 ' O ' ' A' ' 60' ' ' GLN . 4.3 m -68.23 -26.45 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.862 0 CA-C-N 114.721 -1.127 . . . . 0.0 110.818 -179.434 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.739 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -55.18 -49.96 70.56 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 174.914 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -73.37 -35.41 65.93 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 119.721 -0.792 . . . . 0.0 112.134 -174.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.651 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.9 pt-20 -59.74 -42.89 94.19 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.042 -0.663 . . . . 0.0 110.447 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.509 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 28.5 m -78.13 -36.74 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.864 0.364 . . . . 0.0 111.212 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 97.6 m -71.08 -20.26 62.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.136 0.493 . . . . 0.0 110.798 -177.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -79.66 -25.12 41.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.388 175.283 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.569 HG13 ' O ' ' A' ' 67' ' ' GLU . 17.6 mt -79.55 -29.77 13.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.392 0.615 . . . . 0.0 109.648 177.103 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.451 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 120.03 13.53 5.93 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.396 -0.907 . . . . 0.0 111.897 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.469 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 55.7 m-85 -104.48 102.47 33.94 Favored Pre-proline 0 N--CA 1.448 -0.528 0 CA-C-O 120.622 0.248 . . . . 0.0 110.89 179.459 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.735 ' HB2' ' CG ' ' A' ' 46' ' ' GLN . 81.7 Cg_exo -54.4 124.72 16.78 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.3 2.667 . . . . 0.0 112.767 176.221 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.739 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -128.05 154.24 45.89 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.279 -0.568 . . . . 0.0 111.165 176.616 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.772 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 1.5 mttt -138.72 112.44 8.35 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.106 179.099 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.725 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 59.3 m -102.09 102.22 12.67 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 119.834 -0.746 . . . . 0.0 109.797 173.889 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 40.6 t -107.61 160.0 16.02 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.365 -178.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' CYS . . . . . 0.502 ' HB2' ' HD2' ' A' ' 41' ' ' ARG . 49.0 t -122.72 100.47 6.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.304 0.573 . . . . 0.0 109.996 178.433 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.643 ' HG2' ' H ' ' A' ' 81' ' ' ASP . 2.7 tt0 -173.98 166.5 4.31 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 105.892 -1.892 . . . . 0.0 105.892 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.643 ' H ' ' HG2' ' A' ' 80' ' ' GLU . 9.4 t70 -69.29 109.12 3.97 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.155 -174.823 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.695 HD21 HG13 ' A' ' 32' ' ' VAL . 30.5 mt 69.27 31.35 3.95 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.983 -177.493 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' CYS . . . . . 0.618 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 3.3 t -70.82 -6.76 40.34 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -173.1 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.444 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 29.7 p-10 . . . . . 0 C--N 1.325 -0.465 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.135 177.769 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.3 tp . . . . . 0 N--CA 1.455 -0.22 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.564 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 31.4 mtmm -106.47 108.25 19.67 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.14 0.495 . . . . 0.0 111.415 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 12.4 m -111.33 153.29 26.2 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.692 ' HB3' ' HB2' ' A' ' 30' ' ' ARG . 63.2 m-85 -70.66 137.31 49.76 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.212 176.859 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.7 p -116.37 144.51 44.19 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.346 175.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.438 HH12 ' NH2' ' A' ' 30' ' ' ARG . 10.8 tpt180 . . . . . 0 C--N 1.324 -0.504 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.692 ' HB2' ' HB3' ' A' ' 23' ' ' PHE . 1.0 OUTLIER . . . . . 0 N--CA 1.453 -0.311 0 CA-C-O 121.436 0.636 . . . . 0.0 112.41 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 27.2 m -108.04 132.01 53.99 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.007 174.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 95.5 t -73.14 107.79 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 176.008 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 19.4 p -123.74 134.7 53.63 Favored 'General case' 0 C--N 1.317 -0.848 0 C-N-CA 120.103 -0.639 . . . . 0.0 111.582 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.564 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.5 t -79.65 113.49 17.85 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 170.368 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.3 m -87.88 166.07 14.81 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.373 -170.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.461 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -61.81 157.5 17.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.051 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -81.28 -12.28 59.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -164.456 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.481 ' HG2' HG22 ' A' ' 57' ' ' THR . 0.0 OUTLIER -78.83 -27.53 44.31 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.511 0.672 . . . . 0.0 109.522 175.566 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.632 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 76.0 mt-30 -88.06 88.06 7.52 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.43 177.748 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 p -97.15 5.11 50.77 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.253 -175.255 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.816 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 17.7 mmt85 -117.51 178.89 4.22 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 119.376 -0.929 . . . . 0.0 110.036 172.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.561 ' HB3' ' HB3' ' A' ' 84' ' ' ASN . 86.0 m -135.61 131.12 35.43 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.649 -1.16 . . . . 0.0 109.407 -174.094 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.5 ' HB2' ' CG ' ' A' ' 56' ' ' LYS . 1.6 tm? -100.23 128.21 46.35 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.667 -173.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.587 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 52.3 t80 -142.17 114.85 8.54 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.768 174.022 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.563 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 41.4 t -101.61 128.88 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 175.024 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.731 ' HB3' ' HB2' ' A' ' 74' ' ' PRO . 2.1 tp60 -90.04 114.22 26.06 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.27 -178.576 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.553 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.5 mm? -109.69 153.33 43.02 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.039 179.494 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -80.15 27.18 0.55 Allowed 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 122.737 2.291 . . . . 0.0 112.724 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.426 ' HD2' ' HG ' ' A' ' 50' ' ' SER . 39.0 p90 -170.63 -23.38 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.829 -177.537 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.553 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 45.2 m -148.09 -160.95 1.24 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.432 ' HA ' HD23 ' A' ' 47' ' ' LEU . 16.3 pt-20 -158.01 150.47 22.37 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.816 179.538 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.587 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 37.8 mt -112.38 137.97 43.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 177.676 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.48 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 45.3 mt-30 -144.5 128.95 17.97 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -178.403 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -150.84 174.98 12.45 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 -179.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 3.6 m -107.72 127.2 53.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 167.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.521 ' HB2' ' SG ' ' A' ' 61' ' ' CYS . 71.9 mmtt -133.5 148.38 51.68 Favored 'General case' 0 C--N 1.314 -0.954 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.599 -174.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.632 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 43.9 p -66.18 154.72 39.01 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 172.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.628 HG22 ' HG2' ' A' ' 41' ' ' ARG . 21.7 t -50.1 -45.66 23.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.453 -176.545 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -66.01 -56.53 11.15 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.648 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.676 ' O ' HG13 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -58.45 -33.42 69.71 Favored 'General case' 0 C--O 1.211 -0.937 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -176.239 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.672 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.7 t -72.68 -33.5 66.57 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.623 -179.264 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.45 -36.85 71.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.238 0.542 . . . . 0.0 109.684 173.424 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.579 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 92.5 mt-10 -59.5 -52.36 65.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.547 175.564 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.676 HG13 ' O ' ' A' ' 60' ' ' GLN . 19.8 m -71.77 -27.67 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.659 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.523 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.491 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 0.2 OUTLIER -60.52 -49.44 77.55 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 175.382 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -73.88 -32.32 63.54 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.834 -174.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.634 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.2 pt-20 -61.13 -41.86 97.48 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.744 -0.783 . . . . 0.0 109.895 -179.241 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.469 HG22 ' O ' ' A' ' 64' ' ' VAL . 28.6 m -81.07 -37.57 16.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 178.392 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.418 ' HG1' HD13 ' A' ' 65' ' ' LEU . 97.8 m -78.15 -25.73 47.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.532 -172.063 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.38 -19.74 63.83 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.426 173.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 67' ' ' GLU . 9.5 mt -80.56 -22.17 11.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.745 177.221 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 112.27 2.08 26.37 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 119.884 -1.15 . . . . 0.0 112.17 -177.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -88.69 126.55 59.39 Favored Pre-proline 0 N--CA 1.448 -0.553 0 O-C-N 122.819 -0.224 . . . . 0.0 110.909 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.731 ' HB2' ' HB3' ' A' ' 46' ' ' GLN . 78.8 Cg_exo -56.64 131.27 44.61 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 123.319 2.68 . . . . 0.0 112.723 176.861 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.418 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -146.93 155.13 42.04 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 119.154 -1.018 . . . . 0.0 111.641 174.163 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.43 ' HD3' ' CD2' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -141.26 151.54 43.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.772 176.012 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.816 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 37.4 t -145.76 92.76 2.25 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.92 173.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 3.9 p -107.13 166.13 10.85 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.956 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' CYS . . . . . 0.547 ' HB2' ' HD3' ' A' ' 41' ' ' ARG . 47.3 t -109.46 105.01 14.18 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.533 -173.402 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 172.13 151.82 0.07 Allowed 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.694 ' HB3' HD22 ' A' ' 82' ' ' LEU . 62.0 m-20 -57.79 138.97 55.07 Favored 'General case' 0 CA--C 1.512 -0.492 0 C-N-CA 119.429 -0.908 . . . . 0.0 109.764 176.306 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.694 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 63.85 17.18 10.35 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.065 172.2 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 4.8 t -78.53 -6.7 56.19 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.058 0.456 . . . . 0.0 111.21 -174.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.561 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 29.5 p-10 . . . . . 0 C--N 1.319 -0.751 0 CA-C-O 121.401 0.62 . . . . 0.0 110.36 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.8 tp . . . . . 0 N--CA 1.462 0.146 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.536 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 28.8 mtmm -110.37 106.13 15.37 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.807 -173.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.458 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 17.2 m -106.23 156.01 18.9 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 175.667 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.618 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 16.2 m-85 -67.58 115.32 7.04 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.72 175.471 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.9 m -96.09 133.45 40.33 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.076 -0.712 . . . . 0.0 109.076 171.656 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.404 ' HD2' HH11 ' A' ' 25' ' ' ARG . 22.9 ttt180 . . . . . 0 C--N 1.323 -0.583 0 CA-C-O 120.991 0.424 . . . . 0.0 111.627 -175.507 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.445 -0.694 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -106.8 143.97 34.13 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.329 -0.549 . . . . 0.0 111.464 -169.08 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.52 HG13 HD11 ' A' ' 82' ' ' LEU . 85.1 t -75.32 106.49 5.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.834 174.431 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.415 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 32.6 p -122.08 139.22 53.98 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.324 -0.55 . . . . 0.0 110.845 178.827 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.536 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.8 t -89.12 112.24 23.18 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.18 177.864 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' CYS . . . . . 0.511 ' HB3' ' OE1' ' A' ' 39' ' ' GLN . 44.9 m -101.45 161.71 13.43 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.833 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.67 158.16 28.11 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.251 -175.136 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -66.9 -17.45 64.91 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.297 0.57 . . . . 0.0 110.768 177.576 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.565 ' HG2' HG22 ' A' ' 57' ' ' THR . 10.7 tt0 -45.18 -48.01 12.43 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.574 -1.194 . . . . 0.0 108.884 163.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.6 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 41.3 mt-30 -98.06 73.17 2.22 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 114.423 -1.262 . . . . 0.0 109.686 -176.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.16 18.56 3.05 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.518 -177.044 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.649 HH21 HG13 ' A' ' 58' ' ' VAL . 1.6 tpp85 -136.38 168.8 18.76 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.621 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.709 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 21.7 m -129.92 137.51 50.41 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -178.571 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.603 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.0 OUTLIER -98.83 123.36 43.03 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.529 0.204 . . . . 0.0 110.507 -176.501 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.655 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 50.7 t80 -131.24 105.27 7.55 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.062 171.225 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.583 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 42.1 t -98.0 138.12 23.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 120.391 -0.524 . . . . 0.0 109.818 177.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.749 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 2.1 mm100 -79.75 139.15 37.39 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 119.666 -0.813 . . . . 0.0 109.303 175.389 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.727 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.9 mm? -134.14 149.06 70.42 Favored Pre-proline 0 C--N 1.314 -0.942 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.631 178.119 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 5.1 Cg_exo -79.9 13.23 2.2 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.93 2.42 . . . . 0.0 112.134 174.631 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -138.63 -43.75 0.49 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.079 0.466 . . . . 0.0 110.71 -176.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.727 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 38.8 m -147.72 -156.71 0.74 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -178.786 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -139.56 135.88 33.85 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.954 -0.698 . . . . 0.0 110.279 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.655 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 73.7 mt -89.92 126.62 42.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.546 177.602 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.603 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 78.4 mt-30 -139.74 130.77 26.34 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 175.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -172.52 163.97 5.5 Favored 'General case' 0 C--N 1.33 -0.279 0 O-C-N 123.473 0.483 . . . . 0.0 110.509 -177.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.458 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 73.5 m -87.91 135.85 33.22 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.052 0.453 . . . . 0.0 111.109 -179.418 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.549 ' HE3' HD12 ' A' ' 43' ' ' LEU . 68.2 mmtt -138.23 157.28 46.59 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.158 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.6 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 5.3 p -70.96 152.18 43.88 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 118.969 -1.092 . . . . 0.0 108.061 173.122 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.649 HG13 HH21 ' A' ' 41' ' ' ARG . 55.4 t -48.67 -51.92 10.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 120.648 0.261 . . . . 0.0 110.745 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.558 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 17.6 tt0 -63.26 -55.69 22.75 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.19 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.772 ' O ' HG13 ' A' ' 64' ' ' VAL . 29.3 tt0 -58.24 -37.31 74.65 Favored 'General case' 0 C--O 1.209 -1.052 0 CA-C-N 116.541 -0.299 . . . . 0.0 110.961 -174.665 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.707 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.7 t -70.94 -32.97 70.03 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.38 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.91 -39.35 87.36 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.93 172.012 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 20.1 mm-40 -58.68 -52.66 64.73 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.492 176.579 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.772 HG13 ' O ' ' A' ' 60' ' ' GLN . 7.4 m -69.77 -26.43 30.47 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.705 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.107 -178.63 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.67 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -57.11 -50.47 72.7 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 175.698 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -73.82 -34.68 64.67 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 120.215 -0.594 . . . . 0.0 111.98 -174.615 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.629 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.1 pt-20 -59.43 -42.74 92.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.17 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.507 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 34.4 m -79.68 -38.51 19.35 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.13 0 CA-C-O 120.738 0.304 . . . . 0.0 111.663 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.8 m -74.03 -19.92 60.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.83 0.347 . . . . 0.0 111.341 -175.219 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.23 -23.47 59.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.999 0.428 . . . . 0.0 110.181 173.68 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 67' ' ' GLU . 6.1 mt -83.83 -21.86 8.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.355 0.598 . . . . 0.0 109.623 177.295 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.453 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 115.43 9.33 13.09 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.13 -1.033 . . . . 0.0 112.224 -178.136 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -101.51 107.11 49.79 Favored Pre-proline 0 N--CA 1.45 -0.43 0 CA-C-O 120.739 0.304 . . . . 0.0 110.966 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.749 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 52.2 Cg_exo -60.54 137.45 73.88 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 123.116 2.544 . . . . 0.0 112.682 175.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.67 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -138.3 160.13 40.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.715 0.293 . . . . 0.0 110.327 174.679 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.3 mmtp -136.25 114.86 11.92 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.032 -178.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.709 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 39.0 m -114.13 98.48 6.98 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.946 173.553 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 7.9 p -111.13 167.69 10.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.692 -0.231 . . . . 0.0 110.727 -178.693 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 37.7 m -109.63 106.04 15.56 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.839 -176.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.47 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 23.2 tt0 178.1 153.71 0.32 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.733 ' HB3' HD22 ' A' ' 82' ' ' LEU . 49.7 m-20 -65.27 139.32 58.6 Favored 'General case' 0 CA--C 1.507 -0.708 0 C-N-CA 117.919 -1.512 . . . . 0.0 108.738 172.806 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.733 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 61.37 23.72 13.93 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.084 174.556 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 83' ' ' CYS . . . . . 0.47 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 5.7 t -69.98 -34.26 73.13 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.619 -171.607 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.581 ' OD1' ' HB3' ' A' ' 42' ' ' CYS . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.35 0 C-N-CA 118.756 -1.177 . . . . 0.0 109.402 174.623 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 27.2 tp . . . . . 0 C--O 1.233 0.199 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.667 ' HG2' ' HB ' ' A' ' 34' ' ' THR . 27.6 mtmm -114.61 114.9 26.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.244 0.545 . . . . 0.0 112.072 -174.318 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 17.2 m -129.41 168.58 16.1 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.044 175.498 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -75.27 132.27 40.93 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.259 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 61.8 m -129.55 135.29 48.41 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 175.837 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 51.5 ttt180 . . . . . 0 C--N 1.324 -0.508 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.909 -176.833 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.682 ' HD2' ' OE1' ' A' ' 53' ' ' GLN . 77.6 mtm180 . . . . . 0 N--CA 1.452 -0.34 0 CA-C-O 120.78 0.324 . . . . 0.0 110.65 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.8 t -120.09 176.11 5.6 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.852 -178.057 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 76.9 t -90.08 116.75 32.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.498 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.489 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 64.4 p -106.76 143.37 34.96 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.69 175.582 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.667 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 1.5 t -98.43 112.32 24.38 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.479 175.788 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 57.9 m -110.54 164.97 12.18 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.241 -172.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.2 -175.98 4.41 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -170.148 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -67.05 -32.6 73.91 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.44 -0.8 . . . . 0.0 113.009 -167.624 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.622 ' CD ' ' H ' ' A' ' 38' ' ' GLU . 1.1 mp0 -55.11 -44.16 74.73 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 122.159 0.98 . . . . 0.0 108.619 177.554 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.721 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 2.2 mm-40 -90.98 49.19 1.61 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 113.694 -1.594 . . . . 0.0 110.411 -172.544 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.74 3.65 11.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.204 0.526 . . . . 0.0 110.906 178.648 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.621 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 19.4 mmt85 -120.07 -179.44 3.93 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.704 0.764 . . . . 0.0 109.367 169.078 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.596 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 35.9 m -144.41 156.1 44.06 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.344 -172.681 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -114.77 135.62 53.98 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 120.922 0.392 . . . . 0.0 110.247 -177.799 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.572 ' HB3' ' HG3' ' A' ' 76' ' ' LYS . 70.3 t80 -141.73 119.97 12.22 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.36 -0.836 . . . . 0.0 108.984 170.46 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.624 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 25.3 t -119.43 140.58 42.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.426 -178.17 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.661 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 11.4 mm-40 -84.48 133.33 34.48 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.122 0.487 . . . . 0.0 110.694 176.302 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.687 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.5 mm? -130.24 146.05 59.95 Favored Pre-proline 0 C--N 1.318 -0.799 0 CA-C-N 115.471 -0.786 . . . . 0.0 108.894 176.809 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -76.15 15.08 1.01 Allowed 'Trans proline' 0 CA--C 1.528 0.212 0 C-N-CA 122.797 2.331 . . . . 0.0 112.193 177.221 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -143.45 -39.42 0.31 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.633 -176.365 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.687 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 49.0 m -149.11 -156.83 0.76 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.416 ' CD ' HH12 ' A' ' 30' ' ' ARG . 22.3 mt-10 -138.65 149.56 45.31 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 177.454 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.686 HG12 HD21 ' A' ' 47' ' ' LEU . 27.9 mm -104.74 129.27 57.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.193 174.283 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.682 ' OE1' ' HD2' ' A' ' 30' ' ' ARG . 50.9 mt-30 -142.86 131.85 22.99 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.58 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -168.2 160.26 11.51 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 123.556 0.535 . . . . 0.0 111.107 -178.295 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 64.7 m -78.32 132.63 37.52 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 170.588 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 56' ' ' LYS . 8.7 tppt? -137.95 135.33 35.94 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 -178.553 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.721 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 6.1 p -59.09 156.45 11.96 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 119.509 -0.876 . . . . 0.0 109.827 -178.307 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.617 HG22 ' HG2' ' A' ' 41' ' ' ARG . 37.3 t -54.81 -46.63 75.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.091 0.472 . . . . 0.0 111.296 -175.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.64 ' HG3' ' N ' ' A' ' 60' ' ' GLN . 8.5 pt20 -65.82 -45.36 82.61 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.881 -179.543 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.64 ' N ' ' HG3' ' A' ' 59' ' ' GLN . 70.9 mt-30 -72.87 -26.71 61.55 Favored 'General case' 0 C--O 1.2 -1.528 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.884 -175.404 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.565 ' HA ' HG22 ' A' ' 64' ' ' VAL . 9.1 p -69.43 -33.05 72.39 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.048 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.45 -40.75 73.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 0.0 109.997 172.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.21 -52.01 66.61 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.174 178.604 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.63 ' HA ' ' HG2' ' A' ' 67' ' ' GLU . 30.6 m -67.77 -29.39 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.375 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.637 -178.707 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.523 HD12 ' HB3' ' A' ' 75' ' ' ALA . 18.4 tp -57.81 -50.79 72.08 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.804 176.554 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -75.25 -32.38 61.07 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -176.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.63 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -61.1 -46.91 88.7 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.615 -175.732 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.585 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.6 m -79.76 -31.32 13.72 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 C-N-CA 120.74 -0.384 . . . . 0.0 111.299 -179.577 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 96.3 m -68.41 -29.06 67.65 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.559 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.76 -22.78 63.32 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.541 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 67' ' ' GLU . 20.1 mt -85.1 -20.61 8.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.337 0.589 . . . . 0.0 109.729 177.654 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 111.2 11.97 16.77 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.187 -1.006 . . . . 0.0 112.453 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -106.47 113.39 63.19 Favored Pre-proline 0 N--CA 1.448 -0.559 0 CA-C-O 120.612 0.244 . . . . 0.0 111.212 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.661 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 90.6 Cg_exo -52.36 129.78 33.09 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 123.577 2.851 . . . . 0.0 113.088 177.41 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.523 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -132.4 161.21 34.2 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.236 -0.585 . . . . 0.0 111.0 174.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.572 ' HG3' ' HB3' ' A' ' 44' ' ' PHE . 14.9 ptmt -145.2 124.33 12.88 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.017 0.437 . . . . 0.0 111.409 175.025 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.621 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 0.6 OUTLIER -100.44 96.66 7.56 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.602 -0.727 . . . . 0.0 109.122 168.714 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 42.7 t -106.81 152.45 23.85 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.579 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' CYS . . . . . 0.465 ' HB2' ' CD ' ' A' ' 41' ' ' ARG . 41.9 t -115.22 100.28 8.02 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.334 -178.959 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.506 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 42.8 tt0 169.68 155.1 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.687 ' HB3' HD22 ' A' ' 82' ' ' LEU . 69.5 m-20 -63.31 135.2 56.88 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 119.038 -1.065 . . . . 0.0 110.001 177.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.687 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 66.72 6.8 4.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.032 170.843 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 83' ' ' CYS . . . . . 0.506 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 42.6 t -75.88 -13.15 60.26 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 120.336 -0.545 . . . . 0.0 111.387 -175.182 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.421 ' HB3' ' HB2' ' A' ' 42' ' ' CYS . 19.3 p-10 . . . . . 0 C--N 1.327 -0.372 0 C-N-CA 120.111 -0.635 . . . . 0.0 110.599 178.672 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 26.1 tp . . . . . 0 N--CA 1.456 -0.175 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.548 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 33.1 mtmm -108.58 106.88 17.16 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 119.63 -0.828 . . . . 0.0 111.632 -179.577 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.581 ' HA ' HD21 ' A' ' 84' ' ' ASN . 8.1 m -110.05 166.26 11.08 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.016 177.043 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -80.75 132.35 35.52 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 119.929 -0.708 . . . . 0.0 110.415 178.474 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.1 p -101.97 130.9 48.61 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 171.021 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.2 tpt85 . . . . . 0 C--N 1.322 -0.625 0 C-N-CA 120.446 -0.502 . . . . 0.0 109.741 -176.412 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.477 HH11 ' HD3' ' A' ' 30' ' ' ARG . 1.1 ptt-85 . . . . . 0 N--CA 1.451 -0.417 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.9 m -97.14 133.48 41.73 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.615 -168.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 95.5 t -72.72 106.84 3.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 173.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 12.1 p -122.3 138.36 54.53 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.557 -0.457 . . . . 0.0 111.513 -177.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.548 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.9 t -77.66 115.92 17.79 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 173.571 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.2 m -89.17 178.21 6.42 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.709 -170.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.5 161.04 30.31 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.072 0.463 . . . . 0.0 112.181 -174.29 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -56.45 -33.32 65.79 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.791 -177.629 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -74.25 -29.57 61.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.133 0.492 . . . . 0.0 111.093 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.521 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 22.7 mt-30 -83.96 90.4 7.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.457 0.646 . . . . 0.0 110.114 -172.409 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.496 ' OG1' HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -102.48 14.5 31.8 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.52 -176.658 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.635 ' HD3' HG22 ' A' ' 58' ' ' VAL . 1.6 tpt180 -135.11 172.44 13.0 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 121.168 0.509 . . . . 0.0 109.724 175.61 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.599 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 70.1 m -131.0 131.64 44.49 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.511 -0.768 . . . . 0.0 108.943 179.189 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.525 ' HB3' ' HG2' ' A' ' 54' ' ' GLU . 0.7 OUTLIER -96.33 123.71 40.07 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.059 -177.151 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.529 ' HD2' ' HG3' ' A' ' 76' ' ' LYS . 71.9 t80 -131.64 109.37 10.16 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.853 170.585 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.651 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 39.9 t -99.42 134.22 39.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 172.044 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 1.049 ' HB3' ' HB2' ' A' ' 74' ' ' PRO . 28.4 tp60 -93.4 114.78 27.28 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.856 -175.736 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.6 mm? -107.8 156.71 37.59 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.909 -179.029 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_exo -70.9 14.93 0.32 Allowed 'Trans proline' 0 CA--C 1.535 0.562 0 C-N-CA 123.23 2.62 . . . . 0.0 114.019 -176.316 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -171.02 -30.94 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.879 -178.564 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.543 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 23.8 p -124.31 -168.4 1.79 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.828 179.015 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -150.48 149.73 30.37 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 119.584 -0.846 . . . . 0.0 111.285 178.118 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.651 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 25.9 mm -98.78 129.49 49.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.777 175.255 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.423 ' OE1' ' HD3' ' A' ' 30' ' ' ARG . 48.5 mt-30 -140.31 130.25 24.69 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 119.811 -0.756 . . . . 0.0 110.565 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.525 ' HG2' ' HB3' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -163.4 163.86 24.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.733 -179.189 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.571 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.3 m -94.86 126.43 40.18 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 168.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.571 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 14.0 mptt -128.05 170.86 12.43 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 119.926 -0.71 . . . . 0.0 109.144 175.049 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 30.9 p -80.68 159.63 25.23 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 118.471 -1.292 . . . . 0.0 107.96 174.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.635 HG22 ' HD3' ' A' ' 41' ' ' ARG . 83.4 t -55.3 -43.75 72.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.53 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -66.54 -56.74 9.41 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.053 -178.79 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.697 ' O ' HG13 ' A' ' 64' ' ' VAL . 74.5 mt-30 -56.44 -44.38 80.38 Favored 'General case' 0 C--O 1.207 -1.178 0 O-C-N 123.456 0.473 . . . . 0.0 110.21 -177.309 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.732 ' HA ' HG22 ' A' ' 64' ' ' VAL . 0.5 OUTLIER -66.35 -31.6 72.48 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.852 -178.108 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.78 -41.18 75.45 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.189 -0.604 . . . . 0.0 110.141 173.52 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.489 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 45.3 mt-10 -56.32 -53.33 58.53 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.981 0.896 . . . . 0.0 110.655 175.615 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.732 HG22 ' HA ' ' A' ' 61' ' ' CYS . 5.7 m -72.73 -26.36 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.735 0 CA-C-N 114.532 -1.213 . . . . 0.0 111.081 -178.251 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.585 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 19.8 tp -56.85 -47.71 79.74 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 176.267 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.544 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 38.7 tt0 -73.98 -37.63 64.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.462 -176.511 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.633 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -58.3 -43.74 88.24 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.611 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.53 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 29.9 m -79.66 -31.75 14.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 120.599 -0.44 . . . . 0.0 112.06 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.544 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 21.0 p -73.87 -26.27 60.47 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.105 -178.602 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.87 -20.21 63.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.183 0.515 . . . . 0.0 110.493 176.098 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 67' ' ' GLU . 22.6 mt -82.07 -19.6 10.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.605 176.678 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 108.65 1.84 32.56 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.18 -1.01 . . . . 0.0 112.398 179.479 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 49.5 m-85 -87.43 134.53 35.97 Favored Pre-proline 0 N--CA 1.45 -0.469 0 CA-C-O 120.787 0.327 . . . . 0.0 111.385 -178.545 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 1.049 ' HB2' ' HB3' ' A' ' 46' ' ' GLN . 54.4 Cg_exo -59.55 130.82 37.16 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 123.394 2.729 . . . . 0.0 111.897 175.163 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -147.03 151.23 36.59 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.2 -0.6 . . . . 0.0 111.508 178.411 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.529 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 1.1 ptmt -151.01 119.57 6.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.549 179.312 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.599 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 65.7 m -113.57 97.97 6.77 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.358 -0.537 . . . . 0.0 109.893 168.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 3.5 p -108.46 157.42 18.45 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.069 177.79 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' CYS . . . . . 0.453 ' HB2' ' HD2' ' A' ' 41' ' ' ARG . 14.5 t -108.42 100.95 10.17 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.354 -175.047 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 79' ' ' CYS . 3.0 mm-40 178.9 151.01 0.3 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.653 ' HB3' HD22 ' A' ' 82' ' ' LEU . 70.0 m-20 -63.02 135.9 57.52 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 118.819 -1.152 . . . . 0.0 109.772 178.722 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.653 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 65.51 10.08 6.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.583 171.636 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 42.7 t -69.65 -20.69 63.58 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.726 0.774 . . . . 0.0 110.313 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.581 HD21 ' HA ' ' A' ' 22' ' ' CYS . 6.0 p30 . . . . . 0 C--N 1.324 -0.504 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.366 178.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.7 tp . . . . . 0 C--O 1.232 0.182 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.518 ' HB3' HG12 ' A' ' 32' ' ' VAL . 23.0 mtpp -115.33 101.17 8.68 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 119.219 -0.992 . . . . 0.0 111.867 178.63 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.402 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 8.4 m -100.71 158.38 15.99 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 173.337 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -76.37 142.21 41.24 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.35 -0.54 . . . . 0.0 109.779 174.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 88.9 m -133.64 129.57 37.06 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 173.055 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 . . . . . 0 C--N 1.324 -0.54 0 C-N-CA 119.576 -0.85 . . . . 0.0 112.223 -173.698 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.5 mtt-85 . . . . . 0 N--CA 1.452 -0.33 0 CA-C-O 121.22 0.533 . . . . 0.0 111.073 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 m -115.29 139.24 50.14 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.065 -178.528 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.518 HG12 ' HB3' ' A' ' 21' ' ' LYS . 6.3 t -88.6 104.59 14.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 C-N-CA 119.789 -0.764 . . . . 0.0 109.846 177.526 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.2 p -87.61 150.24 23.79 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.858 -173.664 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 t -90.15 112.25 23.68 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 171.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.1 140.87 35.8 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.894 0.378 . . . . 0.0 110.499 -173.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.44 172.23 10.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.258 -171.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -56.19 -38.53 71.08 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.107 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.445 ' HG3' ' H ' ' A' ' 39' ' ' GLN . 3.2 pt-20 -52.07 -46.13 65.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.793 175.737 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.656 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 38.2 mt-30 -103.07 72.54 1.18 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.237 -177.158 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.09 15.57 11.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.302 -179.287 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.696 ' HG2' ' SG ' ' A' ' 61' ' ' CYS . 1.7 tpt180 -119.68 171.13 8.6 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.299 -0.56 . . . . 0.0 109.494 173.923 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.73 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.3 m -130.42 131.0 45.02 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.504 -179.636 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.541 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.7 OUTLIER -94.95 130.73 41.47 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.835 0.35 . . . . 0.0 110.507 -176.596 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.623 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 54.4 t80 -143.69 119.23 10.36 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.468 174.221 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.404 HG23 ' CD2' ' A' ' 43' ' ' LEU . 57.5 t -122.49 138.8 51.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.848 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 7.1 mm100 -75.58 142.0 42.8 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.663 178.421 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.639 HD21 HG13 ' A' ' 52' ' ' ILE . 3.4 mm? -130.55 158.57 74.22 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 169.738 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -76.27 13.82 1.26 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.761 2.308 . . . . 0.0 112.39 176.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -140.43 -54.48 0.51 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.467 0.651 . . . . 0.0 109.69 -179.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.608 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 6.7 p -137.83 -151.5 0.39 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.675 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.549 ' HA ' HD23 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -147.14 161.01 41.74 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.297 176.347 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.639 HG13 HD21 ' A' ' 47' ' ' LEU . 67.3 mt -92.92 133.96 32.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.524 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -135.1 130.51 35.62 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 120.345 -0.542 . . . . 0.0 109.544 176.274 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -169.99 162.24 9.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.06 177.576 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.402 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 4.4 m -86.81 140.8 29.33 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 170.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.541 ' HE3' HD12 ' A' ' 43' ' ' LEU . 5.0 tppt? -143.72 153.3 42.3 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.136 -0.626 . . . . 0.0 109.647 -178.139 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.656 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 29.3 p -69.45 142.82 53.72 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 176.748 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.684 HG22 ' HD3' ' A' ' 41' ' ' ARG . 39.9 t -54.96 -35.97 36.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-O 121.079 0.466 . . . . 0.0 110.794 -176.348 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.458 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 13.2 tt0 -69.1 -56.55 7.37 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.548 179.463 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.623 ' O ' HG13 ' A' ' 64' ' ' VAL . 20.4 mm-40 -67.55 -29.32 68.67 Favored 'General case' 0 C--O 1.209 -1.053 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.615 -175.543 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.696 ' SG ' ' HG2' ' A' ' 41' ' ' ARG . 2.5 p -67.25 -32.93 74.29 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.148 178.499 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.13 -44.79 75.32 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 173.592 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 49.6 mm-40 -53.74 -53.14 56.44 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.769 177.264 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.641 HG22 ' HA ' ' A' ' 61' ' ' CYS . 16.1 m -73.31 -26.84 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.626 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.315 -177.3 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.643 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 4.3 tp -62.67 -50.9 69.34 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.467 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.609 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 49.1 mt-10 -76.05 -29.61 58.09 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -176.173 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.625 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.3 pt-20 -61.94 -45.17 94.87 Favored 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.095 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.569 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 34.4 m -80.29 -31.06 12.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.493 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.609 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 15.7 p -71.15 -28.35 64.2 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.857 -179.51 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.76 -21.26 63.45 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.453 175.256 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 67' ' ' GLU . 28.4 mt -84.71 -26.37 6.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.794 176.335 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.428 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 121.33 -1.91 11.42 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.111 -1.042 . . . . 0.0 112.507 -179.368 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -88.19 112.77 51.7 Favored Pre-proline 0 N--CA 1.451 -0.38 0 CA-C-O 120.516 0.198 . . . . 0.0 111.099 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.848 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 32.4 Cg_exo -62.91 130.96 30.97 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.997 2.464 . . . . 0.0 112.059 176.715 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -145.19 155.19 43.12 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.35 -178.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -148.03 131.67 16.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.575 177.348 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.73 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 24.4 p -119.29 102.24 8.56 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.537 0.684 . . . . 0.0 109.723 165.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 2.5 p -107.49 163.46 13.04 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.298 178.004 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 7.1 p -108.55 101.33 10.5 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.405 -175.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.543 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 24.3 tt0 177.84 146.44 0.13 Allowed 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 -177.254 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.65 ' HB3' HD22 ' A' ' 82' ' ' LEU . 17.6 m-20 -60.47 138.15 58.05 Favored 'General case' 0 CA--C 1.506 -0.723 0 C-N-CA 119.471 -0.892 . . . . 0.0 109.793 177.01 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.65 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 63.13 18.58 11.06 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.664 173.613 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 83' ' ' CYS . . . . . 0.543 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 12.1 t -75.03 -23.95 58.23 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.096 0.474 . . . . 0.0 111.299 -173.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.566 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 29.6 p-10 . . . . . 0 C--N 1.325 -0.466 0 CA-C-O 121.589 0.709 . . . . 0.0 109.951 177.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.0 tp . . . . . 0 N--CA 1.46 0.073 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.556 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 30.8 mtmm -106.44 113.32 26.77 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.911 -0.315 . . . . 0.0 111.181 -177.511 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.605 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 34.7 m -116.47 138.11 51.64 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.729 178.71 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.661 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 11.8 m-85 -57.23 105.6 0.25 Allowed 'General case' 0 N--CA 1.465 0.309 0 O-C-N 123.118 0.261 . . . . 0.0 111.333 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.1 m -91.37 129.03 37.41 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 175.328 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 . . . . . 0 C--N 1.33 -0.264 0 C-N-CA 119.768 -0.773 . . . . 0.0 111.196 -175.905 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 . . . . . 0 N--CA 1.445 -0.723 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.8 m -99.41 147.17 25.52 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.282 -170.196 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.528 HG13 HD11 ' A' ' 82' ' ' LEU . 58.0 t -78.07 105.67 7.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 172.201 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.5 p -125.09 140.21 53.09 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 120.07 -0.652 . . . . 0.0 111.172 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.556 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 2.2 t -88.39 111.67 22.02 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.637 176.698 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 81.7 m -95.57 161.3 14.11 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.685 -179.645 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.72 153.9 27.0 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.234 -175.228 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -66.84 -19.95 65.84 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.365 0.602 . . . . 0.0 110.914 178.006 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.593 ' HG2' HG22 ' A' ' 57' ' ' THR . 8.4 tt0 -46.72 -44.82 19.1 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.178 164.625 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.671 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 2.1 mt-30 -99.14 70.73 1.79 Allowed 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.541 -1.208 . . . . 0.0 109.567 -176.298 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.74 14.87 4.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.472 -0.786 . . . . 0.0 112.211 -173.544 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ARG . . . . . 0.668 ' CG ' ' HA ' ' A' ' 58' ' ' VAL . 13.6 mmt85 -131.77 177.4 7.55 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.374 0.606 . . . . 0.0 109.993 172.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.67 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 8.6 m -133.56 139.56 46.65 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.085 -0.961 . . . . 0.0 108.68 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.568 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -99.33 122.99 43.24 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.717 0.294 . . . . 0.0 110.341 -177.035 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.663 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 56.3 t80 -131.7 107.28 8.69 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.953 171.229 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.563 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 43.9 t -102.62 138.65 26.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 120.411 -0.516 . . . . 0.0 109.681 177.395 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.772 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 3.7 mm100 -77.9 139.27 39.22 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 176.009 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.666 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.1 mm? -135.03 153.0 78.2 Favored Pre-proline 0 C--N 1.317 -0.846 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.896 178.886 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -87.77 8.75 4.07 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.463 2.109 . . . . 0.0 112.221 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -133.92 -24.8 1.67 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.967 0.413 . . . . 0.0 110.95 -179.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.666 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 68.0 m -162.31 -157.83 0.49 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 -175.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.402 ' HB3' ' HE1' ' A' ' 44' ' ' PHE . 49.5 mt-10 -140.81 135.92 31.92 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 172.857 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ILE . . . . . 0.663 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 59.6 mt -88.96 127.05 41.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.621 178.801 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.474 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 24.2 mt-30 -139.35 130.46 26.55 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 123.499 0.499 . . . . 0.0 109.917 177.665 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -173.4 172.32 3.76 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.671 0.607 . . . . 0.0 110.198 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.605 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 34.7 m -98.82 138.24 36.25 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.683 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.568 ' HE3' HD12 ' A' ' 43' ' ' LEU . 66.0 mmtt -137.66 156.05 48.46 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.671 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 7.8 p -69.77 152.74 44.26 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 172.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.668 ' HA ' ' CG ' ' A' ' 41' ' ' ARG . 40.3 t -49.7 -55.33 5.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.799 0.333 . . . . 0.0 110.513 -176.568 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.581 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 39.0 tt0 -61.82 -55.14 33.02 Favored 'General case' 0 C--O 1.217 -0.624 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.371 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.787 ' O ' HG13 ' A' ' 64' ' ' VAL . 26.1 tt0 -54.46 -38.84 66.83 Favored 'General case' 0 C--O 1.206 -1.197 0 O-C-N 123.11 0.256 . . . . 0.0 111.202 -175.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.655 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.4 t -69.68 -32.8 71.62 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 120.069 -0.652 . . . . 0.0 110.382 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.8 -39.35 87.73 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.038 171.839 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 14.5 mm-40 -57.79 -52.54 65.05 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.96 0.886 . . . . 0.0 110.217 176.306 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.787 HG13 ' O ' ' A' ' 60' ' ' GLN . 4.7 m -69.83 -26.41 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.759 0 CA-C-N 114.591 -1.186 . . . . 0.0 111.053 -178.669 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.697 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -55.75 -49.36 73.32 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 174.787 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -73.26 -36.39 66.36 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.535 -0.466 . . . . 0.0 112.102 -174.778 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.645 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 12.3 pt-20 -59.41 -43.35 93.05 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.292 -179.205 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.517 HG22 ' O ' ' A' ' 64' ' ' VAL . 34.6 m -79.37 -34.95 16.57 Favored 'Isoleucine or valine' 0 C--O 1.231 0.096 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.488 -179.807 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 95.7 m -74.67 -20.54 59.83 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 0.0 110.882 -176.631 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.3 -23.34 57.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.021 0.439 . . . . 0.0 110.015 173.566 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 67' ' ' GLU . 14.3 mt -82.8 -25.86 8.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.723 176.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.46 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 115.52 7.67 15.66 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.279 -0.962 . . . . 0.0 112.017 -178.256 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -101.03 106.21 43.22 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-O 120.701 0.286 . . . . 0.0 111.063 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.772 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 74.8 Cg_exo -57.2 130.63 40.47 Favored 'Trans proline' 0 N--CA 1.471 0.173 0 C-N-CA 123.383 2.722 . . . . 0.0 113.043 177.095 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.697 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -126.16 159.32 33.23 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.034 175.107 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -135.46 120.98 19.31 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.836 -178.623 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.67 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 70.1 m -123.27 92.45 3.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.178 0.513 . . . . 0.0 110.721 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.7 p -110.29 159.87 17.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.763 -176.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 41.8 t -109.71 102.79 11.57 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.04 -178.645 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.544 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 9.9 tt0 -175.02 146.99 0.9 Allowed 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 -178.279 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.734 ' HB3' HD22 ' A' ' 82' ' ' LEU . 58.2 m-20 -63.78 135.18 56.43 Favored 'General case' 0 CA--C 1.504 -0.818 0 C-N-CA 117.878 -1.529 . . . . 0.0 109.313 177.031 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.734 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.76 20.37 12.11 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.166 174.116 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 83' ' ' CYS . . . . . 0.544 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.7 t -65.24 -45.78 83.24 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.397 -173.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.49 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 32.2 p-10 . . . . . 0 C--N 1.328 -0.357 0 C-N-CA 119.517 -0.873 . . . . 0.0 109.443 174.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 52.9 ttm . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.532 ' HB1' ' OG1' ' A' ' 34' ' ' THR . . . 67.4 107.76 0.04 OUTLIER 'General case' 0 C--O 1.234 0.261 0 O-C-N 124.219 0.949 . . . . 0.0 112.867 174.327 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.514 HD23 HG22 ' A' ' 40' ' ' THR . 2.3 mm? -90.95 138.59 31.48 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 175.43 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 33' ' ' THR . 30.5 mtmm -115.02 98.61 6.9 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 119.552 -0.859 . . . . 0.0 111.323 -178.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 27.9 m -123.1 165.98 15.93 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.12 175.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.451 ' HA ' ' O ' ' A' ' 31' ' ' THR . 76.8 m-85 -72.01 131.55 43.06 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.145 -176.65 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.1 m -116.82 128.02 54.88 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 167.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.781 ' HE ' ' HA ' ' A' ' 28' ' ' ASP . 18.6 ttt180 -101.5 110.09 22.02 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.441 -173.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -100.7 85.78 2.98 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 176.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.38 -89.9 0.87 Allowed Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 119.53 -1.319 . . . . 0.0 110.971 -173.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.781 ' HA ' ' HE ' ' A' ' 25' ' ' ARG . 17.7 t70 -144.9 0.62 0.96 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.161 0.505 . . . . 0.0 110.974 -179.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.542 ' O ' ' HG3' ' A' ' 25' ' ' ARG . 3.8 p-10 -75.73 165.48 24.97 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.788 -176.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 51.2 mtp85 -126.38 111.82 14.92 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 119.794 -0.763 . . . . 0.0 109.099 172.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.451 ' O ' ' HA ' ' A' ' 23' ' ' PHE . 97.1 m -130.88 133.41 45.87 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.324 -175.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 59.3 t -73.9 106.5 3.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.868 175.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.579 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 38.4 p -106.46 148.16 28.49 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.607 178.127 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.532 ' OG1' ' HB1' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -107.3 112.51 25.39 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.458 -179.526 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.509 ' O ' ' HA ' ' A' ' 19' ' ' ALA . 2.5 p -95.1 166.11 12.09 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.037 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.27 174.77 9.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.511 -176.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.08 -28.27 66.33 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.368 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.595 ' O ' HG23 ' A' ' 57' ' ' THR . 3.3 pt-20 -54.91 -56.78 15.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.645 175.015 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.741 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 54.9 mt-30 -86.96 53.6 2.89 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.774 -172.521 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.514 HG22 HD23 ' A' ' 20' ' ' LEU . 0.1 OUTLIER -73.67 -0.36 15.25 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -173.283 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.627 ' CG ' ' HA ' ' A' ' 58' ' ' VAL . 3.7 mmp_? -110.75 178.84 4.23 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 119.943 -0.703 . . . . 0.0 109.91 173.515 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.654 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 61.2 m -135.73 131.93 36.22 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.066 -177.065 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.51 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.5 OUTLIER -93.12 128.72 39.16 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.288 -176.815 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.616 ' HB2' ' HB2' ' A' ' 84' ' ' ASN . 80.7 t80 -140.16 117.3 11.21 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.147 172.334 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.59 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 40.5 t -115.11 136.05 53.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 178.67 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.795 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 8.2 mm100 -74.22 139.73 44.57 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.141 177.356 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.569 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.8 mm? -132.19 147.86 67.47 Favored Pre-proline 0 C--N 1.316 -0.862 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 172.474 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 11.6 Cg_exo -72.84 8.98 1.44 Allowed 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.682 2.255 . . . . 0.0 112.479 177.139 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -139.02 -59.35 0.59 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.394 0.616 . . . . 0.0 109.566 -177.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.569 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 13.1 m -121.62 -150.08 0.44 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.436 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HG2' ' NH1' ' A' ' 25' ' ' ARG . 2.7 pt-20 -151.21 147.8 27.45 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 177.389 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.59 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 22.5 mm -91.44 129.42 42.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.259 176.434 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.446 ' HB3' ' ND2' ' A' ' 84' ' ' ASN . 45.7 mt-30 -139.09 130.22 26.66 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.102 -178.473 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -173.6 160.56 3.81 Favored 'General case' 0 N--CA 1.463 0.21 0 O-C-N 123.403 0.439 . . . . 0.0 111.146 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.516 ' O ' ' HE2' ' A' ' 56' ' ' LYS . 1.3 m -79.27 147.25 32.6 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 168.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.516 ' HE2' ' O ' ' A' ' 55' ' ' CYS . 7.1 tppt? -156.96 132.5 9.31 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.154 -179.062 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.741 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 38.1 m -54.28 143.17 23.97 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.753 178.257 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.627 ' HA ' ' CG ' ' A' ' 41' ' ' ARG . 20.1 t -44.84 -61.46 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 123.796 0.685 . . . . 0.0 111.511 -173.138 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -57.51 -52.36 65.71 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.161 178.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.675 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 6.8 tp60 -54.56 -47.48 73.19 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.86 -176.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.66 ' HA ' HG22 ' A' ' 64' ' ' VAL . 4.2 t -65.9 -32.8 74.52 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.382 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.36 -41.35 85.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.217 0.532 . . . . 0.0 110.835 176.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.675 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 9.1 pt-20 -74.52 -38.07 62.9 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.552 -176.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.66 HG22 ' HA ' ' A' ' 61' ' ' CYS . 13.5 m -72.23 -26.32 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-O 121.428 0.632 . . . . 0.0 110.414 174.222 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.66 HD23 ' SG ' ' A' ' 77' ' ' CYS . 0.2 OUTLIER -56.02 -47.64 77.42 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 174.059 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -72.7 -36.56 67.87 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.054 -174.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.64 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.5 pt-20 -59.6 -43.68 93.64 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.236 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.54 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 35.0 m -79.17 -34.42 16.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.951 0.405 . . . . 0.0 111.552 -178.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 97.8 m -78.42 -15.67 58.42 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.165 0.507 . . . . 0.0 110.861 -176.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.64 -19.56 45.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.082 173.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.514 HG13 ' O ' ' A' ' 67' ' ' GLU . 29.9 mt -81.0 -27.11 10.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.864 177.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 119.76 4.18 11.84 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 119.891 -1.147 . . . . 0.0 112.306 -178.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -97.82 112.4 61.52 Favored Pre-proline 0 N--CA 1.449 -0.499 0 CA-C-O 120.536 0.208 . . . . 0.0 110.797 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.795 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 54.4 Cg_exo -58.29 134.98 65.13 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.11 2.54 . . . . 0.0 112.306 177.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -143.29 160.92 39.6 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 119.983 -0.687 . . . . 0.0 111.427 178.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.412 ' HE3' ' HB3' ' A' ' 76' ' ' LYS . 7.6 ptpp? -142.19 147.58 36.82 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.917 175.226 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.66 ' SG ' HD23 ' A' ' 65' ' ' LEU . 76.6 m -130.24 87.08 2.46 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.151 173.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 15.4 p -106.95 171.02 7.6 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 119.943 -0.703 . . . . 0.0 111.475 -175.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.508 ' HB3' ' CZ ' ' A' ' 41' ' ' ARG . 10.0 p -115.35 107.08 14.77 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.085 0.469 . . . . 0.0 111.486 -174.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.536 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 23.7 tt0 177.63 153.17 0.27 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.697 ' HB3' HD22 ' A' ' 82' ' ' LEU . 62.2 m-20 -64.43 137.31 57.81 Favored 'General case' 0 CA--C 1.505 -0.765 0 C-N-CA 117.563 -1.655 . . . . 0.0 108.66 173.505 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.697 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.99 15.8 10.19 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.607 175.12 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' CYS . . . . . 0.536 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.2 t -64.83 -23.42 67.23 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.654 -172.497 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.616 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 19.5 p-10 -73.46 81.31 1.44 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 122.03 0.919 . . . . 0.0 110.606 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -165.13 163.38 20.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.196 -1.365 . . . . 0.0 109.076 -174.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 71.3 m -153.98 -60.81 0.13 Allowed 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.455 173.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.556 ' CD ' ' H ' ' A' ' 87' ' ' GLU . 1.4 pm0 -83.58 33.87 0.47 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.557 -174.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.426 178.191 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.462 ' O ' ' HG3' ' A' ' 18' ' ' MET . 22.6 ptm . . . . . 0 N--CA 1.478 0.93 0 CA-C-O 121.207 0.527 . . . . 0.0 110.358 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -90.07 -175.49 4.58 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.066 179.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 46.2 tp -135.61 148.41 49.01 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.658 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.512 ' HA ' ' O ' ' A' ' 33' ' ' THR . 9.9 mtmp? -91.44 102.9 15.58 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 120.449 -0.5 . . . . 0.0 111.306 178.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 30.4 m -111.26 139.34 46.73 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 178.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.666 ' N ' HD21 ' A' ' 84' ' ' ASN . 19.0 m-85 -54.24 123.86 14.07 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.893 175.248 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -100.61 167.36 10.39 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 171.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.569 ' HG3' ' HB2' ' A' ' 53' ' ' GLN . 7.2 mtp180 -123.82 111.35 16.0 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.062 -0.655 . . . . 0.0 112.241 178.206 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -98.53 107.32 19.74 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 170.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 65.23 -98.75 0.33 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 119.497 -1.335 . . . . 0.0 110.831 -172.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.555 ' HA ' ' NH2' ' A' ' 25' ' ' ARG . 8.7 t70 -130.62 -4.07 4.18 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.597 173.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -75.46 157.61 33.82 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 118.174 -1.41 . . . . 0.0 108.989 177.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.2 mmt85 -106.33 130.98 54.07 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 119.068 -1.053 . . . . 0.0 109.491 -179.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.3 m -114.28 114.9 26.58 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.53 -169.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.4 HG22 ' CE1' ' A' ' 23' ' ' PHE . 48.6 t -80.01 106.37 11.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 174.05 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.512 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 47.2 p -128.48 142.74 50.99 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.313 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 t -85.43 121.73 28.56 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 165.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.4 t -87.66 -163.39 0.93 Allowed 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.536 -172.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.27 168.67 12.52 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.65 -0.42 . . . . 0.0 111.04 -176.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -60.21 -18.68 50.05 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.042 178.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.812 ' HG2' HG22 ' A' ' 57' ' ' THR . 19.1 tt0 -63.63 -40.94 98.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.44 176.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.406 ' OE1' ' HB3' ' A' ' 38' ' ' GLU . 22.0 mp0 -96.98 120.88 38.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.656 0.741 . . . . 0.0 112.741 -169.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.428 ' OG1' HG23 ' A' ' 58' ' ' VAL . 1.1 p -124.92 12.53 8.43 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.552 -1.204 . . . . 0.0 110.582 177.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.512 ' CG ' ' HB3' ' A' ' 77' ' ' CYS . 8.2 tpp85 -138.18 173.4 11.66 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.489 177.511 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.651 ' HB3' ' OD1' ' A' ' 84' ' ' ASN . 18.1 m -126.36 149.31 49.28 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.557 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.3 OUTLIER -110.1 122.03 46.64 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 123.147 0.279 . . . . 0.0 110.298 -176.231 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.618 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 50.2 t80 -133.12 104.06 6.32 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.487 173.688 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.531 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 61.8 t -101.48 134.36 42.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.118 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.746 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 1.6 mm100 -76.78 138.07 39.66 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 119.777 -0.769 . . . . 0.0 109.637 177.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.48 HD22 ' C ' ' A' ' 46' ' ' GLN . 2.9 mm? -138.51 152.38 70.96 Favored Pre-proline 0 C--N 1.314 -0.978 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.762 176.177 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -86.32 9.42 4.04 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 122.438 2.092 . . . . 0.0 111.424 172.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -125.0 -65.39 1.03 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.842 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.3 m -151.85 132.24 13.75 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.13 149.85 37.29 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.79 0.329 . . . . 0.0 110.542 -172.683 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.618 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 65.8 mt -90.95 124.91 43.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.377 178.172 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.569 ' HB2' ' HG3' ' A' ' 25' ' ' ARG . 48.5 mt-30 -135.85 129.96 33.16 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -176.25 163.69 2.6 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 123.419 0.449 . . . . 0.0 110.979 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 2.0 p -85.88 135.87 33.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.724 0.297 . . . . 0.0 110.585 177.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.559 ' HB2' ' HB2' ' A' ' 61' ' ' CYS . 68.1 mmtt -138.71 158.76 43.64 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 176.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.812 HG22 ' HG2' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -69.54 155.2 40.85 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.605 -1.258 . . . . 0.0 107.605 171.722 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.478 ' HA ' ' HB2' ' A' ' 41' ' ' ARG . 85.3 t -52.76 -46.09 50.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.254 -0.579 . . . . 0.0 109.92 179.077 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.582 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 37.5 tt0 -66.87 -55.56 14.2 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.117 178.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.806 ' O ' HG13 ' A' ' 64' ' ' VAL . 7.8 tt0 -54.84 -40.23 69.4 Favored 'General case' 0 C--O 1.212 -0.887 0 O-C-N 123.331 0.394 . . . . 0.0 110.594 -175.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.668 ' HA ' HG22 ' A' ' 64' ' ' VAL . 3.8 t -69.93 -32.19 70.35 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.711 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.37 -38.75 85.24 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.059 171.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.582 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 11.5 mm-40 -57.61 -52.71 64.3 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 122.114 0.959 . . . . 0.0 110.202 175.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.806 HG13 ' O ' ' A' ' 60' ' ' GLN . 4.2 m -71.06 -26.06 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.79 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.84 -178.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.662 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -56.09 -49.33 74.13 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 175.23 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -72.88 -37.11 67.43 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 120.562 -0.455 . . . . 0.0 112.011 -174.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.645 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 12.1 pt-20 -59.25 -42.95 92.33 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.109 -0.637 . . . . 0.0 110.355 -179.615 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.499 HG22 ' O ' ' A' ' 64' ' ' VAL . 34.8 m -79.3 -36.37 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-O 120.827 0.346 . . . . 0.0 111.691 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 98.3 m -74.75 -20.74 59.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.994 -175.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.61 -23.7 58.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.152 0.501 . . . . 0.0 110.149 174.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.497 HG13 ' O ' ' A' ' 67' ' ' GLU . 12.1 mt -81.03 -23.85 10.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.666 177.378 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.463 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 112.87 5.82 23.41 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.979 -178.122 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -98.66 107.94 45.61 Favored Pre-proline 0 N--CA 1.449 -0.475 0 CA-C-O 120.777 0.322 . . . . 0.0 111.081 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.746 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 74.9 Cg_exo -55.38 130.75 42.26 Favored 'Trans proline' 0 C--N 1.34 0.118 0 C-N-CA 123.478 2.785 . . . . 0.0 113.262 177.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.662 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -128.38 154.51 45.92 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.889 174.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -134.61 118.81 17.62 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.885 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.592 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 45.9 m -114.34 93.85 4.53 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.187 173.699 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 17.8 p -109.33 155.1 21.6 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.944 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 49.6 t -109.48 103.44 12.34 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 119.991 -0.684 . . . . 0.0 110.469 -174.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.511 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 14.4 tt0 -173.87 152.67 2.01 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 -179.36 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.722 ' HB3' HD22 ' A' ' 82' ' ' LEU . 28.7 m-20 -63.48 136.43 57.58 Favored 'General case' 0 CA--C 1.504 -0.812 0 C-N-CA 117.878 -1.529 . . . . 0.0 109.389 176.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.722 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 62.38 21.53 12.61 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.114 174.654 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 83' ' ' CYS . . . . . 0.517 ' O ' ' HG2' ' A' ' 85' ' ' ARG . 8.1 t -68.43 -37.03 79.91 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.559 -172.166 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.666 HD21 ' N ' ' A' ' 23' ' ' PHE . 0.3 OUTLIER -74.29 91.96 2.22 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 119.085 -1.046 . . . . 0.0 109.528 175.454 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.517 ' HG2' ' O ' ' A' ' 83' ' ' CYS . 5.6 ptt180 -132.4 156.76 46.1 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.835 -171.446 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.5 m -56.62 115.82 2.77 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.796 0.685 . . . . 0.0 111.413 -176.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -99.08 -33.08 10.94 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.096 -179.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.601 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.725 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 49.6 tpp . . . . . 0 N--CA 1.477 0.882 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.27 126.63 28.78 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 123.476 0.485 . . . . 0.0 110.845 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.627 HD23 HG22 ' A' ' 40' ' ' THR . 2.6 mm? -95.5 130.99 42.15 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.829 -178.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.761 ' HE3' ' N ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -83.92 124.49 31.05 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 171.689 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.624 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 12.3 t -147.47 153.54 39.67 Favored 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 119.399 -0.921 . . . . 0.0 109.972 -177.284 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.737 ' H ' HD21 ' A' ' 84' ' ' ASN . 92.1 m-85 -84.55 123.13 29.96 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 119.179 -1.009 . . . . 0.0 109.354 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.5 m -113.78 131.42 56.22 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 175.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.986 HH11 ' HA ' ' A' ' 28' ' ' ASP . 1.8 tpp180 -82.92 110.45 17.92 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.059 0.457 . . . . 0.0 110.379 -178.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -106.84 94.11 4.93 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 175.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 71.53 -98.26 0.74 Allowed Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 119.157 -1.497 . . . . 0.0 110.561 -173.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.986 ' HA ' HH11 ' A' ' 25' ' ' ARG . 33.5 t70 -115.9 -29.01 6.49 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.127 -0.629 . . . . 0.0 109.848 173.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -58.79 129.24 41.18 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.214 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 30' ' ' ARG . 27.4 mtp-105 -120.44 113.81 20.87 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 176.561 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.499 ' O ' ' HA ' ' A' ' 23' ' ' PHE . 9.1 t -140.15 163.97 31.3 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.753 -173.094 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.413 HG13 ' HB3' ' A' ' 21' ' ' LYS . 94.8 t -79.12 120.78 30.98 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.236 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.396 178.194 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.3 p -113.21 141.49 46.9 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.171 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.7 t -87.11 111.93 21.42 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 174.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.1 m -107.2 157.54 17.8 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.924 -171.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.12 170.99 10.39 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -167.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -52.68 -39.06 61.54 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.449 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 39' ' ' GLN . 4.5 pt-20 -56.85 -40.81 76.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.828 177.307 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.622 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 70.5 mt-30 -97.21 64.96 1.96 Allowed 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.797 -174.186 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.627 HG22 HD23 ' A' ' 20' ' ' LEU . 0.7 OUTLIER -89.71 27.28 1.56 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.433 0.635 . . . . 0.0 110.427 177.461 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.61 ' HD3' HG22 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -136.23 177.78 7.57 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.979 178.253 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.8 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.0 m -137.21 131.28 32.22 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.809 179.458 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.456 ' HG ' ' SG ' ' A' ' 61' ' ' CYS . 0.5 OUTLIER -94.01 118.43 31.5 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 176.87 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.558 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 91.5 t80 -134.76 118.83 17.49 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.226 175.415 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.569 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 58.8 t -125.29 141.59 44.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.982 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.651 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 12.9 mm-40 -83.52 137.1 34.02 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.138 0.494 . . . . 0.0 110.901 177.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.581 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.7 mm? -131.9 154.02 81.6 Favored Pre-proline 0 C--N 1.319 -0.744 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 175.639 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.91 18.72 1.43 Allowed 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.28 1.986 . . . . 0.0 112.267 177.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -138.35 -44.43 0.5 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.461 0.648 . . . . 0.0 109.747 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.581 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 48.1 m -150.77 -151.39 0.39 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 178.414 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.29 153.78 42.37 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.264 175.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.569 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 14.3 mm -87.65 127.01 41.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.491 177.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.533 ' HB3' ' O ' ' A' ' 23' ' ' PHE . 25.7 mt-30 -140.69 129.11 22.57 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 123.556 0.535 . . . . 0.0 110.232 176.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.48 ' OE2' HG23 ' A' ' 52' ' ' ILE . 0.5 OUTLIER -174.03 146.1 1.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.936 -177.314 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.624 ' SG ' ' HB3' ' A' ' 22' ' ' CYS . 88.2 m -79.91 118.67 21.87 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 119.984 -0.687 . . . . 0.0 109.223 169.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -124.0 156.18 36.92 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 174.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.622 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 15.6 p -67.34 153.8 42.84 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 119.405 -0.918 . . . . 0.0 109.435 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.61 HG22 ' HD3' ' A' ' 41' ' ' ARG . 58.7 t -53.31 -46.67 57.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 121.221 -0.192 . . . . 0.0 111.105 -175.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -62.3 -55.82 24.48 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 120.903 0.382 . . . . 0.0 111.234 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.6 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 58.5 tt0 -64.14 -42.86 96.64 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.59 -172.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.652 ' HA ' HG22 ' A' ' 64' ' ' VAL . 4.7 t -64.52 -31.5 72.73 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.5 -0.48 . . . . 0.0 109.84 178.277 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.436 ' O ' ' HB3' ' A' ' 65' ' ' LEU . . . -69.68 -40.07 76.6 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.546 -0.462 . . . . 0.0 111.209 176.445 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.6 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 12.4 pt-20 -72.85 -38.47 67.06 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.95 0.405 . . . . 0.0 110.653 -178.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.652 HG22 ' HA ' ' A' ' 61' ' ' CYS . 12.8 m -73.56 -26.39 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.366 0 CA-C-O 121.638 0.732 . . . . 0.0 110.446 174.22 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.558 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 25.6 tp -54.94 -47.46 74.42 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 174.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.555 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 40.0 tt0 -73.98 -39.84 63.39 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.486 -175.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.644 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.0 pt-20 -55.24 -45.28 76.03 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.549 -177.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.591 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 33.0 m -80.16 -32.93 13.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.555 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 13.9 p -70.19 -27.98 64.94 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.217 -178.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.32 -19.74 63.87 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.629 176.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 11.3 mt -87.85 -20.31 7.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.827 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 114.51 -1.88 23.5 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 119.935 -1.126 . . . . 0.0 112.648 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.419 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 80.4 m-85 -78.71 123.51 85.36 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.663 0.232 . . . . 0.0 111.155 -178.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.651 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 52.8 Cg_exo -62.0 117.68 4.53 Favored 'Trans proline' 0 CA--C 1.516 -0.394 0 C-N-CA 123.045 2.497 . . . . 0.0 111.973 175.31 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.476 ' HA ' ' O ' ' A' ' 44' ' ' PHE . . . -135.22 149.4 49.87 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.811 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 ptmt -150.15 112.64 4.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.483 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.8 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 29.6 m -103.23 92.56 4.56 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.569 170.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.3 p -107.84 160.39 15.78 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.654 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 7.9 p -109.42 101.36 10.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.991 0.424 . . . . 0.0 111.029 -175.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.569 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 3.4 tt0 179.64 152.04 0.41 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -179.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.671 ' HB3' HD22 ' A' ' 82' ' ' LEU . 78.0 m-20 -64.37 132.54 50.4 Favored 'General case' 0 CA--C 1.506 -0.714 0 C-N-CA 118.388 -1.325 . . . . 0.0 109.981 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.671 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.54 16.84 10.53 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.531 172.883 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 83' ' ' CYS . . . . . 0.569 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 39.6 t -61.37 -18.54 59.22 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -172.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.737 HD21 ' H ' ' A' ' 23' ' ' PHE . 4.3 p30 -60.09 -81.45 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 119.234 -0.412 . . . . 0.0 110.474 -179.575 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.471 ' H ' ' CG ' ' A' ' 84' ' ' ASN . 9.4 ptt180 31.96 -123.73 0.06 Allowed 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.325 1.05 . . . . 0.0 113.182 174.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.4 m 71.96 21.47 4.09 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 175.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -71.75 -27.85 63.26 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.334 178.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.394 178.098 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 66.5 mtm . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.67 116.58 13.32 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 123.373 0.421 . . . . 0.0 110.659 178.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -90.1 147.88 23.35 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.33 -0.548 . . . . 0.0 109.718 -177.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.508 ' HG2' ' HB ' ' A' ' 34' ' ' THR . 29.0 mtmm -120.9 98.57 6.06 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 119.471 -0.892 . . . . 0.0 110.808 176.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.2 m -107.17 151.62 25.17 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.262 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.611 ' CD1' ' HB2' ' A' ' 85' ' ' ARG . 28.8 m-85 -73.28 153.56 40.53 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.823 179.335 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.4 m -142.11 127.91 19.32 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.41 177.323 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.758 HH11 ' HG2' ' A' ' 51' ' ' GLU . 63.0 mtp180 -91.09 110.87 22.15 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 119.379 -0.929 . . . . 0.0 111.161 -178.358 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -98.77 85.73 3.37 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.599 0.714 . . . . 0.0 109.906 177.251 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.52 -87.73 1.27 Allowed Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 119.667 -1.254 . . . . 0.0 110.869 -173.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -125.21 -53.37 1.62 Allowed 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.894 176.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -65.03 162.15 17.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.317 0.579 . . . . 0.0 110.672 -178.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.552 ' HB3' ' HG2' ' A' ' 25' ' ' ARG . 15.0 ptp180 -125.46 115.56 20.44 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.562 -175.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 19.1 p -94.99 157.02 16.08 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.199 -178.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 61.8 t -99.31 112.81 32.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 176.114 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.484 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 41.3 p -107.64 148.01 29.9 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.394 176.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.508 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 1.7 t -101.92 112.28 24.85 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.753 176.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 39' ' ' GLN . 1.6 p -95.12 162.55 13.66 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.4 -175.63 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.53 178.04 7.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.749 -173.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -51.23 -33.07 26.28 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.494 0.664 . . . . 0.0 110.343 174.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.51 ' HG2' HG22 ' A' ' 57' ' ' THR . 39.8 tt0 -51.3 -49.61 60.95 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.387 -1.278 . . . . 0.0 110.939 175.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.564 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 34.8 mm-40 -96.76 94.29 7.19 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 119.715 -0.794 . . . . 0.0 109.67 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.8 18.87 20.82 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.591 177.654 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.741 ' HG2' ' SG ' ' A' ' 61' ' ' CYS . 2.8 tpt180 -131.29 174.45 10.04 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.502 174.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.669 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.1 m -134.01 131.07 38.47 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.338 -0.847 . . . . 0.0 108.739 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.562 HD22 HG23 ' A' ' 45' ' ' VAL . 0.2 OUTLIER -91.79 128.91 37.81 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -179.328 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.553 ' HB2' ' HB2' ' A' ' 84' ' ' ASN . 24.9 t80 -138.36 102.14 4.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.323 172.838 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.606 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 31.8 t -105.35 133.95 48.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 175.396 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.881 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -97.68 134.01 41.44 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.013 -179.118 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.519 HD23 ' HA ' ' A' ' 51' ' ' GLU . 3.7 mm? -119.48 157.85 50.58 Favored Pre-proline 0 C--N 1.319 -0.734 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.38 -28.41 87.51 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.473 2.115 . . . . 0.0 113.013 -178.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -135.31 9.76 3.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.822 0.344 . . . . 0.0 111.021 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.452 ' C ' ' HB2' ' A' ' 47' ' ' LEU . 37.2 m -156.58 -166.63 2.18 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.528 -0.469 . . . . 0.0 109.97 -175.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.758 ' HG2' HH11 ' A' ' 25' ' ' ARG . 7.7 pt-20 -165.6 151.05 9.07 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 175.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.606 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 24.7 mm -105.87 128.39 60.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.457 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.441 HE22 ' HA ' ' A' ' 85' ' ' ARG . 17.7 mt-30 -139.2 130.56 26.94 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.999 -0.68 . . . . 0.0 110.124 -179.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -165.74 158.73 15.55 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.678 -178.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.422 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 6.3 m -77.98 117.51 19.38 Favored 'General case' 0 CA--C 1.507 -0.687 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 163.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.422 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 11.1 mptt -123.86 144.93 49.45 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 176.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.564 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 21.9 p -63.01 156.86 23.44 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 118.925 -1.11 . . . . 0.0 108.127 -178.105 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.56 HG22 ' HD3' ' A' ' 41' ' ' ARG . 57.6 t -58.17 -37.04 60.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.033 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -65.52 -55.68 16.48 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.981 177.065 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.633 ' O ' HG13 ' A' ' 64' ' ' VAL . 34.1 tt0 -64.06 -28.59 69.89 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.23 -175.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.741 ' SG ' ' HG2' ' A' ' 41' ' ' ARG . 0.5 OUTLIER -67.86 -33.84 75.54 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.997 178.975 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.12 -40.41 78.31 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 174.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.567 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 88.1 mt-10 -58.45 -53.2 61.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.647 177.195 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.637 HG22 ' HA ' ' A' ' 61' ' ' CYS . 17.7 m -72.8 -28.89 28.14 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.569 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.661 -177.076 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.607 HD12 ' HB3' ' A' ' 75' ' ' ALA . 52.5 tp -58.93 -50.79 72.71 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.617 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -75.21 -36.38 61.39 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.331 -176.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.625 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.4 pt-20 -56.33 -47.65 78.32 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.59 -176.02 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.599 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.6 m -80.67 -34.97 14.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 C-N-CA 120.809 -0.357 . . . . 0.0 111.806 -179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 89.7 m -67.76 -28.61 67.77 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.855 0.36 . . . . 0.0 110.955 -177.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.58 -21.52 62.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.992 0.425 . . . . 0.0 110.682 176.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 67' ' ' GLU . 8.9 mt -87.22 -20.13 7.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.269 0.557 . . . . 0.0 109.753 178.07 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 115.49 -1.12 22.04 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.015 -1.088 . . . . 0.0 112.494 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.518 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 63.1 m-85 -87.58 116.88 67.57 Favored Pre-proline 0 N--CA 1.448 -0.529 0 CA-C-O 120.596 0.236 . . . . 0.0 110.547 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.881 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 46.6 Cg_exo -63.08 129.08 24.63 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 123.193 2.595 . . . . 0.0 112.616 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.607 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -138.34 162.4 34.47 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.079 -0.649 . . . . 0.0 111.796 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.77 154.36 38.35 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.317 168.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.669 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 9.4 p -129.62 111.64 12.9 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-O 121.759 0.79 . . . . 0.0 109.912 164.006 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 2.5 p -106.08 153.21 22.39 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.174 179.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.444 ' HB3' ' HD2' ' A' ' 41' ' ' ARG . 7.7 p -109.64 100.23 9.3 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.424 -0.51 . . . . 0.0 109.893 177.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 173.45 145.08 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -177.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.686 ' HB3' HD22 ' A' ' 82' ' ' LEU . 70.8 m-20 -61.65 139.24 58.31 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.328 -0.949 . . . . 0.0 110.593 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.686 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 62.82 17.81 10.21 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.582 171.738 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 14.7 p -79.58 -37.62 35.92 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.011 -175.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.553 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 20.4 p-10 -74.35 -3.78 32.4 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.149 0.499 . . . . 0.0 110.607 -177.279 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.611 ' HB2' ' CD1' ' A' ' 23' ' ' PHE . 1.3 ttp180 -66.63 -49.15 67.18 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.394 178.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.3 p -159.97 135.03 7.97 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.328 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -85.92 -4.72 59.23 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.271 0.558 . . . . 0.0 110.722 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.299 179.203 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 12.7 tpt . . . . . 0 N--CA 1.48 1.031 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 67.08 175.38 0.25 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.43 -176.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 30.2 tp -157.49 157.66 34.29 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -118.08 109.58 16.6 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 119.556 -0.858 . . . . 0.0 111.273 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 38.7 m -128.81 163.27 25.57 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.674 -0.411 . . . . 0.0 110.679 175.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.474 ' HB3' ' HB3' ' A' ' 30' ' ' ARG . 98.8 m-85 -78.51 124.97 28.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.925 -177.44 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.468 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 48.2 m -125.14 125.44 43.72 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 172.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.576 ' HA ' ' HA ' ' A' ' 30' ' ' ARG . 39.9 ttp85 -90.8 110.8 22.01 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 119.924 -0.71 . . . . 0.0 110.821 -175.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -102.48 90.55 3.9 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.848 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 84.57 -86.71 1.54 Allowed Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 119.858 -1.163 . . . . 0.0 112.481 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -77.73 -83.21 0.08 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -175.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.533 ' C ' ' HG3' ' A' ' 25' ' ' ARG . 6.3 t70 -127.89 177.91 6.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.087 0.47 . . . . 0.0 111.295 -176.073 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.576 ' HA ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -81.48 120.27 24.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.965 -168.634 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 35.2 p -100.45 144.38 29.52 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.911 174.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.9 t -76.05 105.69 5.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 120.258 -0.577 . . . . 0.0 109.938 178.248 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.5 p -97.44 149.67 21.89 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.207 -176.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.9 t -89.51 112.48 23.66 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 174.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.73 147.22 23.55 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.603 -174.224 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.88 176.99 8.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.234 -0.439 . . . . 0.0 112.072 -174.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -56.21 -39.55 72.65 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.539 -177.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.831 ' HG3' ' HG3' ' A' ' 39' ' ' GLN . 9.5 pt-20 -61.7 -34.06 75.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.929 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.831 ' HG3' ' HG3' ' A' ' 38' ' ' GLU . 29.2 mt-30 -95.5 59.31 2.13 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.421 -173.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.405 ' O ' ' HD2' ' A' ' 41' ' ' ARG . 0.2 OUTLIER -83.97 7.21 19.08 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.062 0.458 . . . . 0.0 111.484 -178.963 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 1.004 ' HD3' HG22 ' A' ' 58' ' ' VAL . 7.3 mpt_? -120.24 177.38 5.04 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 168.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.778 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 59.8 m -145.62 130.15 17.88 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 119.741 -0.784 . . . . 0.0 110.284 -176.265 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.409 ' HA ' HD23 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -88.52 135.96 33.22 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.082 0.467 . . . . 0.0 110.933 -175.075 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.529 ' CE1' ' HA ' ' A' ' 86' ' ' SER . 20.1 t80 -139.71 109.23 6.21 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.979 -1.009 . . . . 0.0 108.673 170.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.585 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 27.8 t -115.04 123.79 71.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 173.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -94.32 116.28 28.64 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.436 0.636 . . . . 0.0 110.162 -178.074 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.616 ' HB2' ' O ' ' A' ' 50' ' ' SER . 2.3 mm? -111.15 156.37 41.12 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.59 -178.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -75.31 15.34 0.81 Allowed 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.01 2.473 . . . . 0.0 112.829 178.349 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -141.15 -45.98 0.38 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.539 0.685 . . . . 0.0 110.175 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.616 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 54.2 m -146.45 -163.08 1.66 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 177.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.498 ' HA ' HD23 ' A' ' 47' ' ' LEU . 29.7 mt-10 -142.88 152.04 41.69 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 119.928 -0.709 . . . . 0.0 111.025 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.585 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 49.8 mt -103.28 102.63 13.92 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.583 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.019 176.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.468 ' O ' ' HA ' ' A' ' 24' ' ' THR . 54.0 mt-30 -124.75 130.61 52.74 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 119.799 -0.761 . . . . 0.0 109.878 178.22 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -168.7 167.75 11.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.91 -176.049 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 16.3 m -90.99 119.49 31.22 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.692 -0.803 . . . . 0.0 108.9 171.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -121.23 139.99 52.64 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.493 -174.117 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.59 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 30.5 p -64.3 147.24 52.92 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 119.891 -0.723 . . . . 0.0 109.852 -178.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 1.004 HG22 ' HD3' ' A' ' 41' ' ' ARG . 25.0 t -51.65 -50.02 32.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 O-C-N 123.439 0.462 . . . . 0.0 112.145 -171.172 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.6 ' HG3' ' HG2' ' A' ' 60' ' ' GLN . 17.6 pt20 -63.03 -48.44 78.74 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 120.874 0.369 . . . . 0.0 111.872 -176.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.624 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 10.8 mm-40 -69.5 -38.49 77.63 Favored 'General case' 0 C--O 1.212 -0.919 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 -176.696 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.633 ' HA ' HG22 ' A' ' 64' ' ' VAL . 0.8 OUTLIER -60.96 -33.15 72.75 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.404 -178.728 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.63 -47.46 75.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.972 0.415 . . . . 0.0 110.454 177.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.624 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 8.2 pt-20 -72.16 -36.85 69.41 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.032 -176.032 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.633 HG22 ' HA ' ' A' ' 61' ' ' CYS . 14.4 m -74.41 -27.21 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 CA-C-O 121.524 0.678 . . . . 0.0 110.553 177.012 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 58.3 tp -59.08 -49.42 77.94 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 174.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.561 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 44.0 mt-10 -74.1 -32.04 63.05 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.556 -175.417 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.629 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.5 pt-20 -61.4 -44.96 96.24 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 120.159 -0.617 . . . . 0.0 109.929 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.557 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 33.6 m -80.21 -32.47 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.561 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 27.7 p -73.77 -25.29 60.07 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 120.201 -0.6 . . . . 0.0 111.203 -178.357 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.07 -21.45 63.15 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.061 0.458 . . . . 0.0 110.275 175.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 67' ' ' GLU . 16.4 mt -82.47 -18.43 10.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.515 176.338 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 105.48 9.06 34.17 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.197 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -89.76 122.52 67.96 Favored Pre-proline 0 N--CA 1.448 -0.561 0 CA-C-O 120.974 0.416 . . . . 0.0 111.749 -178.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_exo -51.95 124.93 15.77 Favored 'Trans proline' 0 N--CA 1.471 0.174 0 C-N-CA 123.929 3.086 . . . . 0.0 112.566 174.18 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.517 ' HA ' ' O ' ' A' ' 44' ' ' PHE . . . -151.93 157.85 42.36 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 119.955 -0.698 . . . . 0.0 112.09 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -155.5 147.07 22.98 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.956 172.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.778 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 27.6 p -130.84 94.51 3.63 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.536 0.684 . . . . 0.0 109.513 165.32 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 6.0 p -106.98 166.92 10.25 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.932 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 9.2 p -109.26 105.33 14.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.932 0.396 . . . . 0.0 110.991 -175.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.585 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 4.3 tt0 175.25 147.36 0.08 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 -176.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.702 ' HB3' HD22 ' A' ' 82' ' ' LEU . 16.5 m-20 -61.84 135.71 57.69 Favored 'General case' 0 CA--C 1.504 -0.825 0 C-N-CA 118.979 -1.088 . . . . 0.0 109.312 175.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.702 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 63.6 19.42 11.7 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.238 175.427 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 83' ' ' CYS . . . . . 0.585 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.2 t -73.57 -31.58 63.68 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.666 -176.038 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.416 ' HB3' ' CB ' ' A' ' 42' ' ' CYS . 22.0 p-10 -84.07 25.46 0.83 Allowed 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.164 -0.615 . . . . 0.0 110.012 178.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.577 ' HB3' ' O ' ' A' ' 82' ' ' LEU . 0.0 OUTLIER -59.7 160.65 7.08 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.436 -178.806 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.529 ' HA ' ' CE1' ' A' ' 44' ' ' PHE . 40.6 t -83.0 134.49 35.05 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.299 -178.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -80.38 -6.02 57.37 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.255 174.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.577 -179.272 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.483 1.2 0 N-CA-C 110.391 -0.226 . . . . 0.0 110.391 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.416 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . . . -81.64 156.84 24.91 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.579 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 30.2 tp -135.86 165.15 26.3 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt -111.26 98.67 7.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.099 0.476 . . . . 0.0 111.205 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.441 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 18.0 m -108.02 153.44 23.1 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 175.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -71.87 134.98 46.4 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.089 -0.645 . . . . 0.0 110.287 175.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.5 p -115.45 118.32 32.85 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 172.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.711 ' CZ ' ' HA ' ' A' ' 28' ' ' ASP . 32.5 ttt85 -91.23 111.39 22.85 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.071 -178.02 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -105.41 104.02 13.66 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 174.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 77.53 -78.38 1.48 Allowed Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 119.938 -1.125 . . . . 0.0 111.165 -175.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.711 ' HA ' ' CZ ' ' A' ' 25' ' ' ARG . 24.4 t70 -140.83 -34.85 0.5 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 176.41 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.524 ' O ' ' HA ' ' A' ' 25' ' ' ARG . 26.3 t70 -58.8 145.46 40.61 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.349 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.443 HH11 ' HD3' ' A' ' 30' ' ' ARG . 9.4 ptp180 -119.45 112.69 19.7 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.135 177.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -103.83 136.37 43.64 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.478 -172.167 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.2 t -75.47 106.63 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 169.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 40.2 p -121.25 131.75 54.4 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 119.841 -0.743 . . . . 0.0 110.938 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.415 HG22 ' H ' ' A' ' 34' ' ' THR . 1.5 t -72.84 116.57 13.5 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 169.791 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.83 177.9 7.15 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -174.48 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.523 ' HB3' ' OE1' ' A' ' 38' ' ' GLU . . . -66.36 161.09 23.27 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 119.267 -0.973 . . . . 0.0 109.257 178.254 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.416 ' HA ' ' HA ' ' A' ' 19' ' ' ALA . 2.3 pt-20 -80.44 -6.81 58.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -165.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.523 ' OE1' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -80.19 -30.42 38.76 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.118 173.089 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.65 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 30.3 mt-30 -80.46 97.25 7.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.119 179.323 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.26 11.31 33.09 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.411 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.839 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 18.0 mmt85 -129.33 179.37 5.82 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.437 0.637 . . . . 0.0 110.676 175.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.63 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 82.9 m -136.48 132.88 35.93 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.738 -171.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.401 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.3 OUTLIER -104.14 125.68 50.64 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.007 -172.185 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.828 ' HD2' ' HD3' ' A' ' 76' ' ' LYS . 49.7 t80 -141.15 124.88 16.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.572 172.435 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.513 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 41.4 t -121.54 140.53 45.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.366 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.743 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 10.0 mm100 -72.72 134.07 44.86 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.095 0.247 . . . . 0.0 110.875 178.552 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.503 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.2 mm? -129.95 143.93 51.03 Favored Pre-proline 0 C--N 1.326 -0.437 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 174.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 7.2 Cg_exo -75.19 28.54 0.37 Allowed 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 123.294 2.663 . . . . 0.0 113.226 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -172.13 -26.02 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.04 0.448 . . . . 0.0 111.088 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.503 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 70.2 m -149.7 -153.31 0.48 Allowed 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.512 ' O ' ' HD3' ' A' ' 25' ' ' ARG . 10.2 pt-20 -149.11 151.96 35.31 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.703 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 68.1 mt -101.93 131.09 50.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.049 175.24 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.401 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 39.1 mt-30 -138.87 130.73 27.78 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.737 ' HG2' ' HE2' ' A' ' 56' ' ' LYS . 2.9 tp10 -168.58 157.24 8.54 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 123.396 0.435 . . . . 0.0 109.863 -168.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 60.6 m -94.84 139.25 31.55 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 173.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.737 ' HE2' ' HG2' ' A' ' 54' ' ' GLU . 18.6 mmtt -147.0 149.41 33.09 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 176.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.65 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 68.3 p -66.48 153.16 43.6 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 175.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.687 HG22 ' HG2' ' A' ' 41' ' ' ARG . 19.9 t -48.67 -49.49 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 120.863 0.363 . . . . 0.0 110.63 -175.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -64.09 -57.08 10.65 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.766 -178.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.706 ' O ' HG13 ' A' ' 64' ' ' VAL . 96.2 mt-30 -63.75 -28.96 70.24 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.191 -175.079 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.674 ' HA ' HG22 ' A' ' 64' ' ' VAL . 5.4 t -71.36 -33.02 69.19 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.59 -35.95 70.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.079 0.466 . . . . 0.0 109.951 173.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.404 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 48.7 mt-10 -62.38 -52.28 64.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.573 175.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.706 HG13 ' O ' ' A' ' 60' ' ' GLN . 15.2 m -69.47 -26.65 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.615 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.417 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.576 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -58.08 -49.03 78.34 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 174.077 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -73.19 -33.87 65.65 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.009 -174.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.659 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.0 pt-20 -59.92 -42.7 94.49 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 119.826 -0.749 . . . . 0.0 110.132 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.503 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.2 m -80.01 -36.16 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 99.1 m -74.52 -29.19 61.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.34 -174.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.64 -21.95 64.44 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.561 174.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 67' ' ' GLU . 14.8 mt -79.14 -25.49 12.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 121.283 0.563 . . . . 0.0 109.91 177.134 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.437 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 113.88 11.39 12.69 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 119.811 -1.185 . . . . 0.0 111.972 -176.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -102.26 105.1 41.18 Favored Pre-proline 0 N--CA 1.451 -0.401 0 CA-C-O 120.658 0.266 . . . . 0.0 111.014 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.743 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 87.4 Cg_exo -52.18 128.56 27.7 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 123.377 2.718 . . . . 0.0 113.001 177.16 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.576 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -136.29 161.88 34.54 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.018 -0.673 . . . . 0.0 111.193 176.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.828 ' HD3' ' HD2' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -138.27 152.51 48.62 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.24 177.277 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.839 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 9.3 t -145.71 89.78 1.94 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.998 174.425 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 7.2 p -107.55 162.95 13.49 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.942 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.482 ' HB2' ' HD3' ' A' ' 41' ' ' ARG . 45.4 t -109.15 107.94 18.41 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.421 -174.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.486 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 9.7 tp10 171.26 150.79 0.05 OUTLIER 'General case' 0 C--O 1.237 0.444 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -178.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.65 ' HB3' HD22 ' A' ' 82' ' ' LEU . 96.4 m-20 -59.66 138.64 57.68 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 119.24 -0.984 . . . . 0.0 109.674 175.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.65 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.58 13.72 8.46 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.963 172.556 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 83' ' ' CYS . . . . . 0.486 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 7.8 t -71.86 -30.39 65.38 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.33 -173.283 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.565 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 28.2 p-10 -82.82 40.61 0.69 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.52 0.676 . . . . 0.0 110.362 179.066 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.492 ' HG2' ' N ' ' A' ' 86' ' ' SER . 35.3 ttp180 -72.61 162.97 28.79 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.274 -0.876 . . . . 0.0 109.844 178.269 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.503 ' HA ' ' CE1' ' A' ' 44' ' ' PHE . 5.7 p -60.5 148.59 37.19 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.272 173.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.439 ' OE2' ' HG2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -56.68 -37.09 70.38 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.36 -178.244 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.439 ' HG2' ' OE2' ' A' ' 87' ' ' GLU . 24.9 pt20 . . . . . 0 C--N 1.328 -0.333 0 CA-C-O 121.2 0.524 . . . . 0.0 111.036 176.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 13.8 tpt . . . . . 0 N--CA 1.481 1.083 0 CA-C-O 120.84 0.352 . . . . 0.0 110.069 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.418 ' HA ' ' O ' ' A' ' 35' ' ' CYS . . . 57.05 87.28 0.06 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.981 -176.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.451 HD23 HG22 ' A' ' 40' ' ' THR . 3.3 mm? -64.5 152.29 42.17 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.135 178.324 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.442 ' HB3' ' CG1' ' A' ' 32' ' ' VAL . 19.0 mtpp -120.95 116.39 25.02 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 119.605 -0.838 . . . . 0.0 111.075 177.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.3 m -140.13 170.09 16.48 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.577 176.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -76.84 132.2 39.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.825 -176.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.3 m -130.07 158.29 40.03 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 175.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.592 ' NH2' ' HA ' ' A' ' 28' ' ' ASP . 15.1 mmm180 -82.06 110.26 17.13 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.94 -179.052 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -117.21 103.97 10.71 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 176.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 69.75 -102.51 0.98 Allowed Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 119.77 -1.205 . . . . 0.0 110.52 -171.072 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.592 ' HA ' ' NH2' ' A' ' 25' ' ' ARG . 35.7 t70 -129.1 -4.07 5.03 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.611 0.719 . . . . 0.0 109.787 172.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -85.25 153.03 22.88 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.379 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 45.1 mtt180 -96.11 110.53 22.77 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.5 m -113.49 131.44 56.04 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.098 -170.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.442 ' CG1' ' HB3' ' A' ' 21' ' ' LYS . 98.7 t -73.04 105.38 2.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 174.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.5 p -94.82 149.88 20.78 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.622 0.725 . . . . 0.0 111.479 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -72.56 127.16 31.71 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 161.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.418 ' O ' ' HA ' ' A' ' 19' ' ' ALA . 0.8 OUTLIER -110.04 153.25 24.89 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 119.804 -0.758 . . . . 0.0 109.622 -179.252 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.82 164.99 11.33 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -172.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -58.21 -34.24 70.17 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.451 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.641 ' HG3' ' HG3' ' A' ' 39' ' ' GLN . 4.1 pt-20 -60.91 -38.57 86.19 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.42 0.629 . . . . 0.0 110.491 175.258 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.641 ' HG3' ' HG3' ' A' ' 38' ' ' GLU . 75.4 mt-30 -88.16 74.89 8.72 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.53 -174.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.451 HG22 HD23 ' A' ' 20' ' ' LEU . 0.9 OUTLIER -95.56 16.51 16.94 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.568 0.699 . . . . 0.0 110.33 177.734 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.877 ' HD3' HG22 ' A' ' 58' ' ' VAL . 0.6 OUTLIER -128.35 177.6 6.85 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.471 173.502 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.778 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.9 m -142.3 131.04 22.76 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.095 -178.225 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.498 HD22 HG23 ' A' ' 45' ' ' VAL . 0.2 OUTLIER -95.37 136.73 35.37 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.005 0.431 . . . . 0.0 110.722 -177.231 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.645 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 1.6 t80 -145.16 109.42 4.87 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.196 -0.911 . . . . 0.0 108.781 171.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.549 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 46.0 t -110.09 133.76 54.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.839 179.46 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.817 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 52.6 mm-40 -77.81 140.82 39.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.877 0.37 . . . . 0.0 110.431 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.2 mm? -128.23 152.17 77.43 Favored Pre-proline 0 C--N 1.319 -0.759 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.649 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -70.87 -11.18 29.03 Favored 'Trans proline' 0 CA--C 1.529 0.258 0 C-N-CA 122.391 2.061 . . . . 0.0 112.622 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -135.86 -0.56 2.55 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.52 0.2 . . . . 0.0 111.434 -177.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.598 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 32.6 p -169.57 -163.92 0.41 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -175.154 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -148.5 152.45 36.9 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 177.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.645 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 74.7 mt -105.61 130.4 57.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.368 176.4 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -139.28 131.32 27.93 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 177.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -167.71 162.07 13.75 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 123.376 0.423 . . . . 0.0 110.706 -178.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 13.3 m -89.12 134.07 34.15 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.128 -0.629 . . . . 0.0 109.465 172.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.4 tppt? -138.46 153.05 48.81 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -176.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.568 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 10.9 p -73.62 152.12 40.63 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 119.468 -0.893 . . . . 0.0 109.154 178.561 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.877 HG22 ' HD3' ' A' ' 41' ' ' ARG . 50.7 t -59.19 -41.54 84.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 120.653 0.263 . . . . 0.0 111.517 -175.424 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.611 ' HG3' ' N ' ' A' ' 60' ' ' GLN . 12.3 pt20 -69.05 -48.0 63.92 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.663 -177.407 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.627 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 10.7 mm-40 -69.33 -37.49 77.73 Favored 'General case' 0 C--O 1.211 -0.94 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -176.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.672 ' SG ' ' HG2' ' A' ' 41' ' ' ARG . 1.9 p -61.65 -32.7 72.88 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.485 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.9 -47.19 75.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.917 0.389 . . . . 0.0 110.567 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.627 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 8.9 pt-20 -71.55 -37.76 71.07 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.9 -176.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.653 HG22 ' HA ' ' A' ' 61' ' ' CYS . 12.1 m -73.59 -26.52 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 121.566 0.698 . . . . 0.0 110.479 176.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.579 HD12 ' HB3' ' A' ' 75' ' ' ALA . 50.4 tp -58.33 -49.75 76.07 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.108 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.543 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 41.7 mt-10 -74.33 -33.1 63.06 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.432 -175.335 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.623 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.4 pt-20 -60.31 -45.85 91.95 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 120.254 -0.578 . . . . 0.0 110.139 -179.374 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.586 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 35.0 m -79.9 -32.62 14.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 C-N-CA 120.743 -0.383 . . . . 0.0 111.944 -178.661 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.543 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 21.3 p -71.27 -26.23 62.8 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 120.394 -0.522 . . . . 0.0 110.875 -178.555 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.64 -22.76 61.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.488 175.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 67' ' ' GLU . 19.0 mt -83.6 -25.68 7.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.767 177.45 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 121.39 -0.61 11.39 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 119.858 -1.163 . . . . 0.0 112.508 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.407 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 90.6 m-85 -85.93 115.27 61.1 Favored Pre-proline 0 N--CA 1.451 -0.385 0 CA-C-N 116.519 0.159 . . . . 0.0 110.863 -179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.817 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 33.6 Cg_exo -63.65 133.16 38.21 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.768 2.312 . . . . 0.0 111.402 174.423 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.579 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -146.89 163.32 36.48 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.343 -0.543 . . . . 0.0 111.59 -179.068 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.472 ' CG ' ' HB3' ' A' ' 44' ' ' PHE . 15.5 ptpt -143.99 150.11 37.77 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.638 174.256 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.778 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 27.7 p -139.92 98.21 3.41 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.79 0.805 . . . . 0.0 109.182 161.046 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.2 p -107.61 164.41 12.25 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.782 -178.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 7.5 p -107.93 100.77 10.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.349 0.595 . . . . 0.0 109.517 -178.369 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.534 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 24.8 tt0 175.13 137.64 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 -172.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.653 ' CB ' HD22 ' A' ' 82' ' ' LEU . 16.5 m-20 -62.06 139.02 58.46 Favored 'General case' 0 CA--C 1.505 -0.758 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.952 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.653 HD22 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.65 13.99 8.71 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.862 174.362 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 83' ' ' CYS . . . . . 0.534 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 47.4 t -71.43 -19.85 62.19 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.823 0.344 . . . . 0.0 111.59 -174.006 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.475 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 22.8 p-10 -86.15 19.56 2.63 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.596 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.653 ' H ' ' HD3' ' A' ' 85' ' ' ARG . 0.0 OUTLIER -67.01 163.13 20.55 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.093 175.583 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.463 ' HA ' ' CE2' ' A' ' 44' ' ' PHE . 22.7 t -71.5 139.13 49.43 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.129 -0.629 . . . . 0.0 109.313 175.29 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -88.65 11.28 17.89 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.217 0.532 . . . . 0.0 110.29 -177.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.219 178.746 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 14.5 tpt . . . . . 0 N--CA 1.481 1.111 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -152.67 176.84 11.32 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.6 tp -141.35 130.52 23.44 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 176.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.5 mttt -82.22 141.27 33.13 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.972 178.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.567 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 6.6 t -161.66 153.89 19.7 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.602 -0.439 . . . . 0.0 109.851 -178.269 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -81.5 128.64 34.11 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.741 -0.383 . . . . 0.0 111.208 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 42.8 m -111.0 134.46 52.58 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 174.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.561 ' HD2' ' HB3' ' A' ' 30' ' ' ARG . 22.9 mmm-85 -85.08 111.53 19.84 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.827 -177.109 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -92.65 83.36 4.86 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 170.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 64.09 -107.52 1.83 Allowed Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 119.483 -1.341 . . . . 0.0 111.268 -170.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -89.73 -29.96 18.36 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.637 0.256 . . . . 0.0 110.538 177.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -69.86 150.27 46.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.907 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.561 ' HB3' ' HD2' ' A' ' 25' ' ' ARG . 2.2 ptt180 -127.74 113.09 15.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.125 169.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 94.2 m -99.12 138.4 36.27 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.827 -178.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 66.0 t -72.12 106.74 2.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 172.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.0 p -118.75 148.11 43.15 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.886 0.374 . . . . 0.0 111.266 -178.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.6 t -88.0 119.99 28.91 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 175.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.73 147.05 24.75 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 -177.379 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.82 166.57 19.09 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -172.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -55.75 -36.54 67.39 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.51 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.495 ' HG3' ' H ' ' A' ' 39' ' ' GLN . 2.9 pt-20 -50.57 -48.31 57.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.741 175.146 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.691 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 36.6 mt-30 -101.1 78.54 1.92 Allowed 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.141 -176.237 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.67 12.62 22.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.713 -175.601 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 1.011 ' HD3' ' SG ' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -121.51 177.94 5.01 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.377 0.608 . . . . 0.0 110.142 173.908 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.586 ' HB3' ' HB3' ' A' ' 84' ' ' ASN . 66.7 m -129.22 172.83 11.07 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.123 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.57 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.4 OUTLIER -127.98 113.34 15.71 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.533 176.508 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.665 ' HD2' ' HD2' ' A' ' 76' ' ' LYS . 2.6 t80 -124.8 99.52 6.19 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 172.056 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.608 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 19.2 t -104.34 133.0 49.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.054 -0.976 . . . . 0.0 108.741 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.822 ' CG ' ' HB2' ' A' ' 74' ' ' PRO . 0.8 OUTLIER -83.42 141.04 32.0 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 120.006 -0.677 . . . . 0.0 110.001 179.592 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.777 HD21 HG12 ' A' ' 52' ' ' ILE . 3.7 mm? -133.62 152.02 78.24 Favored Pre-proline 0 C--N 1.317 -0.817 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.29 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -78.57 3.22 7.43 Favored 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 122.755 2.303 . . . . 0.0 111.583 171.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -124.25 -31.99 3.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.875 -176.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.683 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 11.4 p -169.36 -154.95 0.13 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.636 -173.454 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.79 131.83 26.23 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.409 176.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.777 HG12 HD21 ' A' ' 47' ' ' LEU . 26.5 mm -82.54 129.12 37.99 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.204 176.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.629 ' HB3' ' ND2' ' A' ' 84' ' ' ASN . 6.5 mt-30 -135.84 131.85 35.87 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -167.25 150.21 6.26 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 123.529 0.518 . . . . 0.0 109.781 -170.037 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.567 ' SG ' ' HB3' ' A' ' 22' ' ' CYS . 6.4 m -93.01 132.39 37.15 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 172.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.453 ' HD3' ' HA ' ' A' ' 56' ' ' LYS . 3.3 tppt? -138.94 156.22 47.43 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 119.027 -1.069 . . . . 0.0 110.686 -178.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.691 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 35.4 p -66.28 153.41 42.67 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 177.551 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.622 ' HA ' ' HG3' ' A' ' 41' ' ' ARG . 20.9 t -59.29 -47.58 89.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 120.997 0.427 . . . . 0.0 110.663 -175.068 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -56.94 -55.72 30.9 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.054 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.59 ' O ' HG13 ' A' ' 64' ' ' VAL . 71.3 mt-30 -68.66 -25.56 64.87 Favored 'General case' 0 C--O 1.2 -1.552 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.605 -174.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.596 ' HA ' HG22 ' A' ' 64' ' ' VAL . 0.6 OUTLIER -63.35 -33.88 76.51 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.115 -0.634 . . . . 0.0 109.891 178.519 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.56 -39.62 73.84 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.091 0.472 . . . . 0.0 110.225 174.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -62.46 -52.42 63.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.834 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.633 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 16.2 m -68.71 -28.15 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.397 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 28.8 tp -58.02 -49.74 75.82 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 176.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.58 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 39.7 tt0 -73.88 -36.03 64.76 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.363 -175.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.633 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -58.24 -43.68 87.91 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.276 -177.182 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.544 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.0 m -79.7 -31.73 14.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 C-N-CA 120.48 -0.488 . . . . 0.0 111.714 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.58 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 37.7 p -72.98 -21.29 60.88 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.995 -179.235 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.09 -19.99 59.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.088 0.47 . . . . 0.0 110.27 176.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 10.7 mt -86.24 -15.92 9.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.334 176.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 108.9 -0.31 31.85 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.366 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -90.72 116.56 66.67 Favored Pre-proline 0 N--CA 1.448 -0.525 0 CA-C-O 120.692 0.282 . . . . 0.0 111.221 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.822 ' HB2' ' CG ' ' A' ' 46' ' ' GLN . 52.8 Cg_exo -58.24 140.66 95.13 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 123.169 2.579 . . . . 0.0 112.124 175.611 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.464 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -148.79 168.62 22.46 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.614 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.665 ' HD2' ' HD2' ' A' ' 44' ' ' PHE . 6.0 ptpp? -154.34 139.08 17.05 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.749 171.155 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 31.0 p -116.81 104.86 11.75 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 166.5 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.2 p -106.72 162.27 13.92 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 119.929 -0.708 . . . . 0.0 112.089 -178.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 1.011 ' SG ' ' HD3' ' A' ' 41' ' ' ARG . 33.6 m -109.24 101.57 10.58 Favored 'General case' 0 CA--C 1.523 -0.076 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.909 175.009 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.588 ' HB3' ' HB3' ' A' ' 83' ' ' CYS . 16.0 tt0 176.85 141.46 0.07 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -177.858 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.748 ' HB3' HD22 ' A' ' 82' ' ' LEU . 15.9 m-20 -58.64 129.55 42.62 Favored 'General case' 0 CA--C 1.503 -0.828 0 C-N-CA 119.641 -0.824 . . . . 0.0 110.095 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.748 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.3 OUTLIER 64.77 15.81 10.03 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.927 173.278 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 83' ' ' CYS . . . . . 0.588 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . 9.9 p -63.24 -22.33 66.8 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.896 0.379 . . . . 0.0 111.701 -171.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.629 ' ND2' ' HB3' ' A' ' 53' ' ' GLN . 35.9 p-10 -76.72 16.23 0.54 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.039 0.447 . . . . 0.0 111.116 -177.161 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.409 ' H ' ' C ' ' A' ' 83' ' ' CYS . 7.9 ptt180 -82.89 -34.4 26.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.085 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 52.2 m -154.42 -175.79 5.57 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.375 -174.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.413 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 41.5 mm-40 -63.83 -31.11 72.19 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.587 -177.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 17.8 mm100 . . . . . 0 N--CA 1.464 0.244 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.217 179.172 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 15.0 tpt . . . . . 0 N--CA 1.482 1.149 0 CA-C-O 120.331 0.11 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.28 146.0 39.25 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.161 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.428 ' HG ' ' N ' ' A' ' 21' ' ' LYS . 32.1 tp -139.95 170.05 16.57 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -178.165 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.428 ' N ' ' HG ' ' A' ' 20' ' ' LEU . 11.5 mtpt -125.89 114.15 18.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.04 177.149 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.599 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 12.9 m -128.43 158.5 38.15 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 174.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.43 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 15.6 m-85 -72.41 120.76 18.46 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.659 -0.416 . . . . 0.0 109.971 173.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 88.2 m -111.15 142.75 42.92 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 176.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.475 ' HA ' ' O ' ' A' ' 29' ' ' ASP . 8.8 mmm180 -84.52 110.58 18.79 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.883 -177.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -96.82 85.65 3.85 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 174.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 73.37 -105.71 1.83 Allowed Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 119.659 -1.257 . . . . 0.0 111.066 -172.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -102.09 -10.67 19.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.905 0.383 . . . . 0.0 110.149 177.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.475 ' O ' ' HA ' ' A' ' 25' ' ' ARG . 2.3 t70 -82.8 148.09 27.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.192 -178.081 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 -127.78 113.64 16.23 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.003 166.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.444 HG23 ' OD1' ' A' ' 29' ' ' ASP . 1.2 p -129.48 169.33 15.09 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.565 -178.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 53.8 t -72.11 121.24 22.01 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.408 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.2 p -123.14 132.59 54.13 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 119.994 -0.683 . . . . 0.0 110.674 174.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 t -76.42 113.97 14.6 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 170.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.76 170.23 11.4 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.878 -170.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.413 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -66.81 166.35 13.43 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.502 -179.335 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.06 -19.94 56.46 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.723 -166.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.42 ' HG2' HG22 ' A' ' 57' ' ' THR . 3.2 pm0 -81.96 -22.85 36.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.284 0.564 . . . . 0.0 109.611 176.153 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.455 ' OE1' ' HB2' ' A' ' 55' ' ' CYS . 8.3 mt-30 -72.89 121.55 20.2 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.193 176.506 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.541 ' OG1' HG23 ' A' ' 58' ' ' VAL . 0.5 OUTLIER -134.51 4.83 3.41 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.327 -0.852 . . . . 0.0 111.597 -170.39 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.763 ' CG ' ' HA ' ' A' ' 58' ' ' VAL . 6.1 mmm180 -138.49 178.48 7.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.633 0.73 . . . . 0.0 110.09 175.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.545 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 8.8 m -132.36 131.5 41.94 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 114.437 -1.256 . . . . 0.0 109.044 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.495 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.2 OUTLIER -91.75 130.44 37.54 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 121.031 -0.267 . . . . 0.0 110.306 179.504 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.798 ' HD2' ' HG3' ' A' ' 76' ' ' LYS . 57.1 t80 -128.45 100.9 5.96 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.28 170.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.613 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 16.8 t -99.44 129.95 49.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 174.735 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.896 ' HB3' ' HB2' ' A' ' 74' ' ' PRO . 3.0 tp60 -99.04 116.77 32.04 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.197 -178.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.67 HD21 HG12 ' A' ' 52' ' ' ILE . 1.8 mm? -114.94 156.93 44.5 Favored Pre-proline 0 C--N 1.327 -0.38 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 -176.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -75.49 18.98 0.55 Allowed 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 122.877 2.385 . . . . 0.0 112.391 175.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -136.55 -55.75 0.74 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.517 0.675 . . . . 0.0 109.44 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.607 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 41.5 p -148.26 -162.58 1.58 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.968 -1.015 . . . . 0.0 108.283 176.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.539 ' HA ' HD23 ' A' ' 47' ' ' LEU . 2.3 mp0 -131.14 147.32 52.59 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 118.434 -1.306 . . . . 0.0 110.9 177.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.67 HG12 HD21 ' A' ' 47' ' ' LEU . 52.0 mm -93.77 132.11 38.83 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.909 176.014 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.495 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 14.9 mt-30 -141.67 130.88 23.45 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 120.04 -0.664 . . . . 0.0 109.406 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.434 ' HB2' ' HZ2' ' A' ' 56' ' ' LYS . 2.6 pt-20 -163.03 153.87 16.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.245 -176.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.737 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 79.1 m -82.04 125.22 30.56 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.294 169.454 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.737 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 11.3 mptt -132.71 -179.17 5.3 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 173.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.516 ' HA ' ' H ' ' A' ' 40' ' ' THR . 16.1 p -86.06 169.05 13.52 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 119.274 -0.971 . . . . 0.0 108.744 177.402 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.763 ' HA ' ' CG ' ' A' ' 41' ' ' ARG . 66.8 t -61.16 -50.25 81.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 C-N-CA 119.583 -0.847 . . . . 0.0 110.102 178.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -56.53 -54.37 46.61 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.863 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.589 ' O ' HG22 ' A' ' 64' ' ' VAL . 17.9 mm-40 -58.91 -34.91 72.24 Favored 'General case' 0 C--O 1.204 -1.326 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.964 -177.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.563 ' HA ' HG22 ' A' ' 64' ' ' VAL . 0.5 OUTLIER -68.22 -34.21 75.82 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.055 -175.921 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.71 -35.8 67.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.347 0.594 . . . . 0.0 109.611 176.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.559 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 74.8 mt-10 -65.91 -52.02 53.64 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.814 -1.084 . . . . 0.0 110.943 178.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.624 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 33.4 m -68.44 -28.7 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.54 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.277 178.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.459 HD12 ' HB3' ' A' ' 75' ' ' ALA . 46.5 tp -58.03 -50.9 71.83 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 176.075 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.591 ' HA ' ' HG1' ' A' ' 69' ' ' THR . 40.8 tt0 -74.2 -33.88 63.55 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.183 -174.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.624 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -60.19 -44.61 94.95 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.313 -177.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.541 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 28.4 m -80.37 -28.42 11.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.938 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.591 ' HG1' ' HA ' ' A' ' 66' ' ' GLU . 31.0 p -75.48 -22.47 57.19 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.842 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.15 -18.43 61.88 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.184 0.516 . . . . 0.0 110.285 176.168 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 19.2 mt -86.37 -18.34 8.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.504 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 107.67 3.76 34.61 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.182 -1.008 . . . . 0.0 112.498 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 55.9 m-85 -90.24 134.11 32.02 Favored Pre-proline 0 N--CA 1.447 -0.603 0 CA-C-O 120.808 0.337 . . . . 0.0 111.478 -178.252 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.896 ' HB2' ' HB3' ' A' ' 46' ' ' GLN . 79.7 Cg_exo -56.17 130.79 42.06 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.598 2.865 . . . . 0.0 112.054 173.217 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.52 ' C ' ' HG2' ' A' ' 76' ' ' LYS . . . -149.16 156.63 42.46 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.711 -0.796 . . . . 0.0 111.861 179.166 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.798 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -153.85 155.52 35.91 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.243 174.943 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 26.9 p -137.46 115.72 11.79 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.627 0.727 . . . . 0.0 109.901 166.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.1 p -108.17 172.48 6.81 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.891 -176.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.435 ' HB2' ' CD ' ' A' ' 41' ' ' ARG . 52.9 t -131.14 100.97 5.39 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.13 178.158 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.599 ' HB3' ' HB3' ' A' ' 83' ' ' CYS . 14.1 tt0 174.81 148.73 0.08 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 -175.469 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.647 ' HB3' HD22 ' A' ' 82' ' ' LEU . 1.0 OUTLIER -55.93 124.02 16.27 Favored 'General case' 0 CA--C 1.509 -0.598 0 C-N-CA 119.805 -0.758 . . . . 0.0 110.365 179.079 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.647 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.1 OUTLIER 66.02 16.06 10.31 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.752 169.713 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 83' ' ' CYS . . . . . 0.599 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . 21.3 p -64.53 -29.57 70.6 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -171.385 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.454 ' ND2' ' HB3' ' A' ' 53' ' ' GLN . 29.5 p-10 -76.11 18.01 0.31 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.17 0.51 . . . . 0.0 110.773 -178.348 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.431 ' H ' ' C ' ' A' ' 83' ' ' CYS . 7.3 ptp85 -63.8 -29.89 71.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.164 171.609 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 45.3 m -156.75 -160.23 0.95 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.459 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.5 ' HG2' ' HD2' ' A' ' 76' ' ' LYS . 32.8 mt-10 -66.37 -52.94 41.73 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.291 175.35 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLN . . . . . 0.847 HE21 ' HA ' ' A' ' 88' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.449 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.878 177.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.482 1.137 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 178.28 154.89 0.37 Allowed 'General case' 0 CA--C 1.516 -0.336 0 O-C-N 123.894 0.746 . . . . 0.0 110.032 173.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.6 tp -124.6 145.4 49.63 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 173.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.541 ' HE2' HG12 ' A' ' 32' ' ' VAL . 36.6 mtpt -107.0 104.36 14.01 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 118.867 -1.133 . . . . 0.0 111.685 -177.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.5 m -103.47 152.46 21.63 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 176.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.499 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 58.5 m-85 -71.65 149.67 45.34 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.565 176.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -121.29 132.03 54.55 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.052 172.194 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -86.37 111.89 20.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.574 -175.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -144.69 112.43 6.25 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.194 -178.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 62.02 34.08 87.77 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.23 -0.986 . . . . 0.0 112.484 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.6 t70 68.04 1.43 2.76 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.841 0.857 . . . . 0.0 111.326 -176.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -85.33 151.14 24.26 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 169.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.425 ' HD3' HH11 ' A' ' 30' ' ' ARG . 8.7 ptp180 -116.57 110.79 19.01 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 119.07 -1.052 . . . . 0.0 108.623 174.355 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.9 m -93.98 127.95 40.04 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.645 -172.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.541 HG12 ' HE2' ' A' ' 21' ' ' LYS . 25.0 t -75.93 104.02 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 176.186 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.43 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 1.3 p -115.82 149.24 38.9 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.652 -174.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.7 t -90.4 136.43 33.06 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.851 178.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -127.37 148.85 50.26 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 -178.117 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.526 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -82.89 -176.75 6.47 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -168.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.36 -43.83 92.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.597 -1.183 . . . . 0.0 112.715 -173.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.601 ' OE2' ' HG3' ' A' ' 39' ' ' GLN . 4.2 pm0 -62.63 -24.47 67.61 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.019 0.438 . . . . 0.0 110.027 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.734 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 37.4 mt-30 -110.1 52.39 0.73 Allowed 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.876 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -79.85 25.64 0.35 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.145 0.498 . . . . 0.0 111.445 178.031 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.76 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 16.1 mmt85 -131.34 179.52 5.98 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.752 172.223 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.733 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 62.7 m -142.95 131.49 22.4 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.625 -174.008 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.423 HD23 ' SG ' ' A' ' 61' ' ' CYS . 0.5 OUTLIER -100.39 127.68 46.64 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.983 0.421 . . . . 0.0 111.103 -175.697 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.658 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 40.7 t80 -142.35 115.6 8.92 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.588 174.097 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.438 ' HA ' ' HA ' ' A' ' 75' ' ' ALA . 58.2 t -105.92 138.04 33.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 C-N-CA 120.452 -0.499 . . . . 0.0 109.895 179.095 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.732 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 7.4 mm100 -74.93 137.45 41.67 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 120.094 -0.642 . . . . 0.0 109.944 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.525 ' HB2' ' C ' ' A' ' 50' ' ' SER . 3.3 mm? -131.85 143.13 47.79 Favored Pre-proline 0 C--N 1.312 -1.03 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.015 171.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 12.0 Cg_exo -72.12 -3.33 13.09 Favored 'Trans proline' 0 CA--C 1.529 0.254 0 C-N-CA 122.836 2.357 . . . . 0.0 112.776 -179.068 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 28.4 p90 -149.65 5.91 0.62 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.951 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.525 ' C ' ' HB2' ' A' ' 47' ' ' LEU . 66.8 m -161.67 -162.09 0.84 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -176.193 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.419 ' OE1' ' HB3' ' A' ' 86' ' ' SER . 14.2 pt-20 -163.8 147.34 10.01 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 174.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.658 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 67.5 mt -106.07 136.85 38.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 177.722 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -146.83 129.9 16.42 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -177.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.553 ' HG3' ' HE2' ' A' ' 56' ' ' LYS . 7.0 pt-20 -179.26 157.26 0.8 Allowed 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.558 0.536 . . . . 0.0 109.965 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 2.8 m -81.34 141.4 34.06 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 119.809 -0.756 . . . . 0.0 109.121 175.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.553 ' HE2' ' HG3' ' A' ' 54' ' ' GLU . 69.6 mmtt -135.87 155.09 50.85 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.734 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 27.7 p -68.83 146.09 53.16 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 118.697 -1.201 . . . . 0.0 108.792 176.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.573 HG22 ' HG2' ' A' ' 41' ' ' ARG . 29.8 t -46.37 -54.73 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 O-C-N 123.461 0.476 . . . . 0.0 111.377 -173.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -63.09 -55.85 21.89 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.586 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.747 ' O ' HG13 ' A' ' 64' ' ' VAL . 99.1 mt-30 -64.51 -26.58 68.49 Favored 'General case' 0 C--O 1.204 -1.317 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.495 -174.278 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.691 ' HA ' HG22 ' A' ' 64' ' ' VAL . 8.7 t -71.77 -33.63 68.78 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 177.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.07 -34.5 73.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.085 0.469 . . . . 0.0 109.867 172.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -64.97 -51.24 62.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.664 176.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.747 HG13 ' O ' ' A' ' 60' ' ' GLN . 14.1 m -67.49 -27.06 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.251 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.691 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.48 -49.26 76.86 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 173.443 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -73.33 -34.16 65.53 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.144 -174.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.646 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.9 pt-20 -60.15 -42.15 94.3 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 120.034 -0.667 . . . . 0.0 110.068 -178.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.506 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.5 m -79.91 -36.67 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 CA-C-O 120.779 0.323 . . . . 0.0 111.796 179.193 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 96.0 m -71.98 -29.46 64.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.206 -175.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.94 -23.75 64.19 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.562 174.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.515 HG13 ' O ' ' A' ' 67' ' ' GLU . 18.6 mt -79.11 -26.02 13.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.323 0.582 . . . . 0.0 109.739 176.388 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.486 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 114.25 2.11 23.33 Favored Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 119.838 -1.172 . . . . 0.0 112.035 -177.139 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -96.03 107.31 33.89 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-O 120.555 0.217 . . . . 0.0 110.602 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.732 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 77.8 Cg_exo -56.74 134.65 65.82 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 123.257 2.638 . . . . 0.0 112.979 178.583 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.691 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -130.79 161.25 32.15 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.847 174.14 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -130.05 140.06 50.9 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.533 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.76 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 6.1 t -150.72 109.65 3.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.137 0.494 . . . . 0.0 109.793 173.459 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.3 p -136.43 172.3 13.22 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.321 -171.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.584 ' SG ' ' HD3' ' A' ' 41' ' ' ARG . 55.7 m -107.88 101.9 11.14 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.074 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.484 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 7.5 tp10 179.06 142.15 0.12 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -176.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.714 ' HB3' HD22 ' A' ' 82' ' ' LEU . 43.7 m-20 -62.9 137.95 58.41 Favored 'General case' 0 CA--C 1.505 -0.776 0 C-N-CA 118.278 -1.369 . . . . 0.0 109.349 177.103 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.714 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 62.68 21.75 12.92 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.902 175.292 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 83' ' ' CYS . . . . . 0.484 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 6.4 t -69.62 -31.17 69.14 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.68 -174.574 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.634 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 28.7 p-10 -79.21 73.56 5.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 122.202 1.001 . . . . 0.0 108.909 174.353 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' A' ' 82' ' ' LEU . 20.3 ttm180 -116.9 154.19 31.25 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.496 -168.007 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.419 ' HB3' ' OE1' ' A' ' 51' ' ' GLU . 14.8 p -73.05 95.61 2.05 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.171 176.566 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.62 -32.54 11.03 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.635 -177.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 . . . . . 0 N--CA 1.472 0.647 0 O-C-N 123.935 0.772 . . . . 0.0 112.381 177.166 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.424 ' N ' ' SD ' ' A' ' 18' ' ' MET . 0.8 OUTLIER . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 120.829 0.347 . . . . 0.0 110.772 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.433 ' HB1' ' O ' ' A' ' 35' ' ' CYS . . . -52.36 132.04 33.91 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.537 176.32 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 35.6 tp -106.61 144.17 33.66 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -177.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.523 ' HG2' ' HB ' ' A' ' 34' ' ' THR . 33.4 mtmm -102.25 114.24 28.23 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.021 -178.636 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 18.0 m -113.46 173.42 6.42 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.612 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 46.2 m-85 -82.95 136.08 34.67 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 173.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.7 p -116.24 130.53 56.83 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 173.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.499 ' HA ' ' O ' ' A' ' 29' ' ' ASP . 7.8 tpt180 -97.04 110.99 23.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.536 -176.562 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -140.01 130.41 25.4 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.418 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 65.14 22.11 68.66 Favored Glycine 0 C--O 1.229 -0.214 0 C-N-CA 119.554 -1.308 . . . . 0.0 111.203 -173.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.1 t70 64.83 15.28 9.76 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.111 0.964 . . . . 0.0 111.224 -175.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.499 ' O ' ' HA ' ' A' ' 25' ' ' ARG . 11.9 t70 -94.33 150.18 20.53 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 171.119 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.424 ' HB3' ' OE1' ' A' ' 53' ' ' GLN . 30.2 ptt180 -114.83 111.7 21.62 Favored 'General case' 0 C--N 1.32 -0.681 0 C-N-CA 119.137 -1.025 . . . . 0.0 109.749 176.055 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -113.09 146.72 38.68 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.929 -173.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.408 HG13 HD11 ' A' ' 82' ' ' LEU . 94.4 t -80.96 108.11 13.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.029 175.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.1 p -119.4 148.37 43.29 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.853 0.359 . . . . 0.0 110.271 176.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.523 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 3.1 t -91.63 115.59 28.17 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.094 -0.642 . . . . 0.0 109.87 177.647 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.433 ' O ' ' HB1' ' A' ' 19' ' ' ALA . 0.2 OUTLIER -87.98 160.44 17.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.41 -0.813 . . . . 0.0 109.186 -176.74 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.546 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -74.89 -179.19 4.1 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.243 -0.583 . . . . 0.0 112.423 -169.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -63.83 -37.26 86.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.377 -172.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.546 ' OE2' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -76.11 -25.84 55.81 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.254 -174.028 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.641 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 40.4 mt-30 -98.24 80.68 2.69 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.366 0.603 . . . . 0.0 110.392 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.54 21.29 9.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.261 -0.882 . . . . 0.0 112.103 -176.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.827 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 15.8 mmt85 -126.82 179.69 5.25 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 119.956 -0.698 . . . . 0.0 109.947 171.126 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.699 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 63.8 m -139.73 131.88 28.09 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.54 -173.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.498 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 1.0 OUTLIER -103.69 130.64 51.2 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.673 0.273 . . . . 0.0 111.081 -171.899 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.725 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 1.2 t80 -146.75 104.05 3.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.331 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.584 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 46.3 t -102.48 136.14 36.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.922 178.547 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.782 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 10.5 mm100 -76.59 140.24 40.97 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.962 0.41 . . . . 0.0 110.791 -178.766 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.519 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.0 mm? -132.09 153.95 81.51 Favored Pre-proline 0 C--N 1.321 -0.656 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 174.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -74.63 18.17 0.52 Allowed 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 122.941 2.427 . . . . 0.0 113.018 179.347 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -160.46 -48.31 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.929 0.395 . . . . 0.0 110.634 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.519 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 20.5 m -120.55 -153.17 0.53 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.74 178.668 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -155.64 144.61 20.63 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.725 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 69.1 mt -89.84 128.95 41.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.381 -0.527 . . . . 0.0 109.761 176.495 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.498 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 49.0 mt-30 -139.48 131.53 27.94 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -177.759 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.909 ' HG2' ' HE2' ' A' ' 56' ' ' LYS . 1.1 tp10 -170.42 153.89 4.51 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -168.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 4.9 m -93.17 128.41 39.11 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 119.689 -0.805 . . . . 0.0 108.895 173.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.909 ' HE2' ' HG2' ' A' ' 54' ' ' GLU . 57.8 mmtt -131.12 147.65 52.64 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.641 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 46.0 p -62.8 153.67 32.25 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 174.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.634 HG22 ' HG2' ' A' ' 41' ' ' ARG . 40.9 t -49.67 -48.15 21.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 123.238 0.336 . . . . 0.0 110.87 -176.184 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -65.83 -56.11 13.57 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.464 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.7 ' O ' HG13 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -58.43 -34.12 70.45 Favored 'General case' 0 C--O 1.21 -0.995 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.803 -175.998 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.697 ' HA ' HG22 ' A' ' 64' ' ' VAL . 4.3 t -72.6 -33.4 66.68 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.613 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.85 -36.76 73.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.276 0.56 . . . . 0.0 109.698 173.465 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.565 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 92.6 mt-10 -59.99 -52.8 63.83 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.459 175.614 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.7 HG13 ' O ' ' A' ' 60' ' ' GLN . 17.9 m -70.38 -27.41 31.56 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.618 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.615 -178.81 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.683 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -59.3 -50.63 73.24 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 175.847 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -73.85 -33.28 64.04 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.944 -173.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.607 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.9 pt-20 -60.28 -43.31 96.35 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.097 -179.234 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.514 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.0 m -79.76 -35.86 16.77 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.738 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 99.4 m -71.84 -27.71 63.07 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.983 -176.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.18 -23.52 61.28 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.484 173.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.597 HG13 ' O ' ' A' ' 67' ' ' GLU . 43.6 mt -78.21 -32.49 17.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.342 0.592 . . . . 0.0 109.971 177.035 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.486 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 121.0 2.34 11.19 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.21 -0.995 . . . . 0.0 111.757 -176.437 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -97.86 106.61 35.18 Favored Pre-proline 0 N--CA 1.448 -0.53 0 CA-C-O 120.629 0.252 . . . . 0.0 110.824 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.782 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 79.2 Cg_exo -54.61 133.83 58.98 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 123.183 2.589 . . . . 0.0 112.846 177.219 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.683 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -130.49 157.13 43.5 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.234 -0.587 . . . . 0.0 110.937 174.248 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.1 mmtp -128.69 143.09 50.86 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.535 -179.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.827 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 8.4 t -156.27 112.29 3.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.919 0.39 . . . . 0.0 110.392 176.432 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 3.8 p -143.77 173.28 11.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.002 -174.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.582 ' SG ' ' HD3' ' A' ' 41' ' ' ARG . 57.6 m -108.07 104.09 13.45 Favored 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.514 -175.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.475 ' HG3' ' HB2' ' A' ' 83' ' ' CYS . 0.0 OUTLIER 177.22 161.72 0.46 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 173.557 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.699 ' HB3' HD22 ' A' ' 82' ' ' LEU . 56.7 m-20 -68.22 135.24 51.7 Favored 'General case' 0 CA--C 1.501 -0.915 0 C-N-CA 117.023 -1.871 . . . . 0.0 109.558 -179.651 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.701 ' O ' ' HB2' ' A' ' 85' ' ' ARG . 0.2 OUTLIER 63.9 22.21 12.92 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.626 175.364 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 83' ' ' CYS . . . . . 0.475 ' HB2' ' HG3' ' A' ' 80' ' ' GLU . 4.3 t -64.5 -27.61 69.09 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.891 0.377 . . . . 0.0 111.049 -174.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.653 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 27.7 p-10 -78.27 70.07 4.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 122.419 1.104 . . . . 0.0 108.677 172.591 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.701 ' HB2' ' O ' ' A' ' 82' ' ' LEU . 30.4 ttp180 -117.94 133.87 55.5 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 113.963 -1.471 . . . . 0.0 111.088 -166.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.418 ' HA ' ' CZ ' ' A' ' 44' ' ' PHE . 0.9 OUTLIER -64.41 143.3 58.0 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.78 -1.1 . . . . 0.0 111.383 -176.2 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -70.75 -47.91 57.18 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 176.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 . . . . . 0 N--CA 1.471 0.614 0 O-C-N 124.341 1.026 . . . . 0.0 112.849 173.573 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 91.0 mtp . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 110.356 -0.238 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.499 ' HB1' ' O ' ' A' ' 35' ' ' CYS . . . -63.79 121.11 13.22 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 123.687 0.617 . . . . 0.0 110.9 176.273 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.652 HD21 ' H ' ' A' ' 80' ' ' GLU . 21.8 tp -103.24 117.51 34.68 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -177.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.615 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 28.8 mtmm -82.67 114.76 21.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.267 0.556 . . . . 0.0 111.403 -175.741 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.7 m -113.27 162.57 15.87 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.794 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.493 ' CD1' ' HB2' ' A' ' 85' ' ' ARG . 34.7 m-85 -79.33 138.87 37.88 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.618 176.581 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 32.2 m -129.0 131.83 47.46 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.3 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.71 HH11 ' HB2' ' A' ' 51' ' ' GLU . 30.8 mtp180 -88.52 111.44 21.85 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 119.923 -0.711 . . . . 0.0 111.749 -176.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -110.18 118.65 36.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.121 174.711 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.51 -77.1 2.01 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 119.618 -1.277 . . . . 0.0 110.958 -174.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -150.2 -45.16 0.13 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.656 0.265 . . . . 0.0 110.619 174.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.435 ' O ' ' HA ' ' A' ' 25' ' ' ARG . 2.1 p-10 -65.08 171.28 3.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.346 0.593 . . . . 0.0 110.725 -177.466 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -120.64 113.9 20.92 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 119.774 -0.771 . . . . 0.0 109.33 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.5 m -100.63 145.15 28.75 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.731 -175.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 96.8 t -72.46 106.93 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 31.2 p -104.26 137.4 42.23 Favored 'General case' 0 C--N 1.314 -0.955 0 C-N-CA 120.069 -0.652 . . . . 0.0 110.346 175.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.615 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.7 t -86.37 111.99 21.03 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 121.634 0.73 . . . . 0.0 109.404 176.14 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.499 ' O ' ' HB1' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -89.28 172.88 8.72 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.089 -173.017 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.89 166.35 20.98 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.291 -0.564 . . . . 0.0 111.147 -175.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -51.98 -26.98 11.8 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.37 176.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.485 ' HG2' ' CG2' ' A' ' 57' ' ' THR . 27.6 tt0 -62.62 -39.68 94.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.012 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.47 ' HG3' ' CB ' ' A' ' 55' ' ' CYS . 16.5 mm-40 -82.04 100.66 9.86 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 118.904 -1.118 . . . . 0.0 109.675 -178.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.422 ' OG1' HG23 ' A' ' 58' ' ' VAL . 0.7 OUTLIER -101.58 21.71 13.9 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.591 0.71 . . . . 0.0 110.04 175.537 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.903 ' HG3' ' HB2' ' A' ' 77' ' ' CYS . 1.2 tpt180 -152.4 177.76 10.26 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.741 -176.524 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.611 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 79.4 m -141.34 131.88 25.41 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 179.537 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.406 HD22 HG23 ' A' ' 45' ' ' VAL . 0.3 OUTLIER -94.93 130.47 41.55 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 -178.881 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.493 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 18.6 t80 -139.54 113.51 8.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.86 170.318 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.645 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 22.0 t -108.72 133.84 52.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 176.634 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.882 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -90.03 132.36 35.42 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 119.397 -0.921 . . . . 0.0 110.455 177.296 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.63 HD21 HG12 ' A' ' 52' ' ' ILE . 3.5 mm? -121.06 152.03 56.12 Favored Pre-proline 0 C--N 1.319 -0.739 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -66.51 -17.25 53.04 Favored 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.46 2.106 . . . . 0.0 112.713 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -134.93 -2.43 2.6 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.526 -177.182 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.604 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 49.1 m -157.97 -168.61 2.56 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.188 -174.77 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.71 ' HB2' HH11 ' A' ' 25' ' ' ARG . 18.4 mt-10 -147.01 148.06 31.31 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 176.1 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.645 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 26.8 mm -109.28 129.18 64.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 175.484 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.529 ' NE2' ' HA ' ' A' ' 85' ' ' ARG . 51.2 mt-30 -140.93 130.27 23.7 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.171 -0.612 . . . . 0.0 110.203 179.37 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.11 158.03 24.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.661 -179.328 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.512 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 8.3 m -80.42 118.34 21.96 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 166.589 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.512 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 12.1 mptt -124.25 147.88 47.76 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.605 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.485 ' CG2' ' HG2' ' A' ' 38' ' ' GLU . 18.2 p -68.34 164.3 21.14 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.422 HG23 ' OG1' ' A' ' 40' ' ' THR . 57.8 t -59.1 -43.27 88.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 119.261 -0.976 . . . . 0.0 110.33 177.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -64.09 -54.57 31.86 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.748 179.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.646 ' O ' HG13 ' A' ' 64' ' ' VAL . 33.6 tt0 -61.58 -32.8 72.91 Favored 'General case' 0 C--O 1.206 -1.219 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.247 -174.37 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.693 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 0.6 OUTLIER -66.12 -33.42 75.74 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.13 -0.628 . . . . 0.0 110.18 178.845 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.91 -41.54 74.55 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.043 0.449 . . . . 0.0 109.943 174.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.538 ' OE2' ' HA ' ' A' ' 60' ' ' GLN . 44.9 mt-10 -56.53 -53.34 58.65 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.545 176.503 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.646 HG13 ' O ' ' A' ' 60' ' ' GLN . 15.3 m -73.77 -27.63 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.656 0 CA-C-N 114.659 -1.155 . . . . 0.0 111.693 -176.431 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.693 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 6.7 tp -59.78 -50.5 73.58 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 179.144 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -74.72 -34.99 62.67 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.465 -0.788 . . . . 0.0 112.218 -176.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.632 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.4 pt-20 -58.0 -47.27 83.52 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.529 -177.754 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.602 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 33.4 m -80.54 -34.13 14.2 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.833 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 32.5 m -72.16 -23.89 61.35 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 120.606 -0.438 . . . . 0.0 111.157 -177.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.39 -21.35 62.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.119 0.485 . . . . 0.0 110.099 174.073 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 67' ' ' GLU . 12.2 mt -86.99 -19.2 8.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.542 176.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 111.18 12.57 15.25 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.09 -1.052 . . . . 0.0 112.362 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 52.5 m-85 -98.65 118.66 62.8 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 120.911 0.386 . . . . 0.0 111.289 -178.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.882 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 46.4 Cg_exo -64.23 123.3 11.62 Favored 'Trans proline' 0 CA--C 1.519 -0.232 0 C-N-CA 123.585 2.857 . . . . 0.0 112.569 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -135.59 155.76 49.95 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 120.481 -0.487 . . . . 0.0 111.509 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.541 ' HD3' HE22 ' A' ' 46' ' ' GLN . 0.0 OUTLIER -139.75 152.06 46.31 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.348 0.594 . . . . 0.0 111.278 172.977 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.903 ' HB2' ' HG3' ' A' ' 41' ' ' ARG . 2.6 p -129.73 115.89 17.97 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.695 161.311 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.6 p -106.56 159.01 16.5 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.798 176.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.436 ' SG ' ' CD ' ' A' ' 41' ' ' ARG . 28.2 m -108.81 101.17 10.3 Favored 'General case' 0 CA--C 1.521 -0.135 0 C-N-CA 120.282 -0.567 . . . . 0.0 109.7 177.17 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.652 ' H ' HD21 ' A' ' 20' ' ' LEU . 9.0 tp10 173.74 144.16 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.669 ' HB3' HD22 ' A' ' 82' ' ' LEU . 58.5 m-20 -60.14 139.73 57.34 Favored 'General case' 0 CA--C 1.511 -0.519 0 C-N-CA 118.937 -1.105 . . . . 0.0 109.614 177.064 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.669 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 66.73 13.88 9.55 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.51 170.9 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 83' ' ' CYS . . . . . 0.499 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . 9.2 p -77.91 -32.33 51.64 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.268 -173.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.555 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 22.1 p-10 -80.03 18.64 0.8 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.935 0.397 . . . . 0.0 111.157 -174.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.529 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 9.6 ttm180 -92.56 -50.23 5.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.436 -176.197 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.4 p -157.04 120.12 4.07 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.379 -174.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -87.86 -23.67 23.91 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.113 0.482 . . . . 0.0 110.465 178.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.175 178.362 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 27.0 ttt . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 110.381 -0.229 . . . . 0.0 110.381 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.93 124.95 24.42 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.864 176.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.0 tp -111.28 158.26 19.2 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.165 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.476 ' O ' HD13 ' A' ' 82' ' ' LEU . 9.4 mtmp? -113.45 109.12 18.16 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 119.643 -0.823 . . . . 0.0 111.056 175.767 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 19.6 m -112.29 154.67 25.3 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 175.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.571 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 11.6 m-85 -70.48 134.11 47.44 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.825 -0.75 . . . . 0.0 109.93 175.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.5 m -132.07 129.33 39.85 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.218 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.801 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 1.9 mtt-85 -83.44 109.77 17.61 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 119.579 -0.848 . . . . 0.0 109.747 175.703 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -136.92 143.14 42.77 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 178.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 75.1 -71.73 1.7 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 119.217 -1.468 . . . . 0.0 109.6 -168.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -144.57 -87.45 0.12 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 166.105 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.428 ' HA ' ' NE ' ' A' ' 25' ' ' ARG . 2.9 t70 -86.02 178.42 7.26 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.676 0.751 . . . . 0.0 112.334 -172.191 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.801 ' HG3' ' HG3' ' A' ' 25' ' ' ARG . 0.8 OUTLIER -76.19 136.84 39.74 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.64 -1.164 . . . . 0.0 112.485 -171.798 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.493 HG23 HG23 ' A' ' 33' ' ' THR . 12.2 t -127.53 162.75 25.69 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 169.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 48.7 t -74.6 106.26 4.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.289 -0.564 . . . . 0.0 109.836 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.493 HG23 HG23 ' A' ' 31' ' ' THR . 27.1 p -115.69 147.78 40.47 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.152 0.501 . . . . 0.0 111.389 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.4 t -105.37 126.75 52.47 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.4 176.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 5.4 p -91.65 176.63 6.47 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 177.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.29 -176.81 6.3 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.154 -0.618 . . . . 0.0 111.793 -172.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 -61.66 -32.28 72.44 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -172.573 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.453 ' HG2' HG22 ' A' ' 57' ' ' THR . 10.2 pm0 -77.21 -23.32 51.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.834 0.349 . . . . 0.0 111.176 -176.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.606 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 69.0 mt-30 -92.93 109.06 20.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.141 0.496 . . . . 0.0 110.152 -178.353 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.34 5.16 10.22 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.768 -174.785 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.617 ' HG2' HG22 ' A' ' 58' ' ' VAL . 10.0 mmm180 -130.44 -179.68 5.41 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-O 121.617 0.722 . . . . 0.0 110.032 174.577 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.568 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 40.4 m -126.51 150.33 48.82 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.245 -177.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.503 ' HB2' ' CG ' ' A' ' 56' ' ' LYS . 0.2 OUTLIER -109.01 122.34 47.05 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.87 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.613 ' HB2' ' HB2' ' A' ' 84' ' ' ASN . 52.6 t80 -131.93 117.95 19.14 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.015 175.059 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.544 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 42.2 t -116.46 130.02 71.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 177.765 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.781 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 2.6 mm100 -75.63 141.25 42.86 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 119.73 -0.788 . . . . 0.0 109.932 178.442 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.531 HD21 HG12 ' A' ' 52' ' ' ILE . 2.5 mm? -138.86 155.82 72.96 Favored Pre-proline 0 C--N 1.318 -0.785 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 172.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -85.82 11.27 3.38 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.494 2.129 . . . . 0.0 111.37 171.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -128.38 -64.56 0.94 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.877 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.451 ' O ' HD23 ' A' ' 47' ' ' LEU . 20.6 t -152.94 132.22 12.79 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 177.006 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.457 ' HA ' HD23 ' A' ' 47' ' ' LEU . 0.9 OUTLIER -77.11 148.63 35.93 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.425 -173.783 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.544 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 38.5 mm -88.65 131.69 35.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.176 177.52 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.585 ' OE1' ' HD3' ' A' ' 30' ' ' ARG . 17.4 mt-30 -144.57 130.39 19.22 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.344 -0.543 . . . . 0.0 110.166 -178.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.429 ' HG3' ' HE2' ' A' ' 56' ' ' LYS . 10.7 pt-20 -175.79 170.74 2.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.423 -178.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.453 ' HB3' ' OE1' ' A' ' 39' ' ' GLN . 8.1 t -92.33 148.92 21.75 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 119.665 -0.814 . . . . 0.0 109.699 177.179 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.503 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 56.6 mmtt -142.08 162.41 35.53 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 176.395 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.606 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 29.3 p -72.34 160.32 32.56 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 172.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.617 HG22 ' HG2' ' A' ' 41' ' ' ARG . 22.0 t -59.12 -39.38 78.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 C-N-CA 120.029 -0.669 . . . . 0.0 109.637 -179.396 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.469 ' O ' ' HG3' ' A' ' 63' ' ' GLU . 41.3 tp60 -62.53 -56.12 20.99 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.697 177.832 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.57 ' O ' HG13 ' A' ' 64' ' ' VAL . 34.8 tt0 -69.75 -30.93 68.63 Favored 'General case' 0 C--O 1.203 -1.351 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.633 -173.097 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.492 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.7 p -65.15 -33.21 75.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 179.111 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.29 -45.87 65.46 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 173.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.542 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 75.7 mt-10 -54.91 -52.32 63.28 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.294 178.604 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.64 ' HA ' ' HG2' ' A' ' 67' ' ' GLU . 27.6 m -68.98 -30.42 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.528 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.481 -177.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.5 tp -62.59 -49.61 74.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.46 174.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -74.2 -31.44 62.64 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -176.552 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.64 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.6 pt-20 -63.35 -45.61 90.43 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.38 -177.006 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.56 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 29.3 m -79.34 -31.8 14.55 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 C-N-CA 120.279 -0.568 . . . . 0.0 111.335 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 85.5 m -66.41 -31.37 72.09 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 120.935 0.398 . . . . 0.0 110.484 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.0 -23.95 65.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.612 176.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.416 HG13 ' O ' ' A' ' 67' ' ' GLU . 16.0 mt -86.43 -20.63 7.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.959 178.639 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 114.95 -4.21 22.53 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.094 -1.05 . . . . 0.0 112.362 -178.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -91.91 114.71 62.9 Favored Pre-proline 0 N--CA 1.448 -0.554 0 CA-C-O 120.658 0.266 . . . . 0.0 110.926 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.781 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 51.6 Cg_exo -59.25 128.8 28.81 Favored 'Trans proline' 0 C--O 1.232 0.212 0 C-N-CA 123.177 2.585 . . . . 0.0 113.09 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.489 ' C ' ' HG2' ' A' ' 76' ' ' LYS . . . -126.53 165.56 18.9 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.451 173.783 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.563 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 0.9 OUTLIER -145.71 118.66 8.75 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.118 -178.115 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.568 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 1.4 t -104.31 106.79 17.42 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.248 0.547 . . . . 0.0 110.078 171.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 54.0 t -110.91 160.86 16.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.226 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.541 ' HB2' ' HD2' ' A' ' 41' ' ' ARG . 36.3 t -125.84 100.09 6.24 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 175.501 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.587 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 3.5 tm-20 171.53 149.79 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 105.681 -1.97 . . . . 0.0 105.681 -173.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.765 ' HB3' HD22 ' A' ' 82' ' ' LEU . 35.3 m-20 -65.38 135.43 55.26 Favored 'General case' 0 CA--C 1.504 -0.793 0 C-N-CA 117.368 -1.733 . . . . 0.0 110.9 -172.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.775 ' O ' ' HD3' ' A' ' 85' ' ' ARG . 0.2 OUTLIER 65.82 1.95 2.0 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.839 173.603 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 83' ' ' CYS . . . . . 0.587 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 16.9 t -54.94 -18.71 5.34 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -167.296 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.613 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 27.9 p-10 -78.36 37.77 0.28 Allowed 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.469 175.404 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.775 ' HD3' ' O ' ' A' ' 82' ' ' LEU . 0.7 OUTLIER -67.62 159.95 28.87 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.23 174.189 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.5 m -72.62 91.0 1.4 Allowed 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 174.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 52.94 81.01 0.09 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.712 -174.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 . . . . . 0 C--O 1.235 0.297 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.713 -179.721 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 26.7 ptm . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.67 151.52 30.46 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.045 -176.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 55.5 tp -110.9 129.74 55.79 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 34' ' ' THR . 30.8 mtmm -89.46 139.04 30.92 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.986 -179.392 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.563 ' HA ' HD23 ' A' ' 82' ' ' LEU . 2.7 m -152.9 166.72 31.44 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.591 173.043 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -76.36 121.61 23.26 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.384 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' A' ' 54' ' ' GLU . 67.6 m -115.26 144.0 44.4 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 174.35 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.488 HH12 ' CD ' ' A' ' 51' ' ' GLU . 3.5 tpt180 -83.4 110.33 18.06 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.89 0.376 . . . . 0.0 111.12 -174.445 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -97.82 85.57 3.57 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 174.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 68.96 -109.64 3.0 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 119.816 -1.183 . . . . 0.0 111.284 -173.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 -93.05 -34.97 13.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.634 0.254 . . . . 0.0 110.346 177.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -71.24 154.85 41.34 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.954 -177.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.599 ' HD2' ' OE1' ' A' ' 53' ' ' GLN . 69.3 mtm180 -116.05 112.69 22.13 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 175.176 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.5 m -108.36 138.49 44.57 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.535 -169.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.695 HG13 HD21 ' A' ' 82' ' ' LEU . 94.3 t -74.52 106.09 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 173.093 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.42 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 42.8 p -113.79 143.14 45.14 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.915 -178.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.424 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.9 t -93.05 111.95 23.75 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 175.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 37.0 m -108.0 155.99 19.73 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.742 -173.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.59 ' HB3' ' HG2' ' A' ' 38' ' ' GLU . . . -74.99 172.06 12.98 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -166.536 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -57.94 -27.44 63.39 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.419 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.59 ' HG2' ' HB3' ' A' ' 36' ' ' ALA . 4.8 pt-20 -52.47 -45.03 65.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.365 0.603 . . . . 0.0 110.203 173.558 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.653 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 41.9 mt-30 -102.44 72.78 1.28 Allowed 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.843 -177.242 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.11 9.73 18.94 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.318 -177.657 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.547 ' HB2' ' HA ' ' A' ' 58' ' ' VAL . 2.4 tpt180 -123.8 174.89 7.22 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 173.526 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.725 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 57.9 m -142.08 131.67 23.95 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 120.516 -0.474 . . . . 0.0 109.765 -175.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.526 HD22 HG23 ' A' ' 45' ' ' VAL . 0.3 OUTLIER -91.14 131.39 36.73 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.84 -174.985 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.772 ' HD2' ' HG3' ' A' ' 76' ' ' LYS . 77.8 t80 -138.28 121.15 16.52 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.367 169.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.601 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 30.1 t -122.43 141.75 41.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.384 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.735 ' CG ' ' HB2' ' A' ' 74' ' ' PRO . 11.2 mm-40 -81.41 142.51 32.91 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 176.193 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.618 HD21 HG12 ' A' ' 52' ' ' ILE . 4.2 mm? -129.93 153.38 80.96 Favored Pre-proline 0 C--N 1.318 -0.792 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 174.291 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -72.18 18.39 0.32 Allowed 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 123.0 2.467 . . . . 0.0 113.154 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 28.9 p90 -168.87 -22.41 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.906 0.384 . . . . 0.0 110.797 -177.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.538 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 33.8 p -144.59 -157.4 0.78 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.34 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.488 ' CD ' HH12 ' A' ' 25' ' ' ARG . 0.0 OUTLIER -151.53 157.37 42.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.882 0.373 . . . . 0.0 110.945 176.973 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.618 HG12 HD21 ' A' ' 47' ' ' LEU . 29.1 mm -105.26 134.16 47.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.658 177.764 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.599 ' OE1' ' HD2' ' A' ' 30' ' ' ARG . 36.7 mt-30 -140.95 131.71 25.77 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.866 174.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.549 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 8.0 pt-20 -169.36 160.92 9.68 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.325 0.391 . . . . 0.0 110.842 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 80.6 m -80.36 145.41 32.06 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 169.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.414 ' HE3' HD12 ' A' ' 43' ' ' LEU . 4.6 tppt? -152.16 148.65 27.87 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.397 -0.521 . . . . 0.0 109.778 178.899 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.653 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 31.7 p -67.46 142.71 56.55 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.179 -0.608 . . . . 0.0 109.518 178.217 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.547 ' HA ' ' HB2' ' A' ' 41' ' ' ARG . 42.3 t -52.59 -46.34 48.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 120.694 0.283 . . . . 0.0 111.132 -175.139 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 38.5 tp60 -58.48 -56.96 15.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.269 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.793 ' O ' HG13 ' A' ' 64' ' ' VAL . 53.4 mt-30 -71.05 -32.59 69.35 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.849 -174.115 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.655 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.9 t -66.33 -32.97 74.69 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.228 -178.347 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.07 -42.76 84.16 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.173 0.511 . . . . 0.0 110.177 172.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -57.68 -52.57 64.9 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.978 0.894 . . . . 0.0 111.042 176.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.793 HG13 ' O ' ' A' ' 60' ' ' GLN . 4.3 m -68.23 -26.45 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.862 0 CA-C-N 114.721 -1.127 . . . . 0.0 110.818 -179.434 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.739 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -55.18 -49.96 70.56 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 174.914 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -73.37 -35.41 65.93 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 119.721 -0.792 . . . . 0.0 112.134 -174.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.651 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.9 pt-20 -59.74 -42.89 94.19 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.042 -0.663 . . . . 0.0 110.447 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.509 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 28.5 m -78.13 -36.74 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.864 0.364 . . . . 0.0 111.212 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 97.6 m -71.08 -20.26 62.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.136 0.493 . . . . 0.0 110.798 -177.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -79.66 -25.12 41.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.388 175.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.569 HG13 ' O ' ' A' ' 67' ' ' GLU . 17.6 mt -79.55 -29.77 13.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.392 0.615 . . . . 0.0 109.648 177.103 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.451 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 120.03 13.53 5.93 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.396 -0.907 . . . . 0.0 111.897 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.469 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 55.7 m-85 -104.48 102.47 33.94 Favored Pre-proline 0 N--CA 1.448 -0.528 0 CA-C-O 120.622 0.248 . . . . 0.0 110.89 179.459 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.735 ' HB2' ' CG ' ' A' ' 46' ' ' GLN . 81.7 Cg_exo -54.4 124.72 16.78 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.3 2.667 . . . . 0.0 112.767 176.221 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.739 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -128.05 154.24 45.89 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.279 -0.568 . . . . 0.0 111.165 176.616 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.772 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 1.5 mttt -138.72 112.44 8.35 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.106 179.099 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.725 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 59.3 m -102.09 102.22 12.67 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 119.834 -0.746 . . . . 0.0 109.797 173.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 40.6 t -107.61 160.0 16.02 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.365 -178.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.502 ' HB2' ' HD2' ' A' ' 41' ' ' ARG . 49.0 t -122.72 100.47 6.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.304 0.573 . . . . 0.0 109.996 178.433 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.643 ' HG2' ' H ' ' A' ' 81' ' ' ASP . 2.7 tt0 -173.98 166.5 4.31 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 105.892 -1.892 . . . . 0.0 105.892 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.643 ' H ' ' HG2' ' A' ' 80' ' ' GLU . 9.4 t70 -69.29 109.12 3.97 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.155 -174.823 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.695 HD21 HG13 ' A' ' 32' ' ' VAL . 30.5 mt 69.27 31.35 3.95 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.983 -177.493 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' CYS . . . . . 0.618 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 3.3 t -70.82 -6.76 40.34 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -173.1 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.444 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 29.7 p-10 -84.31 24.62 0.95 Allowed 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.135 177.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 24.4 ptt180 -90.3 130.32 36.43 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.516 174.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 55.9 m -156.94 159.34 38.01 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 121.319 -0.152 . . . . 0.0 111.021 -179.094 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 56.22 44.54 24.78 Favored 'General case' 0 C--O 1.232 0.139 0 O-C-N 124.168 0.918 . . . . 0.0 111.275 176.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.72 178.875 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.484 1.266 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.96 131.04 36.2 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.993 -178.073 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.3 tp -124.25 152.49 42.92 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.564 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 31.4 mtmm -106.47 108.25 19.67 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.14 0.495 . . . . 0.0 111.415 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 12.4 m -111.33 153.29 26.2 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.692 ' HB3' ' HB2' ' A' ' 30' ' ' ARG . 63.2 m-85 -70.66 137.31 49.76 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.212 176.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.7 p -116.37 144.51 44.19 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.346 175.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.438 HH12 ' NH2' ' A' ' 30' ' ' ARG . 10.8 tpt180 -83.3 110.29 17.98 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -129.41 116.94 19.77 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -175.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 71.09 -76.14 0.6 Allowed Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 -171.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -140.0 -85.62 0.22 Allowed 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 166.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -62.14 174.97 0.78 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.806 0.812 . . . . 0.0 112.823 -169.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.692 ' HB2' ' HB3' ' A' ' 23' ' ' PHE . 1.0 OUTLIER -80.62 136.42 36.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.216 -0.902 . . . . 0.0 112.41 -167.751 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 27.2 m -108.04 132.01 53.99 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.007 174.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 95.5 t -73.14 107.79 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 176.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 19.4 p -123.74 134.7 53.63 Favored 'General case' 0 C--N 1.317 -0.848 0 C-N-CA 120.103 -0.639 . . . . 0.0 111.582 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.564 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.5 t -79.65 113.49 17.85 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 170.368 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.3 m -87.88 166.07 14.81 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.373 -170.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.461 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -61.81 157.5 17.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.051 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -81.28 -12.28 59.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -164.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.481 ' HG2' HG22 ' A' ' 57' ' ' THR . 0.0 OUTLIER -78.83 -27.53 44.31 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.511 0.672 . . . . 0.0 109.522 175.566 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.632 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 76.0 mt-30 -88.06 88.06 7.52 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.43 177.748 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 p -97.15 5.11 50.77 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.253 -175.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.816 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 17.7 mmt85 -117.51 178.89 4.22 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 119.376 -0.929 . . . . 0.0 110.036 172.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.561 ' HB3' ' HB3' ' A' ' 84' ' ' ASN . 86.0 m -135.61 131.12 35.43 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.649 -1.16 . . . . 0.0 109.407 -174.094 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.5 ' HB2' ' CG ' ' A' ' 56' ' ' LYS . 1.6 tm? -100.23 128.21 46.35 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.667 -173.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.587 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 52.3 t80 -142.17 114.85 8.54 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.768 174.022 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.563 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 41.4 t -101.61 128.88 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 175.024 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.731 ' HB3' ' HB2' ' A' ' 74' ' ' PRO . 2.1 tp60 -90.04 114.22 26.06 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.27 -178.576 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.553 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.5 mm? -109.69 153.33 43.02 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.039 179.494 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -80.15 27.18 0.55 Allowed 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 122.737 2.291 . . . . 0.0 112.724 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.426 ' HD2' ' HG ' ' A' ' 50' ' ' SER . 39.0 p90 -170.63 -23.38 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.829 -177.537 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.553 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 45.2 m -148.09 -160.95 1.24 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.432 ' HA ' HD23 ' A' ' 47' ' ' LEU . 16.3 pt-20 -158.01 150.47 22.37 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.816 179.538 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.587 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 37.8 mt -112.38 137.97 43.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 177.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.48 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 45.3 mt-30 -144.5 128.95 17.97 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -178.403 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -150.84 174.98 12.45 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 -179.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 3.6 m -107.72 127.2 53.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 167.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.521 ' HB2' ' SG ' ' A' ' 61' ' ' CYS . 71.9 mmtt -133.5 148.38 51.68 Favored 'General case' 0 C--N 1.314 -0.954 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.599 -174.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.632 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 43.9 p -66.18 154.72 39.01 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 172.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.628 HG22 ' HG2' ' A' ' 41' ' ' ARG . 21.7 t -50.1 -45.66 23.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.453 -176.545 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -66.01 -56.53 11.15 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.648 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.676 ' O ' HG13 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -58.45 -33.42 69.71 Favored 'General case' 0 C--O 1.211 -0.937 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -176.239 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.672 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.7 t -72.68 -33.5 66.57 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.623 -179.264 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.45 -36.85 71.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.238 0.542 . . . . 0.0 109.684 173.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.579 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 92.5 mt-10 -59.5 -52.36 65.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.547 175.564 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.676 HG13 ' O ' ' A' ' 60' ' ' GLN . 19.8 m -71.77 -27.67 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.659 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.523 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.491 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 0.2 OUTLIER -60.52 -49.44 77.55 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 175.382 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -73.88 -32.32 63.54 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.834 -174.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.634 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.2 pt-20 -61.13 -41.86 97.48 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.744 -0.783 . . . . 0.0 109.895 -179.241 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.469 HG22 ' O ' ' A' ' 64' ' ' VAL . 28.6 m -81.07 -37.57 16.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 178.392 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.418 ' HG1' HD13 ' A' ' 65' ' ' LEU . 97.8 m -78.15 -25.73 47.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.532 -172.063 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.38 -19.74 63.83 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.426 173.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 67' ' ' GLU . 9.5 mt -80.56 -22.17 11.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.745 177.221 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 112.27 2.08 26.37 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 119.884 -1.15 . . . . 0.0 112.17 -177.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -88.69 126.55 59.39 Favored Pre-proline 0 N--CA 1.448 -0.553 0 O-C-N 122.819 -0.224 . . . . 0.0 110.909 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.731 ' HB2' ' HB3' ' A' ' 46' ' ' GLN . 78.8 Cg_exo -56.64 131.27 44.61 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 123.319 2.68 . . . . 0.0 112.723 176.861 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.418 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -146.93 155.13 42.04 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 119.154 -1.018 . . . . 0.0 111.641 174.163 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.43 ' HD3' ' CD2' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -141.26 151.54 43.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.772 176.012 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.816 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 37.4 t -145.76 92.76 2.25 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.92 173.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 3.9 p -107.13 166.13 10.85 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.956 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.547 ' HB2' ' HD3' ' A' ' 41' ' ' ARG . 47.3 t -109.46 105.01 14.18 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.533 -173.402 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 172.13 151.82 0.07 Allowed 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.694 ' HB3' HD22 ' A' ' 82' ' ' LEU . 62.0 m-20 -57.79 138.97 55.07 Favored 'General case' 0 CA--C 1.512 -0.492 0 C-N-CA 119.429 -0.908 . . . . 0.0 109.764 176.306 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.694 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 63.85 17.18 10.35 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.065 172.2 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 4.8 t -78.53 -6.7 56.19 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.058 0.456 . . . . 0.0 111.21 -174.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.561 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 29.5 p-10 -103.58 37.69 1.97 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.401 0.62 . . . . 0.0 110.36 178.108 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.81 167.61 13.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.239 179.036 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.63 132.67 48.67 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.245 178.381 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.06 -36.9 40.16 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 179.043 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 . . . . . 0 N--CA 1.471 0.606 0 O-C-N 124.375 1.047 . . . . 0.0 112.535 176.881 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.611 ' O ' ' HB3' ' A' ' 37' ' ' GLU . 26.0 ptm . . . . . 0 N--CA 1.483 1.186 0 CA-C-O 120.63 0.252 . . . . 0.0 110.371 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.456 ' HB1' ' O ' ' A' ' 35' ' ' CYS . . . -77.95 152.57 33.11 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.717 -175.174 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.8 tp -115.89 142.53 46.65 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.176 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.536 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 28.8 mtmm -110.37 106.13 15.37 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.807 -173.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.458 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 17.2 m -106.23 156.01 18.9 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 175.667 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.618 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 16.2 m-85 -67.58 115.32 7.04 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.72 175.471 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.9 m -96.09 133.45 40.33 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.076 -0.712 . . . . 0.0 109.076 171.656 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.418 ' HE ' ' HA ' ' A' ' 28' ' ' ASP . 22.9 ttt180 -91.63 111.23 22.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.991 0.424 . . . . 0.0 111.627 -175.507 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -90.87 90.64 8.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.329 174.696 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 73.27 -81.93 0.68 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.281 -0.961 . . . . 0.0 111.099 -174.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.418 ' HA ' ' HE ' ' A' ' 25' ' ' ARG . 10.4 t70 -123.84 -41.54 2.23 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 174.012 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -52.48 140.86 21.46 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.375 -179.071 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -111.39 111.38 22.38 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 179.195 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -106.8 143.97 34.13 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.329 -0.549 . . . . 0.0 111.464 -169.08 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.52 HG13 HD11 ' A' ' 82' ' ' LEU . 85.1 t -75.32 106.49 5.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.834 174.431 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.415 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 32.6 p -122.08 139.22 53.98 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.324 -0.55 . . . . 0.0 110.845 178.827 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.536 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.8 t -89.12 112.24 23.18 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.18 177.864 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.511 ' HB3' ' OE1' ' A' ' 39' ' ' GLN . 44.9 m -101.45 161.71 13.43 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.833 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.67 158.16 28.11 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.251 -175.136 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.611 ' HB3' ' O ' ' A' ' 18' ' ' MET . 3.4 pt-20 -66.9 -17.45 64.91 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.297 0.57 . . . . 0.0 110.768 177.576 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.565 ' HG2' HG22 ' A' ' 57' ' ' THR . 10.7 tt0 -45.18 -48.01 12.43 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.574 -1.194 . . . . 0.0 108.884 163.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.6 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 41.3 mt-30 -98.06 73.17 2.22 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 114.423 -1.262 . . . . 0.0 109.686 -176.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.16 18.56 3.05 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.518 -177.044 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.649 HH21 HG13 ' A' ' 58' ' ' VAL . 1.6 tpp85 -136.38 168.8 18.76 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.621 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.709 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 21.7 m -129.92 137.51 50.41 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -178.571 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.603 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.0 OUTLIER -98.83 123.36 43.03 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.529 0.204 . . . . 0.0 110.507 -176.501 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.655 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 50.7 t80 -131.24 105.27 7.55 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.062 171.225 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.583 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 42.1 t -98.0 138.12 23.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 120.391 -0.524 . . . . 0.0 109.818 177.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.749 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 2.1 mm100 -79.75 139.15 37.39 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 119.666 -0.813 . . . . 0.0 109.303 175.389 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.727 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.9 mm? -134.14 149.06 70.42 Favored Pre-proline 0 C--N 1.314 -0.942 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.631 178.119 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 5.1 Cg_exo -79.9 13.23 2.2 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.93 2.42 . . . . 0.0 112.134 174.631 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -138.63 -43.75 0.49 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.079 0.466 . . . . 0.0 110.71 -176.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.727 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 38.8 m -147.72 -156.71 0.74 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -178.786 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -139.56 135.88 33.85 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.954 -0.698 . . . . 0.0 110.279 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.655 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 73.7 mt -89.92 126.62 42.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.546 177.602 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.603 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 78.4 mt-30 -139.74 130.77 26.34 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 175.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -172.52 163.97 5.5 Favored 'General case' 0 C--N 1.33 -0.279 0 O-C-N 123.473 0.483 . . . . 0.0 110.509 -177.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.458 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 73.5 m -87.91 135.85 33.22 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.052 0.453 . . . . 0.0 111.109 -179.418 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.549 ' HE3' HD12 ' A' ' 43' ' ' LEU . 68.2 mmtt -138.23 157.28 46.59 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.158 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.6 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 5.3 p -70.96 152.18 43.88 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 118.969 -1.092 . . . . 0.0 108.061 173.122 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.649 HG13 HH21 ' A' ' 41' ' ' ARG . 55.4 t -48.67 -51.92 10.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 120.648 0.261 . . . . 0.0 110.745 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.558 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 17.6 tt0 -63.26 -55.69 22.75 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.19 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.772 ' O ' HG13 ' A' ' 64' ' ' VAL . 29.3 tt0 -58.24 -37.31 74.65 Favored 'General case' 0 C--O 1.209 -1.052 0 CA-C-N 116.541 -0.299 . . . . 0.0 110.961 -174.665 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.707 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.7 t -70.94 -32.97 70.03 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.38 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.91 -39.35 87.36 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.93 172.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 20.1 mm-40 -58.68 -52.66 64.73 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.492 176.579 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.772 HG13 ' O ' ' A' ' 60' ' ' GLN . 7.4 m -69.77 -26.43 30.47 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.705 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.107 -178.63 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.67 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -57.11 -50.47 72.7 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 175.698 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -73.82 -34.68 64.67 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 120.215 -0.594 . . . . 0.0 111.98 -174.615 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.629 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.1 pt-20 -59.43 -42.74 92.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.17 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.507 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 34.4 m -79.68 -38.51 19.35 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.13 0 CA-C-O 120.738 0.304 . . . . 0.0 111.663 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.8 m -74.03 -19.92 60.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.83 0.347 . . . . 0.0 111.341 -175.219 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.23 -23.47 59.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.999 0.428 . . . . 0.0 110.181 173.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 67' ' ' GLU . 6.1 mt -83.83 -21.86 8.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.355 0.598 . . . . 0.0 109.623 177.295 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.453 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 115.43 9.33 13.09 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.13 -1.033 . . . . 0.0 112.224 -178.136 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -101.51 107.11 49.79 Favored Pre-proline 0 N--CA 1.45 -0.43 0 CA-C-O 120.739 0.304 . . . . 0.0 110.966 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.749 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 52.2 Cg_exo -60.54 137.45 73.88 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 123.116 2.544 . . . . 0.0 112.682 175.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.67 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -138.3 160.13 40.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.715 0.293 . . . . 0.0 110.327 174.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.3 mmtp -136.25 114.86 11.92 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.032 -178.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.709 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 39.0 m -114.13 98.48 6.98 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.946 173.553 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 7.9 p -111.13 167.69 10.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.692 -0.231 . . . . 0.0 110.727 -178.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 37.7 m -109.63 106.04 15.56 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.839 -176.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.47 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 23.2 tt0 178.1 153.71 0.32 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.733 ' HB3' HD22 ' A' ' 82' ' ' LEU . 49.7 m-20 -65.27 139.32 58.6 Favored 'General case' 0 CA--C 1.507 -0.708 0 C-N-CA 117.919 -1.512 . . . . 0.0 108.738 172.806 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.733 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 61.37 23.72 13.93 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.084 174.556 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 83' ' ' CYS . . . . . 0.47 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 5.7 t -69.98 -34.26 73.13 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.619 -171.607 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.581 ' OD1' ' HB3' ' A' ' 42' ' ' CYS . 0.4 OUTLIER -74.95 109.51 8.48 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 118.756 -1.177 . . . . 0.0 109.402 174.623 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.532 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 10.2 ptt180 -155.49 153.6 30.52 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.125 -171.064 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.1 m -64.67 114.49 4.46 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.213 177.266 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -85.01 -17.9 36.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.228 0.537 . . . . 0.0 110.606 -177.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.575 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.873 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 90.0 mtp . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 110.397 -0.223 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.622 ' HA ' ' O ' ' A' ' 35' ' ' CYS . . . 71.45 114.03 0.05 Allowed 'General case' 0 N--CA 1.465 0.325 0 O-C-N 124.338 1.024 . . . . 0.0 112.697 175.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 27.2 tp -109.53 146.33 34.81 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 176.383 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.667 ' HG2' ' HB ' ' A' ' 34' ' ' THR . 27.6 mtmm -114.61 114.9 26.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.244 0.545 . . . . 0.0 112.072 -174.318 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 17.2 m -129.41 168.58 16.1 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.044 175.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -75.27 132.27 40.93 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.259 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 61.8 m -129.55 135.29 48.41 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 175.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 51.5 ttt180 -84.31 110.44 18.58 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.909 -176.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -91.16 86.5 6.21 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.934 177.267 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 81.02 -81.89 1.58 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.315 -174.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -127.24 -51.59 1.41 Allowed 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 176.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -56.91 148.65 20.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.214 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.682 ' HD2' ' OE1' ' A' ' 53' ' ' GLN . 77.6 mtm180 -126.04 114.2 18.12 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.181 -0.607 . . . . 0.0 110.65 -178.38 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.8 t -120.09 176.11 5.6 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.852 -178.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 76.9 t -90.08 116.75 32.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.498 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.489 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 64.4 p -106.76 143.37 34.96 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.69 175.582 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.667 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 1.5 t -98.43 112.32 24.38 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.479 175.788 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.622 ' O ' ' HA ' ' A' ' 19' ' ' ALA . 57.9 m -110.54 164.97 12.18 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.241 -172.601 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.2 -175.98 4.41 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -170.148 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -67.05 -32.6 73.91 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.44 -0.8 . . . . 0.0 113.009 -167.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.622 ' CD ' ' H ' ' A' ' 38' ' ' GLU . 1.1 mp0 -55.11 -44.16 74.73 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 122.159 0.98 . . . . 0.0 108.619 177.554 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.721 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 2.2 mm-40 -90.98 49.19 1.61 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 113.694 -1.594 . . . . 0.0 110.411 -172.544 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.74 3.65 11.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.204 0.526 . . . . 0.0 110.906 178.648 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.621 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 19.4 mmt85 -120.07 -179.44 3.93 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.704 0.764 . . . . 0.0 109.367 169.078 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.596 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 35.9 m -144.41 156.1 44.06 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.344 -172.681 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -114.77 135.62 53.98 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 120.922 0.392 . . . . 0.0 110.247 -177.799 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.572 ' HB3' ' HG3' ' A' ' 76' ' ' LYS . 70.3 t80 -141.73 119.97 12.22 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.36 -0.836 . . . . 0.0 108.984 170.46 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.624 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 25.3 t -119.43 140.58 42.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.426 -178.17 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.661 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 11.4 mm-40 -84.48 133.33 34.48 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.122 0.487 . . . . 0.0 110.694 176.302 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.687 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.5 mm? -130.24 146.05 59.95 Favored Pre-proline 0 C--N 1.318 -0.799 0 CA-C-N 115.471 -0.786 . . . . 0.0 108.894 176.809 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -76.15 15.08 1.01 Allowed 'Trans proline' 0 CA--C 1.528 0.212 0 C-N-CA 122.797 2.331 . . . . 0.0 112.193 177.221 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -143.45 -39.42 0.31 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.633 -176.365 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.687 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 49.0 m -149.11 -156.83 0.76 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.416 ' CD ' HH12 ' A' ' 30' ' ' ARG . 22.3 mt-10 -138.65 149.56 45.31 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 177.454 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.686 HG12 HD21 ' A' ' 47' ' ' LEU . 27.9 mm -104.74 129.27 57.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.193 174.283 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.682 ' OE1' ' HD2' ' A' ' 30' ' ' ARG . 50.9 mt-30 -142.86 131.85 22.99 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.58 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -168.2 160.26 11.51 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 123.556 0.535 . . . . 0.0 111.107 -178.295 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 64.7 m -78.32 132.63 37.52 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 170.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 56' ' ' LYS . 8.7 tppt? -137.95 135.33 35.94 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 -178.553 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.721 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 6.1 p -59.09 156.45 11.96 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 119.509 -0.876 . . . . 0.0 109.827 -178.307 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.617 HG22 ' HG2' ' A' ' 41' ' ' ARG . 37.3 t -54.81 -46.63 75.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.091 0.472 . . . . 0.0 111.296 -175.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.64 ' HG3' ' N ' ' A' ' 60' ' ' GLN . 8.5 pt20 -65.82 -45.36 82.61 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.881 -179.543 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.64 ' N ' ' HG3' ' A' ' 59' ' ' GLN . 70.9 mt-30 -72.87 -26.71 61.55 Favored 'General case' 0 C--O 1.2 -1.528 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.884 -175.404 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.565 ' HA ' HG22 ' A' ' 64' ' ' VAL . 9.1 p -69.43 -33.05 72.39 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.048 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.45 -40.75 73.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 0.0 109.997 172.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.21 -52.01 66.61 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.174 178.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.63 ' HA ' ' HG2' ' A' ' 67' ' ' GLU . 30.6 m -67.77 -29.39 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.375 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.637 -178.707 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.523 HD12 ' HB3' ' A' ' 75' ' ' ALA . 18.4 tp -57.81 -50.79 72.08 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.804 176.554 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -75.25 -32.38 61.07 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -176.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.63 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -61.1 -46.91 88.7 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.615 -175.732 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.585 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.6 m -79.76 -31.32 13.72 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 C-N-CA 120.74 -0.384 . . . . 0.0 111.299 -179.577 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 96.3 m -68.41 -29.06 67.65 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.559 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.76 -22.78 63.32 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.541 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 67' ' ' GLU . 20.1 mt -85.1 -20.61 8.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.337 0.589 . . . . 0.0 109.729 177.654 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 111.2 11.97 16.77 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.187 -1.006 . . . . 0.0 112.453 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -106.47 113.39 63.19 Favored Pre-proline 0 N--CA 1.448 -0.559 0 CA-C-O 120.612 0.244 . . . . 0.0 111.212 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.661 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 90.6 Cg_exo -52.36 129.78 33.09 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 123.577 2.851 . . . . 0.0 113.088 177.41 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.523 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -132.4 161.21 34.2 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.236 -0.585 . . . . 0.0 111.0 174.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.572 ' HG3' ' HB3' ' A' ' 44' ' ' PHE . 14.9 ptmt -145.2 124.33 12.88 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.017 0.437 . . . . 0.0 111.409 175.025 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.621 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 0.6 OUTLIER -100.44 96.66 7.56 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.602 -0.727 . . . . 0.0 109.122 168.714 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 42.7 t -106.81 152.45 23.85 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.579 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.465 ' HB2' ' CD ' ' A' ' 41' ' ' ARG . 41.9 t -115.22 100.28 8.02 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.334 -178.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.506 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 42.8 tt0 169.68 155.1 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.687 ' HB3' HD22 ' A' ' 82' ' ' LEU . 69.5 m-20 -63.31 135.2 56.88 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 119.038 -1.065 . . . . 0.0 110.001 177.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.687 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 66.72 6.8 4.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.032 170.843 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 83' ' ' CYS . . . . . 0.506 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 42.6 t -75.88 -13.15 60.26 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 120.336 -0.545 . . . . 0.0 111.387 -175.182 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.421 ' HB3' ' HB2' ' A' ' 42' ' ' CYS . 19.3 p-10 -88.02 16.81 5.55 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.111 -0.635 . . . . 0.0 110.599 178.672 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.411 ' HG2' ' H ' ' A' ' 86' ' ' SER . 26.0 ttp180 -71.16 161.48 31.04 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 176.62 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.53 ' HA ' ' CZ ' ' A' ' 44' ' ' PHE . 2.1 p -64.38 139.98 58.82 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.767 0.317 . . . . 0.0 110.977 177.051 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -63.17 -56.39 17.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.174 -178.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 . . . . . 0 C--N 1.323 -0.572 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.22 -178.824 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 110.425 -0.213 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -74.5 101.45 4.16 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.924 175.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 26.1 tp -93.5 155.3 17.41 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 177.663 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.548 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 33.1 mtmm -108.58 106.88 17.16 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 119.63 -0.828 . . . . 0.0 111.632 -179.577 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.581 ' HA ' HD21 ' A' ' 84' ' ' ASN . 8.1 m -110.05 166.26 11.08 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.016 177.043 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -80.75 132.35 35.52 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 119.929 -0.708 . . . . 0.0 110.415 178.474 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.1 p -101.97 130.9 48.61 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 171.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.2 tpt85 -83.29 109.43 17.25 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.446 -0.502 . . . . 0.0 109.741 -176.412 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -118.82 90.38 3.32 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.266 -0.424 . . . . 0.0 109.89 -179.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 68.84 -118.54 9.01 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 119.949 -1.119 . . . . 0.0 111.587 -176.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -89.8 -18.76 25.67 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.592 0.234 . . . . 0.0 110.631 179.587 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -91.57 157.08 17.2 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.442 0.639 . . . . 0.0 111.941 -177.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.477 HH11 ' HD3' ' A' ' 30' ' ' ARG . 1.1 ptt-85 -125.26 113.05 17.12 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 169.451 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.9 m -97.14 133.48 41.73 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.615 -168.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 95.5 t -72.72 106.84 3.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 173.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 12.1 p -122.3 138.36 54.53 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.557 -0.457 . . . . 0.0 111.513 -177.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.548 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.9 t -77.66 115.92 17.79 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 173.571 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.2 m -89.17 178.21 6.42 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.709 -170.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.5 161.04 30.31 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.072 0.463 . . . . 0.0 112.181 -174.29 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -56.45 -33.32 65.79 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.791 -177.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -74.25 -29.57 61.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.133 0.492 . . . . 0.0 111.093 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.521 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 22.7 mt-30 -83.96 90.4 7.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.457 0.646 . . . . 0.0 110.114 -172.409 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.496 ' OG1' HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -102.48 14.5 31.8 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.52 -176.658 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.635 ' HD3' HG22 ' A' ' 58' ' ' VAL . 1.6 tpt180 -135.11 172.44 13.0 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 121.168 0.509 . . . . 0.0 109.724 175.61 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.599 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 70.1 m -131.0 131.64 44.49 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.511 -0.768 . . . . 0.0 108.943 179.189 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.525 ' HB3' ' HG2' ' A' ' 54' ' ' GLU . 0.7 OUTLIER -96.33 123.71 40.07 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.059 -177.151 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.529 ' HD2' ' HG3' ' A' ' 76' ' ' LYS . 71.9 t80 -131.64 109.37 10.16 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.853 170.585 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.651 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 39.9 t -99.42 134.22 39.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 172.044 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 1.049 ' HB3' ' HB2' ' A' ' 74' ' ' PRO . 28.4 tp60 -93.4 114.78 27.28 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.856 -175.736 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.6 mm? -107.8 156.71 37.59 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.909 -179.029 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_exo -70.9 14.93 0.32 Allowed 'Trans proline' 0 CA--C 1.535 0.562 0 C-N-CA 123.23 2.62 . . . . 0.0 114.019 -176.316 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -171.02 -30.94 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.879 -178.564 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.543 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 23.8 p -124.31 -168.4 1.79 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.828 179.015 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HG3' ' OG ' ' A' ' 86' ' ' SER . 0.1 OUTLIER -150.48 149.73 30.37 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 119.584 -0.846 . . . . 0.0 111.285 178.118 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.651 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 25.9 mm -98.78 129.49 49.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.777 175.255 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.423 ' OE1' ' HD3' ' A' ' 30' ' ' ARG . 48.5 mt-30 -140.31 130.25 24.69 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 119.811 -0.756 . . . . 0.0 110.565 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.525 ' HG2' ' HB3' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -163.4 163.86 24.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.733 -179.189 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.571 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.3 m -94.86 126.43 40.18 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 168.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.571 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 14.0 mptt -128.05 170.86 12.43 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 119.926 -0.71 . . . . 0.0 109.144 175.049 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 30.9 p -80.68 159.63 25.23 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 118.471 -1.292 . . . . 0.0 107.96 174.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.635 HG22 ' HD3' ' A' ' 41' ' ' ARG . 83.4 t -55.3 -43.75 72.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.53 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -66.54 -56.74 9.41 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.053 -178.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.697 ' O ' HG13 ' A' ' 64' ' ' VAL . 74.5 mt-30 -56.44 -44.38 80.38 Favored 'General case' 0 C--O 1.207 -1.178 0 O-C-N 123.456 0.473 . . . . 0.0 110.21 -177.309 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.732 ' HA ' HG22 ' A' ' 64' ' ' VAL . 0.5 OUTLIER -66.35 -31.6 72.48 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.852 -178.108 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.78 -41.18 75.45 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.189 -0.604 . . . . 0.0 110.141 173.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.489 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 45.3 mt-10 -56.32 -53.33 58.53 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.981 0.896 . . . . 0.0 110.655 175.615 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.732 HG22 ' HA ' ' A' ' 61' ' ' CYS . 5.7 m -72.73 -26.36 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.735 0 CA-C-N 114.532 -1.213 . . . . 0.0 111.081 -178.251 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.585 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 19.8 tp -56.85 -47.71 79.74 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 176.267 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.544 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 38.7 tt0 -73.98 -37.63 64.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.462 -176.511 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.633 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -58.3 -43.74 88.24 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.611 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.53 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 29.9 m -79.66 -31.75 14.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 120.599 -0.44 . . . . 0.0 112.06 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.544 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 21.0 p -73.87 -26.27 60.47 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.105 -178.602 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.87 -20.21 63.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.183 0.515 . . . . 0.0 110.493 176.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 67' ' ' GLU . 22.6 mt -82.07 -19.6 10.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.605 176.678 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 108.65 1.84 32.56 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.18 -1.01 . . . . 0.0 112.398 179.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 49.5 m-85 -87.43 134.53 35.97 Favored Pre-proline 0 N--CA 1.45 -0.469 0 CA-C-O 120.787 0.327 . . . . 0.0 111.385 -178.545 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 1.049 ' HB2' ' HB3' ' A' ' 46' ' ' GLN . 54.4 Cg_exo -59.55 130.82 37.16 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 123.394 2.729 . . . . 0.0 111.897 175.163 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -147.03 151.23 36.59 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.2 -0.6 . . . . 0.0 111.508 178.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.529 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 1.1 ptmt -151.01 119.57 6.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.549 179.312 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.599 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 65.7 m -113.57 97.97 6.77 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.358 -0.537 . . . . 0.0 109.893 168.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 3.5 p -108.46 157.42 18.45 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.069 177.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.453 ' HB2' ' HD2' ' A' ' 41' ' ' ARG . 14.5 t -108.42 100.95 10.17 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.354 -175.047 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 79' ' ' CYS . 3.0 mm-40 178.9 151.01 0.3 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.653 ' HB3' HD22 ' A' ' 82' ' ' LEU . 70.0 m-20 -63.02 135.9 57.52 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 118.819 -1.152 . . . . 0.0 109.772 178.722 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.653 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 65.51 10.08 6.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.583 171.636 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 42.7 t -69.65 -20.69 63.58 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.726 0.774 . . . . 0.0 110.313 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.581 HD21 ' HA ' ' A' ' 22' ' ' CYS . 6.0 p30 -82.22 20.34 1.06 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.366 178.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 22.2 ttp180 -57.54 138.06 55.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.302 178.066 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.492 ' OG ' ' HG3' ' A' ' 51' ' ' GLU . 3.0 m -80.95 107.17 13.54 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.068 176.754 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -90.66 -27.54 18.96 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.903 178.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 19.3 mm-40 . . . . . 0 C--N 1.325 -0.483 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.282 179.08 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 110.378 -0.231 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 63.22 92.12 0.07 Allowed 'General case' 0 N--CA 1.464 0.275 0 O-C-N 123.92 0.763 . . . . 0.0 110.739 -173.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.7 tp -90.64 156.04 18.41 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 -176.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.518 ' HB3' HG12 ' A' ' 32' ' ' VAL . 23.0 mtpp -115.33 101.17 8.68 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 119.219 -0.992 . . . . 0.0 111.867 178.63 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.402 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 8.4 m -100.71 158.38 15.99 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 173.337 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -76.37 142.21 41.24 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.35 -0.54 . . . . 0.0 109.779 174.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 88.9 m -133.64 129.57 37.06 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 173.055 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.623 ' NH1' ' HA ' ' A' ' 28' ' ' ASP . 16.5 mtm180 -91.66 114.38 26.89 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 119.576 -0.85 . . . . 0.0 112.223 -173.698 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -79.29 86.39 5.04 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.341 172.106 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 71.48 -108.86 2.62 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 119.173 -1.489 . . . . 0.0 109.909 -168.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.623 ' HA ' ' NH1' ' A' ' 25' ' ' ARG . 10.4 m-20 -109.07 -7.18 15.38 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.433 172.446 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -69.63 152.86 44.23 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.511 173.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.5 mtt-85 -126.16 113.36 16.92 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 119.376 -0.93 . . . . 0.0 111.073 -175.539 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 m -115.29 139.24 50.14 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.065 -178.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.518 HG12 ' HB3' ' A' ' 21' ' ' LYS . 6.3 t -88.6 104.59 14.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 C-N-CA 119.789 -0.764 . . . . 0.0 109.846 177.526 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.2 p -87.61 150.24 23.79 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.858 -173.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 t -90.15 112.25 23.68 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 171.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.1 140.87 35.8 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.894 0.378 . . . . 0.0 110.499 -173.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.44 172.23 10.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.258 -171.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -56.19 -38.53 71.08 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.107 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.445 ' HG3' ' H ' ' A' ' 39' ' ' GLN . 3.2 pt-20 -52.07 -46.13 65.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.793 175.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.656 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 38.2 mt-30 -103.07 72.54 1.18 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.237 -177.158 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.09 15.57 11.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.302 -179.287 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.696 ' HG2' ' SG ' ' A' ' 61' ' ' CYS . 1.7 tpt180 -119.68 171.13 8.6 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.299 -0.56 . . . . 0.0 109.494 173.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.73 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.3 m -130.42 131.0 45.02 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.504 -179.636 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.541 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.7 OUTLIER -94.95 130.73 41.47 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.835 0.35 . . . . 0.0 110.507 -176.596 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.623 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 54.4 t80 -143.69 119.23 10.36 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.468 174.221 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.404 HG23 ' CD2' ' A' ' 43' ' ' LEU . 57.5 t -122.49 138.8 51.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.848 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 7.1 mm100 -75.58 142.0 42.8 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.663 178.421 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.639 HD21 HG13 ' A' ' 52' ' ' ILE . 3.4 mm? -130.55 158.57 74.22 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 169.738 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -76.27 13.82 1.26 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.761 2.308 . . . . 0.0 112.39 176.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -140.43 -54.48 0.51 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.467 0.651 . . . . 0.0 109.69 -179.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.608 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 6.7 p -137.83 -151.5 0.39 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.675 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.549 ' HA ' HD23 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -147.14 161.01 41.74 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.297 176.347 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.639 HG13 HD21 ' A' ' 47' ' ' LEU . 67.3 mt -92.92 133.96 32.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.524 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -135.1 130.51 35.62 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 120.345 -0.542 . . . . 0.0 109.544 176.274 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -169.99 162.24 9.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.06 177.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.402 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 4.4 m -86.81 140.8 29.33 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 170.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.541 ' HE3' HD12 ' A' ' 43' ' ' LEU . 5.0 tppt? -143.72 153.3 42.3 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.136 -0.626 . . . . 0.0 109.647 -178.139 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.656 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 29.3 p -69.45 142.82 53.72 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 176.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.684 HG22 ' HD3' ' A' ' 41' ' ' ARG . 39.9 t -54.96 -35.97 36.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-O 121.079 0.466 . . . . 0.0 110.794 -176.348 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.458 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 13.2 tt0 -69.1 -56.55 7.37 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.548 179.463 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.623 ' O ' HG13 ' A' ' 64' ' ' VAL . 20.4 mm-40 -67.55 -29.32 68.67 Favored 'General case' 0 C--O 1.209 -1.053 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.615 -175.543 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.696 ' SG ' ' HG2' ' A' ' 41' ' ' ARG . 2.5 p -67.25 -32.93 74.29 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.148 178.499 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.13 -44.79 75.32 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 173.592 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 49.6 mm-40 -53.74 -53.14 56.44 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.769 177.264 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.641 HG22 ' HA ' ' A' ' 61' ' ' CYS . 16.1 m -73.31 -26.84 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.626 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.315 -177.3 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.643 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 4.3 tp -62.67 -50.9 69.34 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.467 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.609 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 49.1 mt-10 -76.05 -29.61 58.09 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -176.173 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.625 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.3 pt-20 -61.94 -45.17 94.87 Favored 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.095 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.569 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 34.4 m -80.29 -31.06 12.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.493 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.609 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 15.7 p -71.15 -28.35 64.2 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.857 -179.51 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.76 -21.26 63.45 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.453 175.256 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 67' ' ' GLU . 28.4 mt -84.71 -26.37 6.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.794 176.335 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.428 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 121.33 -1.91 11.42 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.111 -1.042 . . . . 0.0 112.507 -179.368 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -88.19 112.77 51.7 Favored Pre-proline 0 N--CA 1.451 -0.38 0 CA-C-O 120.516 0.198 . . . . 0.0 111.099 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.848 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 32.4 Cg_exo -62.91 130.96 30.97 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.997 2.464 . . . . 0.0 112.059 176.715 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -145.19 155.19 43.12 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.35 -178.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -148.03 131.67 16.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.575 177.348 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.73 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 24.4 p -119.29 102.24 8.56 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.537 0.684 . . . . 0.0 109.723 165.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 2.5 p -107.49 163.46 13.04 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.298 178.004 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 7.1 p -108.55 101.33 10.5 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.405 -175.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.543 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 24.3 tt0 177.84 146.44 0.13 Allowed 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 -177.254 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.65 ' HB3' HD22 ' A' ' 82' ' ' LEU . 17.6 m-20 -60.47 138.15 58.05 Favored 'General case' 0 CA--C 1.506 -0.723 0 C-N-CA 119.471 -0.892 . . . . 0.0 109.793 177.01 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.65 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 63.13 18.58 11.06 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.664 173.613 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 83' ' ' CYS . . . . . 0.543 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 12.1 t -75.03 -23.95 58.23 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.096 0.474 . . . . 0.0 111.299 -173.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.566 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 29.6 p-10 -85.07 31.41 0.55 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.589 0.709 . . . . 0.0 109.951 177.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 85' ' ' ARG . 9.5 ptt-85 -70.19 162.2 28.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.714 173.581 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.492 ' HA ' ' CE1' ' A' ' 44' ' ' PHE . 32.2 t -90.42 113.81 25.81 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.879 0.371 . . . . 0.0 110.486 179.498 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -100.95 9.19 42.56 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.618 176.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 53.6 tt0 . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.697 -177.001 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 18' ' ' MET . . . . . 0.53 ' O ' ' HB3' ' A' ' 37' ' ' GLU . 16.8 ptm . . . . . 0 N--CA 1.484 1.265 0 CA-C-O 121.228 0.537 . . . . 0.0 111.228 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.551 ' HB1' ' O ' ' A' ' 35' ' ' CYS . . . -81.58 160.12 23.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.62 -174.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.0 tp -121.12 143.9 48.85 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -178.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.556 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 30.8 mtmm -106.44 113.32 26.77 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.911 -0.315 . . . . 0.0 111.181 -177.511 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.605 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 34.7 m -116.47 138.11 51.64 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.729 178.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.661 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 11.8 m-85 -57.23 105.6 0.25 Allowed 'General case' 0 N--CA 1.465 0.309 0 O-C-N 123.118 0.261 . . . . 0.0 111.333 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.1 m -91.37 129.03 37.41 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 175.328 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.43 ' HD2' ' HA ' ' A' ' 28' ' ' ASP . 12.9 ttp180 -90.49 110.57 21.68 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 119.768 -0.773 . . . . 0.0 111.196 -175.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -93.56 96.79 10.08 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.094 176.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 76.34 -79.25 1.22 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 119.467 -1.349 . . . . 0.0 110.219 -171.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.43 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 14.0 t70 -146.4 -21.83 0.43 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 168.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -55.77 132.78 50.15 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 171.499 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -114.48 111.26 21.13 Favored 'General case' 0 C--N 1.313 -1.022 0 C-N-CA 119.16 -1.016 . . . . 0.0 109.131 -178.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.8 m -99.41 147.17 25.52 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.282 -170.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.528 HG13 HD11 ' A' ' 82' ' ' LEU . 58.0 t -78.07 105.67 7.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 172.201 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.5 p -125.09 140.21 53.09 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 120.07 -0.652 . . . . 0.0 111.172 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.556 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 2.2 t -88.39 111.67 22.02 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.637 176.698 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' CYS . . . . . 0.551 ' O ' ' HB1' ' A' ' 19' ' ' ALA . 81.7 m -95.57 161.3 14.11 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.685 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.72 153.9 27.0 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.234 -175.228 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.53 ' HB3' ' O ' ' A' ' 18' ' ' MET . 2.7 pt-20 -66.84 -19.95 65.84 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.365 0.602 . . . . 0.0 110.914 178.006 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.593 ' HG2' HG22 ' A' ' 57' ' ' THR . 8.4 tt0 -46.72 -44.82 19.1 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.178 164.625 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.671 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 2.1 mt-30 -99.14 70.73 1.79 Allowed 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.541 -1.208 . . . . 0.0 109.567 -176.298 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.74 14.87 4.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.472 -0.786 . . . . 0.0 112.211 -173.544 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ARG . . . . . 0.668 ' CG ' ' HA ' ' A' ' 58' ' ' VAL . 13.6 mmt85 -131.77 177.4 7.55 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.374 0.606 . . . . 0.0 109.993 172.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.67 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 8.6 m -133.56 139.56 46.65 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.085 -0.961 . . . . 0.0 108.68 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.568 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -99.33 122.99 43.24 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.717 0.294 . . . . 0.0 110.341 -177.035 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.663 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 56.3 t80 -131.7 107.28 8.69 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.953 171.229 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.563 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 43.9 t -102.62 138.65 26.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 120.411 -0.516 . . . . 0.0 109.681 177.395 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.772 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 3.7 mm100 -77.9 139.27 39.22 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 176.009 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.666 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.1 mm? -135.03 153.0 78.2 Favored Pre-proline 0 C--N 1.317 -0.846 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.896 178.886 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -87.77 8.75 4.07 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.463 2.109 . . . . 0.0 112.221 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -133.92 -24.8 1.67 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.967 0.413 . . . . 0.0 110.95 -179.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.666 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 68.0 m -162.31 -157.83 0.49 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 -175.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.402 ' HB3' ' HE1' ' A' ' 44' ' ' PHE . 49.5 mt-10 -140.81 135.92 31.92 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 172.857 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.663 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 59.6 mt -88.96 127.05 41.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.621 178.801 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.474 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 24.2 mt-30 -139.35 130.46 26.55 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 123.499 0.499 . . . . 0.0 109.917 177.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -173.4 172.32 3.76 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.671 0.607 . . . . 0.0 110.198 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.605 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 34.7 m -98.82 138.24 36.25 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.683 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.568 ' HE3' HD12 ' A' ' 43' ' ' LEU . 66.0 mmtt -137.66 156.05 48.46 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.671 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 7.8 p -69.77 152.74 44.26 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 172.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.668 ' HA ' ' CG ' ' A' ' 41' ' ' ARG . 40.3 t -49.7 -55.33 5.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.799 0.333 . . . . 0.0 110.513 -176.568 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.581 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 39.0 tt0 -61.82 -55.14 33.02 Favored 'General case' 0 C--O 1.217 -0.624 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.371 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.787 ' O ' HG13 ' A' ' 64' ' ' VAL . 26.1 tt0 -54.46 -38.84 66.83 Favored 'General case' 0 C--O 1.206 -1.197 0 O-C-N 123.11 0.256 . . . . 0.0 111.202 -175.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.655 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.4 t -69.68 -32.8 71.62 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 120.069 -0.652 . . . . 0.0 110.382 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.8 -39.35 87.73 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.038 171.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 14.5 mm-40 -57.79 -52.54 65.05 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.96 0.886 . . . . 0.0 110.217 176.306 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.787 HG13 ' O ' ' A' ' 60' ' ' GLN . 4.7 m -69.83 -26.41 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.759 0 CA-C-N 114.591 -1.186 . . . . 0.0 111.053 -178.669 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.697 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -55.75 -49.36 73.32 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 174.787 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -73.26 -36.39 66.36 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.535 -0.466 . . . . 0.0 112.102 -174.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.645 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 12.3 pt-20 -59.41 -43.35 93.05 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.292 -179.205 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.517 HG22 ' O ' ' A' ' 64' ' ' VAL . 34.6 m -79.37 -34.95 16.57 Favored 'Isoleucine or valine' 0 C--O 1.231 0.096 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.488 -179.807 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 95.7 m -74.67 -20.54 59.83 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 0.0 110.882 -176.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.3 -23.34 57.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.021 0.439 . . . . 0.0 110.015 173.566 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 67' ' ' GLU . 14.3 mt -82.8 -25.86 8.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.723 176.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.46 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 115.52 7.67 15.66 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.279 -0.962 . . . . 0.0 112.017 -178.256 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -101.03 106.21 43.22 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-O 120.701 0.286 . . . . 0.0 111.063 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.772 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 74.8 Cg_exo -57.2 130.63 40.47 Favored 'Trans proline' 0 N--CA 1.471 0.173 0 C-N-CA 123.383 2.722 . . . . 0.0 113.043 177.095 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.697 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -126.16 159.32 33.23 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.034 175.107 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -135.46 120.98 19.31 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.836 -178.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.67 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 70.1 m -123.27 92.45 3.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.178 0.513 . . . . 0.0 110.721 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.7 p -110.29 159.87 17.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.763 -176.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 41.8 t -109.71 102.79 11.57 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.04 -178.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.544 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 9.9 tt0 -175.02 146.99 0.9 Allowed 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 -178.279 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.734 ' HB3' HD22 ' A' ' 82' ' ' LEU . 58.2 m-20 -63.78 135.18 56.43 Favored 'General case' 0 CA--C 1.504 -0.818 0 C-N-CA 117.878 -1.529 . . . . 0.0 109.313 177.031 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.734 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.76 20.37 12.11 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.166 174.116 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 83' ' ' CYS . . . . . 0.544 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.7 t -65.24 -45.78 83.24 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.397 -173.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.49 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 32.2 p-10 -70.79 110.37 5.53 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 119.517 -0.873 . . . . 0.0 109.443 174.738 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 83' ' ' CYS . 4.8 ptt180 -151.36 171.29 17.72 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.65 -172.145 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 17.6 m -55.96 121.84 10.21 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 123.885 0.74 . . . . 0.0 111.297 -179.086 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -118.26 -56.91 2.12 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.059 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.303 -178.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.514 HD23 HG22 ' A' ' 40' ' ' THR . 2.3 mm? . . . . . 0 CA--C 1.519 -0.239 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 33' ' ' THR . 30.5 mtmm -115.02 98.61 6.9 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 119.552 -0.859 . . . . 0.0 111.323 -178.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 27.9 m -123.1 165.98 15.93 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.12 175.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.451 ' HA ' ' O ' ' A' ' 31' ' ' THR . 76.8 m-85 -72.01 131.55 43.06 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.145 -176.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.1 m -116.82 128.02 54.88 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 167.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.492 ' NH1' ' HG2' ' A' ' 51' ' ' GLU . 18.6 ttt180 . . . . . 0 C--N 1.319 -0.756 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.441 -173.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 51.2 mtp85 . . . . . 0 N--CA 1.45 -0.453 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.451 ' O ' ' HA ' ' A' ' 23' ' ' PHE . 97.1 m -130.88 133.41 45.87 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.324 -175.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 59.3 t -73.9 106.5 3.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.868 175.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.579 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 38.4 p -106.46 148.16 28.49 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.607 178.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.524 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -107.3 112.51 25.39 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.458 -179.526 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.468 ' HB2' ' HB2' ' A' ' 39' ' ' GLN . 2.5 p -95.1 166.11 12.09 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.037 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.27 174.77 9.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.511 -176.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.08 -28.27 66.33 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.368 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.595 ' O ' HG23 ' A' ' 57' ' ' THR . 3.3 pt-20 -54.91 -56.78 15.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.645 175.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.741 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 54.9 mt-30 -86.96 53.6 2.89 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.774 -172.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.514 HG22 HD23 ' A' ' 20' ' ' LEU . 0.1 OUTLIER -73.67 -0.36 15.25 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -173.283 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.627 ' CG ' ' HA ' ' A' ' 58' ' ' VAL . 3.7 mmp_? -110.75 178.84 4.23 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 119.943 -0.703 . . . . 0.0 109.91 173.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.654 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 61.2 m -135.73 131.93 36.22 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.066 -177.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.51 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.5 OUTLIER -93.12 128.72 39.16 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.288 -176.815 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.616 ' HB2' ' HB2' ' A' ' 84' ' ' ASN . 80.7 t80 -140.16 117.3 11.21 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.147 172.334 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.59 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 40.5 t -115.11 136.05 53.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 178.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.795 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 8.2 mm100 -74.22 139.73 44.57 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.141 177.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.569 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.8 mm? -132.19 147.86 67.47 Favored Pre-proline 0 C--N 1.316 -0.862 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 172.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 11.6 Cg_exo -72.84 8.98 1.44 Allowed 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.682 2.255 . . . . 0.0 112.479 177.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -139.02 -59.35 0.59 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.394 0.616 . . . . 0.0 109.566 -177.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.569 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 13.1 m -121.62 -150.08 0.44 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.436 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HG2' ' NH1' ' A' ' 25' ' ' ARG . 2.7 pt-20 -151.21 147.8 27.45 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 177.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.59 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 22.5 mm -91.44 129.42 42.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.259 176.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.446 ' HB3' ' ND2' ' A' ' 84' ' ' ASN . 45.7 mt-30 -139.09 130.22 26.66 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.102 -178.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -173.6 160.56 3.81 Favored 'General case' 0 N--CA 1.463 0.21 0 O-C-N 123.403 0.439 . . . . 0.0 111.146 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.516 ' O ' ' HE2' ' A' ' 56' ' ' LYS . 1.3 m -79.27 147.25 32.6 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 168.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.516 ' HE2' ' O ' ' A' ' 55' ' ' CYS . 7.1 tppt? -156.96 132.5 9.31 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.154 -179.062 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.741 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 38.1 m -54.28 143.17 23.97 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.753 178.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.627 ' HA ' ' CG ' ' A' ' 41' ' ' ARG . 20.1 t -44.84 -61.46 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 123.796 0.685 . . . . 0.0 111.511 -173.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -57.51 -52.36 65.71 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.161 178.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.675 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -54.56 -47.48 73.19 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.86 -176.625 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.66 ' HA ' HG22 ' A' ' 64' ' ' VAL . 4.2 t -65.9 -32.8 74.52 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.382 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.36 -41.35 85.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.217 0.532 . . . . 0.0 110.835 176.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.675 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 9.1 pt-20 -74.52 -38.07 62.9 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.552 -176.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.66 HG22 ' HA ' ' A' ' 61' ' ' CYS . 13.5 m -72.23 -26.32 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-O 121.428 0.632 . . . . 0.0 110.414 174.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.66 HD23 ' SG ' ' A' ' 77' ' ' CYS . 0.2 OUTLIER -56.02 -47.64 77.42 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 174.059 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -72.7 -36.56 67.87 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.054 -174.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.64 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.5 pt-20 -59.6 -43.68 93.64 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.236 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.54 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 35.0 m -79.17 -34.42 16.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.951 0.405 . . . . 0.0 111.552 -178.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 97.8 m -78.42 -15.67 58.42 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.165 0.507 . . . . 0.0 110.861 -176.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.64 -19.56 45.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.082 173.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.514 HG13 ' O ' ' A' ' 67' ' ' GLU . 29.9 mt -81.0 -27.11 10.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.864 177.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 119.76 4.18 11.84 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 119.891 -1.147 . . . . 0.0 112.306 -178.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -97.82 112.4 61.52 Favored Pre-proline 0 N--CA 1.449 -0.499 0 CA-C-O 120.536 0.208 . . . . 0.0 110.797 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.795 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 54.4 Cg_exo -58.29 134.98 65.13 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.11 2.54 . . . . 0.0 112.306 177.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -143.29 160.92 39.6 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 119.983 -0.687 . . . . 0.0 111.427 178.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.412 ' HE3' ' HB3' ' A' ' 76' ' ' LYS . 7.6 ptpp? -142.19 147.58 36.82 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.917 175.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.66 ' SG ' HD23 ' A' ' 65' ' ' LEU . 76.6 m -130.24 87.08 2.46 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.151 173.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 15.4 p -106.95 171.02 7.6 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 119.943 -0.703 . . . . 0.0 111.475 -175.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . 0.508 ' HB3' ' CZ ' ' A' ' 41' ' ' ARG . 10.0 p -115.35 107.08 14.77 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.085 0.469 . . . . 0.0 111.486 -174.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.536 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 23.7 tt0 177.63 153.17 0.27 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.697 ' HB3' HD22 ' A' ' 82' ' ' LEU . 62.2 m-20 -64.43 137.31 57.81 Favored 'General case' 0 CA--C 1.505 -0.765 0 C-N-CA 117.563 -1.655 . . . . 0.0 108.66 173.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.697 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.99 15.8 10.19 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.607 175.12 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . 0.536 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.2 t -64.83 -23.42 67.23 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.654 -172.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.616 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 19.5 p-10 . . . . . 0 N--CA 1.45 -0.429 0 CA-C-O 122.03 0.919 . . . . 0.0 110.606 -179.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 46.2 tp . . . . . 0 C--O 1.235 0.303 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.512 ' HA ' ' O ' ' A' ' 33' ' ' THR . 9.9 mtmp? -91.44 102.9 15.58 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 120.449 -0.5 . . . . 0.0 111.306 178.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 30.4 m -111.26 139.34 46.73 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 178.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.666 ' N ' HD21 ' A' ' 84' ' ' ASN . 19.0 m-85 -54.24 123.86 14.07 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.893 175.248 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -100.61 167.36 10.39 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 171.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.569 ' HG3' ' HB2' ' A' ' 53' ' ' GLN . 7.2 mtp180 . . . . . 0 C--N 1.324 -0.528 0 C-N-CA 120.062 -0.655 . . . . 0.0 112.241 178.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.2 mmt85 . . . . . 0 N--CA 1.446 -0.666 0 CA-C-O 121.351 0.596 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.3 m -114.28 114.9 26.58 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.53 -169.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.4 HG22 ' CE1' ' A' ' 23' ' ' PHE . 48.6 t -80.01 106.37 11.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 174.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.512 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 47.2 p -128.48 142.74 50.99 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.313 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 t -85.43 121.73 28.56 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 165.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.4 t -87.66 -163.39 0.93 Allowed 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.536 -172.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.27 168.67 12.52 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.65 -0.42 . . . . 0.0 111.04 -176.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -60.21 -18.68 50.05 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.042 178.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.812 ' HG2' HG22 ' A' ' 57' ' ' THR . 19.1 tt0 -63.63 -40.94 98.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.44 176.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.406 ' OE1' ' HB3' ' A' ' 38' ' ' GLU . 22.0 mp0 -96.98 120.88 38.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.656 0.741 . . . . 0.0 112.741 -169.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.428 ' OG1' HG23 ' A' ' 58' ' ' VAL . 1.1 p -124.92 12.53 8.43 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.552 -1.204 . . . . 0.0 110.582 177.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.512 ' CG ' ' HB3' ' A' ' 77' ' ' CYS . 8.2 tpp85 -138.18 173.4 11.66 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.489 177.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.651 ' HB3' ' OD1' ' A' ' 84' ' ' ASN . 18.1 m -126.36 149.31 49.28 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.557 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.3 OUTLIER -110.1 122.03 46.64 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 123.147 0.279 . . . . 0.0 110.298 -176.231 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.618 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 50.2 t80 -133.12 104.06 6.32 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.487 173.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.531 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 61.8 t -101.48 134.36 42.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.746 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 1.6 mm100 -76.78 138.07 39.66 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 119.777 -0.769 . . . . 0.0 109.637 177.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.48 HD22 ' C ' ' A' ' 46' ' ' GLN . 2.9 mm? -138.51 152.38 70.96 Favored Pre-proline 0 C--N 1.314 -0.978 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.762 176.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -86.32 9.42 4.04 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 122.438 2.092 . . . . 0.0 111.424 172.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -125.0 -65.39 1.03 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.842 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.3 m -151.85 132.24 13.75 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.13 149.85 37.29 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.79 0.329 . . . . 0.0 110.542 -172.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.618 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 65.8 mt -90.95 124.91 43.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.377 178.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.569 ' HB2' ' HG3' ' A' ' 25' ' ' ARG . 48.5 mt-30 -135.85 129.96 33.16 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -176.25 163.69 2.6 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 123.419 0.449 . . . . 0.0 110.979 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 2.0 p -85.88 135.87 33.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.724 0.297 . . . . 0.0 110.585 177.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.559 ' HB2' ' HB2' ' A' ' 61' ' ' CYS . 68.1 mmtt -138.71 158.76 43.64 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 176.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.812 HG22 ' HG2' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -69.54 155.2 40.85 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.605 -1.258 . . . . 0.0 107.605 171.722 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.478 ' HA ' ' HB2' ' A' ' 41' ' ' ARG . 85.3 t -52.76 -46.09 50.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.254 -0.579 . . . . 0.0 109.92 179.077 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.582 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 37.5 tt0 -66.87 -55.56 14.2 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.117 178.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.806 ' O ' HG13 ' A' ' 64' ' ' VAL . 7.8 tt0 -54.84 -40.23 69.4 Favored 'General case' 0 C--O 1.212 -0.887 0 O-C-N 123.331 0.394 . . . . 0.0 110.594 -175.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.668 ' HA ' HG22 ' A' ' 64' ' ' VAL . 3.8 t -69.93 -32.19 70.35 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.711 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.37 -38.75 85.24 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.059 171.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.582 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 11.5 mm-40 -57.61 -52.71 64.3 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 122.114 0.959 . . . . 0.0 110.202 175.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.806 HG13 ' O ' ' A' ' 60' ' ' GLN . 4.2 m -71.06 -26.06 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.79 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.84 -178.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.662 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -56.09 -49.33 74.13 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 175.23 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -72.88 -37.11 67.43 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 120.562 -0.455 . . . . 0.0 112.011 -174.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.645 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 12.1 pt-20 -59.25 -42.95 92.33 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.109 -0.637 . . . . 0.0 110.355 -179.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.499 HG22 ' O ' ' A' ' 64' ' ' VAL . 34.8 m -79.3 -36.37 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-O 120.827 0.346 . . . . 0.0 111.691 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 98.3 m -74.75 -20.74 59.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.994 -175.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.61 -23.7 58.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.152 0.501 . . . . 0.0 110.149 174.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.497 HG13 ' O ' ' A' ' 67' ' ' GLU . 12.1 mt -81.03 -23.85 10.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.666 177.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.463 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 112.87 5.82 23.41 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.979 -178.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -98.66 107.94 45.61 Favored Pre-proline 0 N--CA 1.449 -0.475 0 CA-C-O 120.777 0.322 . . . . 0.0 111.081 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.746 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 74.9 Cg_exo -55.38 130.75 42.26 Favored 'Trans proline' 0 C--N 1.34 0.118 0 C-N-CA 123.478 2.785 . . . . 0.0 113.262 177.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.662 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -128.38 154.51 45.92 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.889 174.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -134.61 118.81 17.62 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.885 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.592 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 45.9 m -114.34 93.85 4.53 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.187 173.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 17.8 p -109.33 155.1 21.6 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.944 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 49.6 t -109.48 103.44 12.34 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 119.991 -0.684 . . . . 0.0 110.469 -174.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.511 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 14.4 tt0 -173.87 152.67 2.01 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 -179.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.722 ' HB3' HD22 ' A' ' 82' ' ' LEU . 28.7 m-20 -63.48 136.43 57.58 Favored 'General case' 0 CA--C 1.504 -0.812 0 C-N-CA 117.878 -1.529 . . . . 0.0 109.389 176.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.722 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 62.38 21.53 12.61 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.114 174.654 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . 0.511 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.1 t -68.43 -37.03 79.91 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.559 -172.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.666 HD21 ' N ' ' A' ' 23' ' ' PHE . 0.3 OUTLIER . . . . . 0 N--CA 1.453 -0.324 0 C-N-CA 119.085 -1.046 . . . . 0.0 109.528 175.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.627 HD23 HG22 ' A' ' 40' ' ' THR . 2.6 mm? . . . . . 0 N--CA 1.453 -0.297 0 CA-C-O 120.758 0.313 . . . . 0.0 110.829 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.761 ' HE3' ' N ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -83.92 124.49 31.05 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 171.689 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.624 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 12.3 t -147.47 153.54 39.67 Favored 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 119.399 -0.921 . . . . 0.0 109.972 -177.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.737 ' H ' HD21 ' A' ' 84' ' ' ASN . 92.1 m-85 -84.55 123.13 29.96 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 119.179 -1.009 . . . . 0.0 109.354 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.5 m -113.78 131.42 56.22 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 175.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 25' ' ' ARG . 1.8 tpp180 . . . . . 0 C--N 1.322 -0.594 0 CA-C-O 121.059 0.457 . . . . 0.0 110.379 -178.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 30' ' ' ARG . 27.4 mtp-105 . . . . . 0 N--CA 1.452 -0.365 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.499 ' O ' ' HA ' ' A' ' 23' ' ' PHE . 9.1 t -140.15 163.97 31.3 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.753 -173.094 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.413 HG13 ' HB3' ' A' ' 21' ' ' LYS . 94.8 t -79.12 120.78 30.98 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.236 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.396 178.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.3 p -113.21 141.49 46.9 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.171 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.7 t -87.11 111.93 21.42 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 174.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.1 m -107.2 157.54 17.8 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.924 -171.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.12 170.99 10.39 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -167.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -52.68 -39.06 61.54 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.449 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 39' ' ' GLN . 4.5 pt-20 -56.85 -40.81 76.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.828 177.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.622 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 70.5 mt-30 -97.21 64.96 1.96 Allowed 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.797 -174.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.627 HG22 HD23 ' A' ' 20' ' ' LEU . 0.7 OUTLIER -89.71 27.28 1.56 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.433 0.635 . . . . 0.0 110.427 177.461 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.61 ' HD3' HG22 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -136.23 177.78 7.57 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.979 178.253 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.8 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.0 m -137.21 131.28 32.22 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.809 179.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.456 ' HG ' ' SG ' ' A' ' 61' ' ' CYS . 0.5 OUTLIER -94.01 118.43 31.5 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 176.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.558 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 91.5 t80 -134.76 118.83 17.49 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.226 175.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.569 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 58.8 t -125.29 141.59 44.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.982 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.991 HE21 ' HA ' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -83.52 137.1 34.02 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.138 0.494 . . . . 0.0 110.901 177.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.581 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.7 mm? -131.9 154.02 81.6 Favored Pre-proline 0 C--N 1.319 -0.744 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 175.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.91 18.72 1.43 Allowed 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.28 1.986 . . . . 0.0 112.267 177.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -138.35 -44.43 0.5 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.461 0.648 . . . . 0.0 109.747 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.581 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 48.1 m -150.77 -151.39 0.39 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 178.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.29 153.78 42.37 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.264 175.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.569 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 14.3 mm -87.65 127.01 41.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.491 177.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.533 ' HB3' ' O ' ' A' ' 23' ' ' PHE . 83.5 mt-30 -140.69 129.11 22.57 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 123.556 0.535 . . . . 0.0 110.232 176.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.48 ' OE2' HG23 ' A' ' 52' ' ' ILE . 0.5 OUTLIER -174.03 146.1 1.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.936 -177.314 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.624 ' SG ' ' HB3' ' A' ' 22' ' ' CYS . 88.2 m -79.91 118.67 21.87 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 119.984 -0.687 . . . . 0.0 109.223 169.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -124.0 156.18 36.92 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 174.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.622 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 15.6 p -67.34 153.8 42.84 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 119.405 -0.918 . . . . 0.0 109.435 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.61 HG22 ' HD3' ' A' ' 41' ' ' ARG . 58.7 t -53.31 -46.67 57.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 121.221 -0.192 . . . . 0.0 111.105 -175.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -62.3 -55.82 24.48 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 120.903 0.382 . . . . 0.0 111.234 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.6 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 58.5 tt0 -64.14 -42.86 96.64 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.59 -172.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.652 ' HA ' HG22 ' A' ' 64' ' ' VAL . 4.7 t -64.52 -31.5 72.73 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.5 -0.48 . . . . 0.0 109.84 178.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.436 ' O ' ' HB3' ' A' ' 65' ' ' LEU . . . -69.68 -40.07 76.6 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.546 -0.462 . . . . 0.0 111.209 176.445 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.6 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 12.4 pt-20 -72.85 -38.47 67.06 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.95 0.405 . . . . 0.0 110.653 -178.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.652 HG22 ' HA ' ' A' ' 61' ' ' CYS . 12.8 m -73.56 -26.39 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.366 0 CA-C-O 121.638 0.732 . . . . 0.0 110.446 174.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.558 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 25.6 tp -54.94 -47.46 74.42 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 174.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.555 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 40.0 tt0 -73.98 -39.84 63.39 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.486 -175.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.644 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.0 pt-20 -55.24 -45.28 76.03 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.549 -177.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.591 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 33.0 m -80.16 -32.93 13.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.555 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 13.9 p -70.19 -27.98 64.94 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.217 -178.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.32 -19.74 63.87 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.629 176.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 11.3 mt -87.85 -20.31 7.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.827 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 114.51 -1.88 23.5 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 119.935 -1.126 . . . . 0.0 112.648 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.419 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 80.4 m-85 -78.71 123.51 85.36 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.663 0.232 . . . . 0.0 111.155 -178.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.651 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 52.8 Cg_exo -62.0 117.68 4.53 Favored 'Trans proline' 0 CA--C 1.516 -0.394 0 C-N-CA 123.045 2.497 . . . . 0.0 111.973 175.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.476 ' HA ' ' O ' ' A' ' 44' ' ' PHE . . . -135.22 149.4 49.87 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.811 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 ptmt -150.15 112.64 4.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.483 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.8 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 29.6 m -103.23 92.56 4.56 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.569 170.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.3 p -107.84 160.39 15.78 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.654 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 7.9 p -109.42 101.36 10.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.991 0.424 . . . . 0.0 111.029 -175.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.569 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 3.4 tt0 179.64 152.04 0.41 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -179.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.671 ' HB3' HD22 ' A' ' 82' ' ' LEU . 78.0 m-20 -64.37 132.54 50.4 Favored 'General case' 0 CA--C 1.506 -0.714 0 C-N-CA 118.388 -1.325 . . . . 0.0 109.981 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.671 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.54 16.84 10.53 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.531 172.883 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . 0.569 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 39.6 t -61.37 -18.54 59.22 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -172.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.737 HD21 ' H ' ' A' ' 23' ' ' PHE . 4.3 p30 . . . . . 0 CA--C 1.541 0.599 0 CA-C-O 119.234 -0.412 . . . . 0.0 110.474 -179.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 mm? . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.508 ' HG2' ' HB ' ' A' ' 34' ' ' THR . 29.0 mtmm -120.9 98.57 6.06 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 119.471 -0.892 . . . . 0.0 110.808 176.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.2 m -107.17 151.62 25.17 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.262 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -73.28 153.56 40.53 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.823 179.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.4 m -142.11 127.91 19.32 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.41 177.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.758 HH11 ' HG2' ' A' ' 51' ' ' GLU . 63.0 mtp180 . . . . . 0 C--N 1.327 -0.392 0 C-N-CA 119.379 -0.929 . . . . 0.0 111.161 -178.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.552 ' HB3' ' HG2' ' A' ' 25' ' ' ARG . 15.0 ptp180 . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 121.096 0.474 . . . . 0.0 110.562 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 19.1 p -94.99 157.02 16.08 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.199 -178.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 61.8 t -99.31 112.81 32.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 176.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.484 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 41.3 p -107.64 148.01 29.9 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.394 176.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.508 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 1.7 t -101.92 112.28 24.85 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.753 176.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 39' ' ' GLN . 1.6 p -95.12 162.55 13.66 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.4 -175.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.53 178.04 7.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.749 -173.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -51.23 -33.07 26.28 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.494 0.664 . . . . 0.0 110.343 174.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.51 ' HG2' HG22 ' A' ' 57' ' ' THR . 39.8 tt0 -51.3 -49.61 60.95 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.387 -1.278 . . . . 0.0 110.939 175.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.564 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 34.8 mm-40 -96.76 94.29 7.19 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 119.715 -0.794 . . . . 0.0 109.67 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.8 18.87 20.82 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.591 177.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.741 ' HG2' ' SG ' ' A' ' 61' ' ' CYS . 2.8 tpt180 -131.29 174.45 10.04 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.502 174.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.669 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.1 m -134.01 131.07 38.47 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.338 -0.847 . . . . 0.0 108.739 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.562 HD22 HG23 ' A' ' 45' ' ' VAL . 0.2 OUTLIER -91.79 128.91 37.81 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -179.328 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.553 ' HB2' ' HB2' ' A' ' 84' ' ' ASN . 24.9 t80 -138.36 102.14 4.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.323 172.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.606 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 31.8 t -105.35 133.95 48.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 175.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.881 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -97.68 134.01 41.44 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.013 -179.118 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.519 HD23 ' HA ' ' A' ' 51' ' ' GLU . 3.7 mm? -119.48 157.85 50.58 Favored Pre-proline 0 C--N 1.319 -0.734 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.38 -28.41 87.51 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.473 2.115 . . . . 0.0 113.013 -178.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -135.31 9.76 3.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.822 0.344 . . . . 0.0 111.021 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.452 ' C ' ' HB2' ' A' ' 47' ' ' LEU . 37.2 m -156.58 -166.63 2.18 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.528 -0.469 . . . . 0.0 109.97 -175.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.758 ' HG2' HH11 ' A' ' 25' ' ' ARG . 7.7 pt-20 -165.6 151.05 9.07 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 175.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.606 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 24.7 mm -105.87 128.39 60.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.457 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.435 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 17.7 mt-30 -139.2 130.56 26.94 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.999 -0.68 . . . . 0.0 110.124 -179.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -165.74 158.73 15.55 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.678 -178.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.422 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 6.3 m -77.98 117.51 19.38 Favored 'General case' 0 CA--C 1.507 -0.687 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 163.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.422 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 11.1 mptt -123.86 144.93 49.45 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 176.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.564 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 21.9 p -63.01 156.86 23.44 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 118.925 -1.11 . . . . 0.0 108.127 -178.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.56 HG22 ' HD3' ' A' ' 41' ' ' ARG . 57.6 t -58.17 -37.04 60.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.033 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -65.52 -55.68 16.48 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.981 177.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.633 ' O ' HG13 ' A' ' 64' ' ' VAL . 34.1 tt0 -64.06 -28.59 69.89 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.23 -175.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.741 ' SG ' ' HG2' ' A' ' 41' ' ' ARG . 0.5 OUTLIER -67.86 -33.84 75.54 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.997 178.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.12 -40.41 78.31 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 174.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.567 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 88.1 mt-10 -58.45 -53.2 61.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.647 177.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.637 HG22 ' HA ' ' A' ' 61' ' ' CYS . 17.7 m -72.8 -28.89 28.14 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.569 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.661 -177.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.607 HD12 ' HB3' ' A' ' 75' ' ' ALA . 52.5 tp -58.93 -50.79 72.71 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.617 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -75.21 -36.38 61.39 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.331 -176.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.625 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.4 pt-20 -56.33 -47.65 78.32 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.59 -176.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.599 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.6 m -80.67 -34.97 14.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 C-N-CA 120.809 -0.357 . . . . 0.0 111.806 -179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 89.7 m -67.76 -28.61 67.77 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.855 0.36 . . . . 0.0 110.955 -177.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.58 -21.52 62.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.992 0.425 . . . . 0.0 110.682 176.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 67' ' ' GLU . 8.9 mt -87.22 -20.13 7.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.269 0.557 . . . . 0.0 109.753 178.07 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 115.49 -1.12 22.04 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.015 -1.088 . . . . 0.0 112.494 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.518 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 63.1 m-85 -87.58 116.88 67.57 Favored Pre-proline 0 N--CA 1.448 -0.529 0 CA-C-O 120.596 0.236 . . . . 0.0 110.547 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.881 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 46.6 Cg_exo -63.08 129.08 24.63 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 123.193 2.595 . . . . 0.0 112.616 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.607 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -138.34 162.4 34.47 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.079 -0.649 . . . . 0.0 111.796 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.77 154.36 38.35 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.317 168.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.669 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 9.4 p -129.62 111.64 12.9 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-O 121.759 0.79 . . . . 0.0 109.912 164.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 2.5 p -106.08 153.21 22.39 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.174 179.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . 0.444 ' HB3' ' HD2' ' A' ' 41' ' ' ARG . 7.7 p -109.64 100.23 9.3 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.424 -0.51 . . . . 0.0 109.893 177.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 173.45 145.08 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -177.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.686 ' HB3' HD22 ' A' ' 82' ' ' LEU . 70.8 m-20 -61.65 139.24 58.31 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.328 -0.949 . . . . 0.0 110.593 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.686 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 62.82 17.81 10.21 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.582 171.738 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 14.7 p -79.58 -37.62 35.92 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.011 -175.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.553 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 20.4 p-10 . . . . . 0 N--CA 1.465 0.305 0 CA-C-O 121.149 0.499 . . . . 0.0 110.607 -177.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 30.2 tp . . . . . 0 C--O 1.235 0.294 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -118.08 109.58 16.6 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 119.556 -0.858 . . . . 0.0 111.273 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 38.7 m -128.81 163.27 25.57 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.674 -0.411 . . . . 0.0 110.679 175.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.474 ' HB3' ' HB3' ' A' ' 30' ' ' ARG . 98.8 m-85 -78.51 124.97 28.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.925 -177.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.468 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 48.2 m -125.14 125.44 43.72 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 172.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.576 ' HA ' ' HA ' ' A' ' 30' ' ' ARG . 39.9 ttp85 . . . . . 0 C--N 1.322 -0.622 0 C-N-CA 119.924 -0.71 . . . . 0.0 110.821 -175.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.576 ' HA ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 121.147 0.499 . . . . 0.0 111.965 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 35.2 p -100.45 144.38 29.52 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.911 174.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.9 t -76.05 105.69 5.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 120.258 -0.577 . . . . 0.0 109.938 178.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.5 p -97.44 149.67 21.89 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.207 -176.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.9 t -89.51 112.48 23.66 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 174.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.73 147.22 23.55 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.603 -174.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.88 176.99 8.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.234 -0.439 . . . . 0.0 112.072 -174.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -56.21 -39.55 72.65 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.539 -177.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.831 ' HG3' ' HG3' ' A' ' 39' ' ' GLN . 9.5 pt-20 -61.7 -34.06 75.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.929 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.831 ' HG3' ' HG3' ' A' ' 38' ' ' GLU . 29.2 mt-30 -95.5 59.31 2.13 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.421 -173.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.405 ' O ' ' HD2' ' A' ' 41' ' ' ARG . 0.2 OUTLIER -83.97 7.21 19.08 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.062 0.458 . . . . 0.0 111.484 -178.963 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 1.004 ' HD3' HG22 ' A' ' 58' ' ' VAL . 7.3 mpt_? -120.24 177.38 5.04 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 168.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.778 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 59.8 m -145.62 130.15 17.88 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 119.741 -0.784 . . . . 0.0 110.284 -176.265 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.409 ' HA ' HD23 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -88.52 135.96 33.22 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.082 0.467 . . . . 0.0 110.933 -175.075 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.517 ' O ' ' HA ' ' A' ' 75' ' ' ALA . 20.1 t80 -139.71 109.23 6.21 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.979 -1.009 . . . . 0.0 108.673 170.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.585 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 27.8 t -115.04 123.79 71.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 173.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -94.32 116.28 28.64 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.436 0.636 . . . . 0.0 110.162 -178.074 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.616 ' HB2' ' O ' ' A' ' 50' ' ' SER . 2.3 mm? -111.15 156.37 41.12 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.59 -178.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -75.31 15.34 0.81 Allowed 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.01 2.473 . . . . 0.0 112.829 178.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -141.15 -45.98 0.38 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.539 0.685 . . . . 0.0 110.175 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.616 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 54.2 m -146.45 -163.08 1.66 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 177.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.498 ' HA ' HD23 ' A' ' 47' ' ' LEU . 29.7 mt-10 -142.88 152.04 41.69 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 119.928 -0.709 . . . . 0.0 111.025 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.585 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 49.8 mt -103.28 102.63 13.92 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.583 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.019 176.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.468 ' O ' ' HA ' ' A' ' 24' ' ' THR . 54.0 mt-30 -124.75 130.61 52.74 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 119.799 -0.761 . . . . 0.0 109.878 178.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -168.7 167.75 11.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.91 -176.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 16.3 m -90.99 119.49 31.22 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.692 -0.803 . . . . 0.0 108.9 171.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -121.23 139.99 52.64 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.493 -174.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.59 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 30.5 p -64.3 147.24 52.92 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 119.891 -0.723 . . . . 0.0 109.852 -178.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 1.004 HG22 ' HD3' ' A' ' 41' ' ' ARG . 25.0 t -51.65 -50.02 32.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 O-C-N 123.439 0.462 . . . . 0.0 112.145 -171.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.6 ' HG3' ' HG2' ' A' ' 60' ' ' GLN . 17.6 pt20 -63.03 -48.44 78.74 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 120.874 0.369 . . . . 0.0 111.872 -176.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.624 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 0.4 OUTLIER -69.5 -38.49 77.63 Favored 'General case' 0 C--O 1.212 -0.919 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 -176.696 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.633 ' HA ' HG22 ' A' ' 64' ' ' VAL . 0.8 OUTLIER -60.96 -33.15 72.75 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.404 -178.728 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.63 -47.46 75.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.972 0.415 . . . . 0.0 110.454 177.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.624 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 8.2 pt-20 -72.16 -36.85 69.41 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.032 -176.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.633 HG22 ' HA ' ' A' ' 61' ' ' CYS . 14.4 m -74.41 -27.21 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 CA-C-O 121.524 0.678 . . . . 0.0 110.553 177.012 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 58.3 tp -59.08 -49.42 77.94 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 174.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.561 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 44.0 mt-10 -74.1 -32.04 63.05 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.556 -175.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.629 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.5 pt-20 -61.4 -44.96 96.24 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 120.159 -0.617 . . . . 0.0 109.929 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.557 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 33.6 m -80.21 -32.47 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.561 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 27.7 p -73.77 -25.29 60.07 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 120.201 -0.6 . . . . 0.0 111.203 -178.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.07 -21.45 63.15 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.061 0.458 . . . . 0.0 110.275 175.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 67' ' ' GLU . 16.4 mt -82.47 -18.43 10.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.515 176.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 105.48 9.06 34.17 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.197 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -89.76 122.52 67.96 Favored Pre-proline 0 N--CA 1.448 -0.561 0 CA-C-O 120.974 0.416 . . . . 0.0 111.749 -178.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_exo -51.95 124.93 15.77 Favored 'Trans proline' 0 N--CA 1.471 0.174 0 C-N-CA 123.929 3.086 . . . . 0.0 112.566 174.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.517 ' HA ' ' O ' ' A' ' 44' ' ' PHE . . . -151.93 157.85 42.36 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 119.955 -0.698 . . . . 0.0 112.09 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -155.5 147.07 22.98 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.956 172.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.778 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 27.6 p -130.84 94.51 3.63 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.536 0.684 . . . . 0.0 109.513 165.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 6.0 p -106.98 166.92 10.25 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.932 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 9.2 p -109.26 105.33 14.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.932 0.396 . . . . 0.0 110.991 -175.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.585 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 4.3 tt0 175.25 147.36 0.08 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 -176.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.702 ' HB3' HD22 ' A' ' 82' ' ' LEU . 16.5 m-20 -61.84 135.71 57.69 Favored 'General case' 0 CA--C 1.504 -0.825 0 C-N-CA 118.979 -1.088 . . . . 0.0 109.312 175.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.702 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 63.6 19.42 11.7 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.238 175.427 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . 0.585 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.2 t -73.57 -31.58 63.68 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.666 -176.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.416 ' HB3' ' CB ' ' A' ' 42' ' ' CYS . 22.0 p-10 . . . . . 0 C--N 1.322 -0.605 0 C-N-CA 120.164 -0.615 . . . . 0.0 110.012 178.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 30.2 tp . . . . . 0 C--O 1.234 0.246 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt -111.26 98.67 7.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.099 0.476 . . . . 0.0 111.205 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.441 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 18.0 m -108.02 153.44 23.1 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 175.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -71.87 134.98 46.4 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.089 -0.645 . . . . 0.0 110.287 175.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.5 p -115.45 118.32 32.85 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 172.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.512 ' HD3' ' O ' ' A' ' 51' ' ' GLU . 32.5 ttt85 . . . . . 0 C--N 1.322 -0.591 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.071 -178.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.443 HH11 ' HD3' ' A' ' 30' ' ' ARG . 9.4 ptp180 . . . . . 0 N--CA 1.446 -0.635 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -103.83 136.37 43.64 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.478 -172.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.2 t -75.47 106.63 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 169.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 40.2 p -121.25 131.75 54.4 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 119.841 -0.743 . . . . 0.0 110.938 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.415 HG22 ' H ' ' A' ' 34' ' ' THR . 1.5 t -72.84 116.57 13.5 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 169.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.83 177.9 7.15 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -174.48 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.523 ' HB3' ' OE1' ' A' ' 38' ' ' GLU . . . -66.36 161.09 23.27 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 119.267 -0.973 . . . . 0.0 109.257 178.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -80.44 -6.81 58.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -165.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.523 ' OE1' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -80.19 -30.42 38.76 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.118 173.089 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.65 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 30.3 mt-30 -80.46 97.25 7.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.119 179.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.26 11.31 33.09 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.411 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.839 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 18.0 mmt85 -129.33 179.37 5.82 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.437 0.637 . . . . 0.0 110.676 175.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.63 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 82.9 m -136.48 132.88 35.93 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.738 -171.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.401 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.3 OUTLIER -104.14 125.68 50.64 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.007 -172.185 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.828 ' HD2' ' HD3' ' A' ' 76' ' ' LYS . 49.7 t80 -141.15 124.88 16.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.572 172.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.513 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 41.4 t -121.54 140.53 45.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.366 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.743 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 10.0 mm100 -72.72 134.07 44.86 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.095 0.247 . . . . 0.0 110.875 178.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.503 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.2 mm? -129.95 143.93 51.03 Favored Pre-proline 0 C--N 1.326 -0.437 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 174.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 7.2 Cg_exo -75.19 28.54 0.37 Allowed 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 123.294 2.663 . . . . 0.0 113.226 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -172.13 -26.02 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.04 0.448 . . . . 0.0 111.088 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.503 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 70.2 m -149.7 -153.31 0.48 Allowed 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.512 ' O ' ' HD3' ' A' ' 25' ' ' ARG . 10.2 pt-20 -149.11 151.96 35.31 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.703 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 68.1 mt -101.93 131.09 50.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.049 175.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.401 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 39.1 mt-30 -138.87 130.73 27.78 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.737 ' HG2' ' HE2' ' A' ' 56' ' ' LYS . 2.9 tp10 -168.58 157.24 8.54 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 123.396 0.435 . . . . 0.0 109.863 -168.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 60.6 m -94.84 139.25 31.55 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 173.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.737 ' HE2' ' HG2' ' A' ' 54' ' ' GLU . 18.6 mmtt -147.0 149.41 33.09 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 176.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.65 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 68.3 p -66.48 153.16 43.6 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 175.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.687 HG22 ' HG2' ' A' ' 41' ' ' ARG . 19.9 t -48.67 -49.49 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 120.863 0.363 . . . . 0.0 110.63 -175.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -64.09 -57.08 10.65 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.766 -178.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.706 ' O ' HG13 ' A' ' 64' ' ' VAL . 96.2 mt-30 -63.75 -28.96 70.24 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.191 -175.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.674 ' HA ' HG22 ' A' ' 64' ' ' VAL . 5.4 t -71.36 -33.02 69.19 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.59 -35.95 70.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.079 0.466 . . . . 0.0 109.951 173.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.404 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 48.7 mt-10 -62.38 -52.28 64.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.573 175.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.706 HG13 ' O ' ' A' ' 60' ' ' GLN . 15.2 m -69.47 -26.65 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.615 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.417 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.576 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -58.08 -49.03 78.34 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 174.077 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -73.19 -33.87 65.65 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.009 -174.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.659 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.0 pt-20 -59.92 -42.7 94.49 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 119.826 -0.749 . . . . 0.0 110.132 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.503 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.2 m -80.01 -36.16 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 99.1 m -74.52 -29.19 61.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.34 -174.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.64 -21.95 64.44 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.561 174.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 67' ' ' GLU . 14.8 mt -79.14 -25.49 12.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 121.283 0.563 . . . . 0.0 109.91 177.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.437 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 113.88 11.39 12.69 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 119.811 -1.185 . . . . 0.0 111.972 -176.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -102.26 105.1 41.18 Favored Pre-proline 0 N--CA 1.451 -0.401 0 CA-C-O 120.658 0.266 . . . . 0.0 111.014 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.743 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 87.4 Cg_exo -52.18 128.56 27.7 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 123.377 2.718 . . . . 0.0 113.001 177.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.576 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -136.29 161.88 34.54 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.018 -0.673 . . . . 0.0 111.193 176.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.828 ' HD3' ' HD2' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -138.27 152.51 48.62 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.24 177.277 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.839 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 9.3 t -145.71 89.78 1.94 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.998 174.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 7.2 p -107.55 162.95 13.49 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.942 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . 0.482 ' HB2' ' HD3' ' A' ' 41' ' ' ARG . 45.4 t -109.15 107.94 18.41 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.421 -174.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.486 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 9.7 tp10 171.26 150.79 0.05 OUTLIER 'General case' 0 C--O 1.237 0.444 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -178.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.65 ' HB3' HD22 ' A' ' 82' ' ' LEU . 96.4 m-20 -59.66 138.64 57.68 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 119.24 -0.984 . . . . 0.0 109.674 175.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.65 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.58 13.72 8.46 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.963 172.556 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . 0.486 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 7.8 t -71.86 -30.39 65.38 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.33 -173.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.565 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 28.2 p-10 . . . . . 0 C--N 1.329 -0.311 0 CA-C-O 121.52 0.676 . . . . 0.0 110.362 179.066 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.451 HD23 HG22 ' A' ' 40' ' ' THR . 3.3 mm? . . . . . 0 C--O 1.235 0.333 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.442 ' HB3' ' CG1' ' A' ' 32' ' ' VAL . 19.0 mtpp -120.95 116.39 25.02 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 119.605 -0.838 . . . . 0.0 111.075 177.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.3 m -140.13 170.09 16.48 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.577 176.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -76.84 132.2 39.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.825 -176.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.3 m -130.07 158.29 40.03 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 175.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 15.1 mmm180 . . . . . 0 C--N 1.325 -0.472 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.94 -179.052 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 45.1 mtt180 . . . . . 0 N--CA 1.448 -0.556 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.5 m -113.49 131.44 56.04 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.098 -170.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.442 ' CG1' ' HB3' ' A' ' 21' ' ' LYS . 98.7 t -73.04 105.38 2.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 174.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.5 p -94.82 149.88 20.78 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.622 0.725 . . . . 0.0 111.479 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -72.56 127.16 31.71 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 161.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.401 ' HB3' ' OE1' ' A' ' 39' ' ' GLN . 0.8 OUTLIER -110.04 153.25 24.89 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 119.804 -0.758 . . . . 0.0 109.622 -179.252 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.82 164.99 11.33 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -172.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -58.21 -34.24 70.17 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.451 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.641 ' HG3' ' HG3' ' A' ' 39' ' ' GLN . 4.1 pt-20 -60.91 -38.57 86.19 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.42 0.629 . . . . 0.0 110.491 175.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.641 ' HG3' ' HG3' ' A' ' 38' ' ' GLU . 75.4 mt-30 -88.16 74.89 8.72 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.53 -174.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.451 HG22 HD23 ' A' ' 20' ' ' LEU . 0.9 OUTLIER -95.56 16.51 16.94 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.568 0.699 . . . . 0.0 110.33 177.734 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.877 ' HD3' HG22 ' A' ' 58' ' ' VAL . 0.6 OUTLIER -128.35 177.6 6.85 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.471 173.502 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.778 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.9 m -142.3 131.04 22.76 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.095 -178.225 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.498 HD22 HG23 ' A' ' 45' ' ' VAL . 0.2 OUTLIER -95.37 136.73 35.37 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.005 0.431 . . . . 0.0 110.722 -177.231 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.645 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 1.6 t80 -145.16 109.42 4.87 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.196 -0.911 . . . . 0.0 108.781 171.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.549 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 46.0 t -110.09 133.76 54.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.839 179.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.817 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 9.4 mm100 -77.81 140.82 39.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.877 0.37 . . . . 0.0 110.431 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.2 mm? -128.23 152.17 77.43 Favored Pre-proline 0 C--N 1.319 -0.759 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -70.87 -11.18 29.03 Favored 'Trans proline' 0 CA--C 1.529 0.258 0 C-N-CA 122.391 2.061 . . . . 0.0 112.622 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -135.86 -0.56 2.55 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.52 0.2 . . . . 0.0 111.434 -177.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.598 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 32.6 p -169.57 -163.92 0.41 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -175.154 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -148.5 152.45 36.9 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 177.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.645 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 74.7 mt -105.61 130.4 57.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.368 176.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -139.28 131.32 27.93 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 177.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -167.71 162.07 13.75 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 123.376 0.423 . . . . 0.0 110.706 -178.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 13.3 m -89.12 134.07 34.15 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.128 -0.629 . . . . 0.0 109.465 172.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.4 tppt? -138.46 153.05 48.81 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -176.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.568 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 10.9 p -73.62 152.12 40.63 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 119.468 -0.893 . . . . 0.0 109.154 178.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.877 HG22 ' HD3' ' A' ' 41' ' ' ARG . 50.7 t -59.19 -41.54 84.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 120.653 0.263 . . . . 0.0 111.517 -175.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.611 ' HG3' ' N ' ' A' ' 60' ' ' GLN . 12.3 pt20 -69.05 -48.0 63.92 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.663 -177.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.627 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -69.33 -37.49 77.73 Favored 'General case' 0 C--O 1.211 -0.94 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -176.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.672 ' SG ' ' HG2' ' A' ' 41' ' ' ARG . 1.9 p -61.65 -32.7 72.88 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.485 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.9 -47.19 75.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.917 0.389 . . . . 0.0 110.567 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.627 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 8.9 pt-20 -71.55 -37.76 71.07 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.9 -176.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.653 HG22 ' HA ' ' A' ' 61' ' ' CYS . 12.1 m -73.59 -26.52 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 121.566 0.698 . . . . 0.0 110.479 176.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.579 HD12 ' HB3' ' A' ' 75' ' ' ALA . 50.4 tp -58.33 -49.75 76.07 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.543 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 41.7 mt-10 -74.33 -33.1 63.06 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.432 -175.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.623 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.4 pt-20 -60.31 -45.85 91.95 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 120.254 -0.578 . . . . 0.0 110.139 -179.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.586 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 35.0 m -79.9 -32.62 14.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 C-N-CA 120.743 -0.383 . . . . 0.0 111.944 -178.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.543 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 21.3 p -71.27 -26.23 62.8 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 120.394 -0.522 . . . . 0.0 110.875 -178.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.64 -22.76 61.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.488 175.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 67' ' ' GLU . 19.0 mt -83.6 -25.68 7.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.767 177.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 121.39 -0.61 11.39 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 119.858 -1.163 . . . . 0.0 112.508 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.407 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 90.6 m-85 -85.93 115.27 61.1 Favored Pre-proline 0 N--CA 1.451 -0.385 0 CA-C-N 116.519 0.159 . . . . 0.0 110.863 -179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.817 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 33.6 Cg_exo -63.65 133.16 38.21 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.768 2.312 . . . . 0.0 111.402 174.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.579 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -146.89 163.32 36.48 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.343 -0.543 . . . . 0.0 111.59 -179.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.472 ' CG ' ' HB3' ' A' ' 44' ' ' PHE . 15.5 ptpt -143.99 150.11 37.77 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.638 174.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.778 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 27.7 p -139.92 98.21 3.41 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.79 0.805 . . . . 0.0 109.182 161.046 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.2 p -107.61 164.41 12.25 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.782 -178.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 7.5 p -107.93 100.77 10.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.349 0.595 . . . . 0.0 109.517 -178.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.534 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 24.8 tt0 175.13 137.64 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 -172.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.653 ' CB ' HD22 ' A' ' 82' ' ' LEU . 16.5 m-20 -62.06 139.02 58.46 Favored 'General case' 0 CA--C 1.505 -0.758 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.952 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.653 HD22 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.65 13.99 8.71 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.862 174.362 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . 0.534 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 47.4 t -71.43 -19.85 62.19 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.823 0.344 . . . . 0.0 111.59 -174.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.475 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 22.8 p-10 . . . . . 0 C--N 1.324 -0.509 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.596 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.6 tp . . . . . 0 CA--C 1.517 -0.289 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.5 mttt -82.22 141.27 33.13 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.972 178.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.567 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 6.6 t -161.66 153.89 19.7 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.602 -0.439 . . . . 0.0 109.851 -178.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -81.5 128.64 34.11 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.741 -0.383 . . . . 0.0 111.208 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 42.8 m -111.0 134.46 52.58 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 174.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.561 ' HD2' ' HB3' ' A' ' 30' ' ' ARG . 22.9 mmm-85 . . . . . 0 C--N 1.329 -0.291 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.827 -177.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.561 ' HB3' ' HD2' ' A' ' 25' ' ' ARG . 2.2 ptt180 . . . . . 0 N--CA 1.453 -0.289 0 CA-C-O 120.826 0.346 . . . . 0.0 110.125 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 94.2 m -99.12 138.4 36.27 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.827 -178.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 66.0 t -72.12 106.74 2.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 172.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.0 p -118.75 148.11 43.15 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.886 0.374 . . . . 0.0 111.266 -178.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.6 t -88.0 119.99 28.91 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 175.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.73 147.05 24.75 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 -177.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.82 166.57 19.09 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -172.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -55.75 -36.54 67.39 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.51 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.495 ' HG3' ' H ' ' A' ' 39' ' ' GLN . 2.9 pt-20 -50.57 -48.31 57.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.741 175.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.691 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 36.6 mt-30 -101.1 78.54 1.92 Allowed 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.141 -176.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.67 12.62 22.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.713 -175.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 1.011 ' HD3' ' SG ' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -121.51 177.94 5.01 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.377 0.608 . . . . 0.0 110.142 173.908 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.586 ' HB3' ' HB3' ' A' ' 84' ' ' ASN . 66.7 m -129.22 172.83 11.07 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.123 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.57 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.4 OUTLIER -127.98 113.34 15.71 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.533 176.508 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.665 ' HD2' ' HD2' ' A' ' 76' ' ' LYS . 2.6 t80 -124.8 99.52 6.19 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 172.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.608 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 19.2 t -104.34 133.0 49.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.054 -0.976 . . . . 0.0 108.741 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.822 ' CG ' ' HB2' ' A' ' 74' ' ' PRO . 0.8 OUTLIER -83.42 141.04 32.0 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 120.006 -0.677 . . . . 0.0 110.001 179.592 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.777 HD21 HG12 ' A' ' 52' ' ' ILE . 3.7 mm? -133.62 152.02 78.24 Favored Pre-proline 0 C--N 1.317 -0.817 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.29 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -78.57 3.22 7.43 Favored 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 122.755 2.303 . . . . 0.0 111.583 171.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -124.25 -31.99 3.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.875 -176.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.683 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 11.4 p -169.36 -154.95 0.13 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.636 -173.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.79 131.83 26.23 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.409 176.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.777 HG12 HD21 ' A' ' 47' ' ' LEU . 26.5 mm -82.54 129.12 37.99 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.204 176.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.629 ' HB3' ' ND2' ' A' ' 84' ' ' ASN . 6.5 mt-30 -135.84 131.85 35.87 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -167.25 150.21 6.26 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 123.529 0.518 . . . . 0.0 109.781 -170.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.567 ' SG ' ' HB3' ' A' ' 22' ' ' CYS . 6.4 m -93.01 132.39 37.15 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 172.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.453 ' HD3' ' HA ' ' A' ' 56' ' ' LYS . 3.3 tppt? -138.94 156.22 47.43 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 119.027 -1.069 . . . . 0.0 110.686 -178.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.691 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 35.4 p -66.28 153.41 42.67 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 177.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.622 ' HA ' ' HG3' ' A' ' 41' ' ' ARG . 20.9 t -59.29 -47.58 89.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 120.997 0.427 . . . . 0.0 110.663 -175.068 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -56.94 -55.72 30.9 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.054 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.59 ' O ' HG13 ' A' ' 64' ' ' VAL . 20.6 mt-30 -68.66 -25.56 64.87 Favored 'General case' 0 C--O 1.2 -1.552 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.605 -174.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.596 ' HA ' HG22 ' A' ' 64' ' ' VAL . 0.6 OUTLIER -63.35 -33.88 76.51 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.115 -0.634 . . . . 0.0 109.891 178.519 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.56 -39.62 73.84 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.091 0.472 . . . . 0.0 110.225 174.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -62.46 -52.42 63.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.834 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.633 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 16.2 m -68.71 -28.15 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.397 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 28.8 tp -58.02 -49.74 75.82 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 176.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.58 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 39.7 tt0 -73.88 -36.03 64.76 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.363 -175.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.633 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -58.24 -43.68 87.91 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.276 -177.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.544 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.0 m -79.7 -31.73 14.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 C-N-CA 120.48 -0.488 . . . . 0.0 111.714 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.58 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 37.7 p -72.98 -21.29 60.88 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.995 -179.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.09 -19.99 59.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.088 0.47 . . . . 0.0 110.27 176.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 10.7 mt -86.24 -15.92 9.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.334 176.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 108.9 -0.31 31.85 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.366 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -90.72 116.56 66.67 Favored Pre-proline 0 N--CA 1.448 -0.525 0 CA-C-O 120.692 0.282 . . . . 0.0 111.221 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.822 ' HB2' ' CG ' ' A' ' 46' ' ' GLN . 52.8 Cg_exo -58.24 140.66 95.13 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 123.169 2.579 . . . . 0.0 112.124 175.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.464 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -148.79 168.62 22.46 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.614 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.665 ' HD2' ' HD2' ' A' ' 44' ' ' PHE . 6.0 ptpp? -154.34 139.08 17.05 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.749 171.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 31.0 p -116.81 104.86 11.75 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 166.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.2 p -106.72 162.27 13.92 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 119.929 -0.708 . . . . 0.0 112.089 -178.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . 1.011 ' SG ' ' HD3' ' A' ' 41' ' ' ARG . 33.6 m -109.24 101.57 10.58 Favored 'General case' 0 CA--C 1.523 -0.076 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.909 175.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.588 ' HB3' ' HB3' ' A' ' 83' ' ' CYS . 16.0 tt0 176.85 141.46 0.07 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -177.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.748 ' HB3' HD22 ' A' ' 82' ' ' LEU . 15.9 m-20 -58.64 129.55 42.62 Favored 'General case' 0 CA--C 1.503 -0.828 0 C-N-CA 119.641 -0.824 . . . . 0.0 110.095 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.748 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.3 OUTLIER 64.77 15.81 10.03 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.927 173.278 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . 0.588 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . 9.9 p -63.24 -22.33 66.8 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.896 0.379 . . . . 0.0 111.701 -171.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.629 ' ND2' ' HB3' ' A' ' 53' ' ' GLN . 35.9 p-10 . . . . . 0 CA--C 1.536 0.419 0 CA-C-O 121.039 0.447 . . . . 0.0 111.116 -177.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.428 ' HG ' ' N ' ' A' ' 21' ' ' LYS . 32.1 tp . . . . . 0 N--CA 1.455 -0.192 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.428 ' N ' ' HG ' ' A' ' 20' ' ' LEU . 11.5 mtpt -125.89 114.15 18.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.04 177.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.599 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 12.9 m -128.43 158.5 38.15 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 174.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.43 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 15.6 m-85 -72.41 120.76 18.46 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.659 -0.416 . . . . 0.0 109.971 173.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 88.2 m -111.15 142.75 42.92 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 176.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 . . . . . 0 C--N 1.324 -0.524 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.883 -177.647 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 . . . . . 0 N--CA 1.456 -0.17 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 p -129.48 169.33 15.09 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.565 -178.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 53.8 t -72.11 121.24 22.01 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.408 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.2 p -123.14 132.59 54.13 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 119.994 -0.683 . . . . 0.0 110.674 174.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 t -76.42 113.97 14.6 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 170.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.76 170.23 11.4 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.878 -170.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.413 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -66.81 166.35 13.43 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.502 -179.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.06 -19.94 56.46 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.723 -166.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.42 ' HG2' HG22 ' A' ' 57' ' ' THR . 3.2 pm0 -81.96 -22.85 36.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.284 0.564 . . . . 0.0 109.611 176.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.455 ' OE1' ' HB2' ' A' ' 55' ' ' CYS . 8.3 mt-30 -72.89 121.55 20.2 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.193 176.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.541 ' OG1' HG23 ' A' ' 58' ' ' VAL . 0.5 OUTLIER -134.51 4.83 3.41 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.327 -0.852 . . . . 0.0 111.597 -170.39 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.763 ' CG ' ' HA ' ' A' ' 58' ' ' VAL . 6.1 mmm180 -138.49 178.48 7.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.633 0.73 . . . . 0.0 110.09 175.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.545 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 8.8 m -132.36 131.5 41.94 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 114.437 -1.256 . . . . 0.0 109.044 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.495 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.2 OUTLIER -91.75 130.44 37.54 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 121.031 -0.267 . . . . 0.0 110.306 179.504 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.798 ' HD2' ' HG3' ' A' ' 76' ' ' LYS . 57.1 t80 -128.45 100.9 5.96 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.28 170.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.613 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 16.8 t -99.44 129.95 49.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 174.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.896 ' HB3' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -99.04 116.77 32.04 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.197 -178.541 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.67 HD21 HG12 ' A' ' 52' ' ' ILE . 1.8 mm? -114.94 156.93 44.5 Favored Pre-proline 0 C--N 1.327 -0.38 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 -176.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -75.49 18.98 0.55 Allowed 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 122.877 2.385 . . . . 0.0 112.391 175.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -136.55 -55.75 0.74 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.517 0.675 . . . . 0.0 109.44 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.607 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 41.5 p -148.26 -162.58 1.58 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.968 -1.015 . . . . 0.0 108.283 176.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.539 ' HA ' HD23 ' A' ' 47' ' ' LEU . 2.3 mp0 -131.14 147.32 52.59 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 118.434 -1.306 . . . . 0.0 110.9 177.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.67 HG12 HD21 ' A' ' 47' ' ' LEU . 52.0 mm -93.77 132.11 38.83 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.909 176.014 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.495 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 14.9 mt-30 -141.67 130.88 23.45 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 120.04 -0.664 . . . . 0.0 109.406 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.434 ' HB2' ' HZ2' ' A' ' 56' ' ' LYS . 2.6 pt-20 -163.03 153.87 16.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.245 -176.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.737 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 79.1 m -82.04 125.22 30.56 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.294 169.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.737 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 11.3 mptt -132.71 -179.17 5.3 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 173.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.516 ' HA ' ' H ' ' A' ' 40' ' ' THR . 16.1 p -86.06 169.05 13.52 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 119.274 -0.971 . . . . 0.0 108.744 177.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.763 ' HA ' ' CG ' ' A' ' 41' ' ' ARG . 66.8 t -61.16 -50.25 81.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 C-N-CA 119.583 -0.847 . . . . 0.0 110.102 178.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -56.53 -54.37 46.61 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.863 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.589 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -58.91 -34.91 72.24 Favored 'General case' 0 C--O 1.204 -1.326 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.964 -177.637 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.563 ' HA ' HG22 ' A' ' 64' ' ' VAL . 0.5 OUTLIER -68.22 -34.21 75.82 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.055 -175.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.71 -35.8 67.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.347 0.594 . . . . 0.0 109.611 176.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.559 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 74.8 mt-10 -65.91 -52.02 53.64 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.814 -1.084 . . . . 0.0 110.943 178.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.624 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 33.4 m -68.44 -28.7 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.54 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.277 178.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.459 HD12 ' HB3' ' A' ' 75' ' ' ALA . 46.5 tp -58.03 -50.9 71.83 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 176.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.591 ' HA ' ' HG1' ' A' ' 69' ' ' THR . 40.8 tt0 -74.2 -33.88 63.55 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.183 -174.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.624 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -60.19 -44.61 94.95 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.313 -177.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.541 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 28.4 m -80.37 -28.42 11.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.938 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.591 ' HG1' ' HA ' ' A' ' 66' ' ' GLU . 31.0 p -75.48 -22.47 57.19 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.842 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.15 -18.43 61.88 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.184 0.516 . . . . 0.0 110.285 176.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 19.2 mt -86.37 -18.34 8.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.504 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 107.67 3.76 34.61 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.182 -1.008 . . . . 0.0 112.498 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 55.9 m-85 -90.24 134.11 32.02 Favored Pre-proline 0 N--CA 1.447 -0.603 0 CA-C-O 120.808 0.337 . . . . 0.0 111.478 -178.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.896 ' HB2' ' HB3' ' A' ' 46' ' ' GLN . 79.7 Cg_exo -56.17 130.79 42.06 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.598 2.865 . . . . 0.0 112.054 173.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.52 ' C ' ' HG2' ' A' ' 76' ' ' LYS . . . -149.16 156.63 42.46 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.711 -0.796 . . . . 0.0 111.861 179.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.798 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -153.85 155.52 35.91 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.243 174.943 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 26.9 p -137.46 115.72 11.79 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.627 0.727 . . . . 0.0 109.901 166.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.1 p -108.17 172.48 6.81 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.891 -176.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . 0.435 ' HB2' ' CD ' ' A' ' 41' ' ' ARG . 52.9 t -131.14 100.97 5.39 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.13 178.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.599 ' HB3' ' HB3' ' A' ' 83' ' ' CYS . 14.1 tt0 174.81 148.73 0.08 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 -175.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.647 ' HB3' HD22 ' A' ' 82' ' ' LEU . 1.0 OUTLIER -55.93 124.02 16.27 Favored 'General case' 0 CA--C 1.509 -0.598 0 C-N-CA 119.805 -0.758 . . . . 0.0 110.365 179.079 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.647 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.1 OUTLIER 66.02 16.06 10.31 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.752 169.713 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . 0.599 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . 21.3 p -64.53 -29.57 70.6 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -171.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.454 ' ND2' ' HB3' ' A' ' 53' ' ' GLN . 29.5 p-10 . . . . . 0 C--N 1.329 -0.286 0 CA-C-O 121.17 0.51 . . . . 0.0 110.773 -178.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.6 tp . . . . . 0 N--CA 1.453 -0.308 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.541 ' HE2' HG12 ' A' ' 32' ' ' VAL . 36.6 mtpt -107.0 104.36 14.01 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 118.867 -1.133 . . . . 0.0 111.685 -177.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.5 m -103.47 152.46 21.63 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 176.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.499 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 58.5 m-85 -71.65 149.67 45.34 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.565 176.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -121.29 132.03 54.55 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.052 172.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 . . . . . 0 C--N 1.323 -0.58 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.574 -175.383 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.425 ' HD3' HH11 ' A' ' 30' ' ' ARG . 8.7 ptp180 . . . . . 0 N--CA 1.441 -0.878 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.9 m -93.98 127.95 40.04 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.645 -172.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.541 HG12 ' HE2' ' A' ' 21' ' ' LYS . 25.0 t -75.93 104.02 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 176.186 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.43 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 1.3 p -115.82 149.24 38.9 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.652 -174.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.7 t -90.4 136.43 33.06 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.851 178.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -127.37 148.85 50.26 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 -178.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.526 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -82.89 -176.75 6.47 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -168.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.36 -43.83 92.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.597 -1.183 . . . . 0.0 112.715 -173.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.601 ' OE2' ' HG3' ' A' ' 39' ' ' GLN . 4.2 pm0 -62.63 -24.47 67.61 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.019 0.438 . . . . 0.0 110.027 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.734 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 37.4 mt-30 -110.1 52.39 0.73 Allowed 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.876 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -79.85 25.64 0.35 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.145 0.498 . . . . 0.0 111.445 178.031 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.76 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 16.1 mmt85 -131.34 179.52 5.98 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.752 172.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.733 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 62.7 m -142.95 131.49 22.4 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.625 -174.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.423 HD23 ' SG ' ' A' ' 61' ' ' CYS . 0.5 OUTLIER -100.39 127.68 46.64 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.983 0.421 . . . . 0.0 111.103 -175.697 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.658 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 40.7 t80 -142.35 115.6 8.92 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.588 174.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.438 ' HA ' ' HA ' ' A' ' 75' ' ' ALA . 58.2 t -105.92 138.04 33.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 C-N-CA 120.452 -0.499 . . . . 0.0 109.895 179.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.732 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 7.4 mm100 -74.93 137.45 41.67 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 120.094 -0.642 . . . . 0.0 109.944 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.525 ' HB2' ' C ' ' A' ' 50' ' ' SER . 3.3 mm? -131.85 143.13 47.79 Favored Pre-proline 0 C--N 1.312 -1.03 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.015 171.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 12.0 Cg_exo -72.12 -3.33 13.09 Favored 'Trans proline' 0 CA--C 1.529 0.254 0 C-N-CA 122.836 2.357 . . . . 0.0 112.776 -179.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 28.4 p90 -149.65 5.91 0.62 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.951 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.525 ' C ' ' HB2' ' A' ' 47' ' ' LEU . 66.8 m -161.67 -162.09 0.84 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -176.193 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -163.8 147.34 10.01 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 174.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.658 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 67.5 mt -106.07 136.85 38.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 177.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -146.83 129.9 16.42 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -177.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.553 ' HG3' ' HE2' ' A' ' 56' ' ' LYS . 7.0 pt-20 -179.26 157.26 0.8 Allowed 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.558 0.536 . . . . 0.0 109.965 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 2.8 m -81.34 141.4 34.06 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 119.809 -0.756 . . . . 0.0 109.121 175.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.553 ' HE2' ' HG3' ' A' ' 54' ' ' GLU . 69.6 mmtt -135.87 155.09 50.85 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.734 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 27.7 p -68.83 146.09 53.16 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 118.697 -1.201 . . . . 0.0 108.792 176.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.573 HG22 ' HG2' ' A' ' 41' ' ' ARG . 29.8 t -46.37 -54.73 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 O-C-N 123.461 0.476 . . . . 0.0 111.377 -173.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -63.09 -55.85 21.89 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.586 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.747 ' O ' HG13 ' A' ' 64' ' ' VAL . 99.1 mt-30 -64.51 -26.58 68.49 Favored 'General case' 0 C--O 1.204 -1.317 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.495 -174.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.691 ' HA ' HG22 ' A' ' 64' ' ' VAL . 8.7 t -71.77 -33.63 68.78 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 177.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.07 -34.5 73.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.085 0.469 . . . . 0.0 109.867 172.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -64.97 -51.24 62.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.664 176.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.747 HG13 ' O ' ' A' ' 60' ' ' GLN . 14.1 m -67.49 -27.06 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.251 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.691 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.48 -49.26 76.86 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 173.443 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -73.33 -34.16 65.53 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.144 -174.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.646 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.9 pt-20 -60.15 -42.15 94.3 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 120.034 -0.667 . . . . 0.0 110.068 -178.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.506 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.5 m -79.91 -36.67 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 CA-C-O 120.779 0.323 . . . . 0.0 111.796 179.193 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 96.0 m -71.98 -29.46 64.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.206 -175.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.94 -23.75 64.19 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.562 174.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.515 HG13 ' O ' ' A' ' 67' ' ' GLU . 18.6 mt -79.11 -26.02 13.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.323 0.582 . . . . 0.0 109.739 176.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.486 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 114.25 2.11 23.33 Favored Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 119.838 -1.172 . . . . 0.0 112.035 -177.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -96.03 107.31 33.89 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-O 120.555 0.217 . . . . 0.0 110.602 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.732 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 77.8 Cg_exo -56.74 134.65 65.82 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 123.257 2.638 . . . . 0.0 112.979 178.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.691 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -130.79 161.25 32.15 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.847 174.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -130.05 140.06 50.9 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.533 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.76 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 6.1 t -150.72 109.65 3.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.137 0.494 . . . . 0.0 109.793 173.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.3 p -136.43 172.3 13.22 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.321 -171.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . 0.584 ' SG ' ' HD3' ' A' ' 41' ' ' ARG . 55.7 m -107.88 101.9 11.14 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.484 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 7.5 tp10 179.06 142.15 0.12 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -176.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.714 ' HB3' HD22 ' A' ' 82' ' ' LEU . 43.7 m-20 -62.9 137.95 58.41 Favored 'General case' 0 CA--C 1.505 -0.776 0 C-N-CA 118.278 -1.369 . . . . 0.0 109.349 177.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.714 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 62.68 21.75 12.92 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.902 175.292 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . 0.484 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 6.4 t -69.62 -31.17 69.14 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.68 -174.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.634 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 28.7 p-10 . . . . . 0 C--N 1.328 -0.35 0 CA-C-O 122.202 1.001 . . . . 0.0 108.909 174.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 35.6 tp . . . . . 0 N--CA 1.454 -0.264 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.523 ' HG2' ' HB ' ' A' ' 34' ' ' THR . 33.4 mtmm -102.25 114.24 28.23 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.021 -178.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 18.0 m -113.46 173.42 6.42 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.612 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 46.2 m-85 -82.95 136.08 34.67 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 173.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.7 p -116.24 130.53 56.83 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 173.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 7.8 tpt180 . . . . . 0 C--N 1.327 -0.401 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.536 -176.562 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.424 ' HB3' ' OE1' ' A' ' 53' ' ' GLN . 30.2 ptt180 . . . . . 0 N--CA 1.447 -0.592 0 CA-C-O 121.466 0.65 . . . . 0.0 109.749 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -113.09 146.72 38.68 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.929 -173.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.408 HG13 HD11 ' A' ' 82' ' ' LEU . 94.4 t -80.96 108.11 13.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.029 175.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.1 p -119.4 148.37 43.29 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.853 0.359 . . . . 0.0 110.271 176.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.523 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 3.1 t -91.63 115.59 28.17 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.094 -0.642 . . . . 0.0 109.87 177.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -87.98 160.44 17.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.41 -0.813 . . . . 0.0 109.186 -176.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.546 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -74.89 -179.19 4.1 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.243 -0.583 . . . . 0.0 112.423 -169.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -63.83 -37.26 86.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.377 -172.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.546 ' OE2' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -76.11 -25.84 55.81 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.254 -174.028 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.641 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 40.4 mt-30 -98.24 80.68 2.69 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.366 0.603 . . . . 0.0 110.392 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.54 21.29 9.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.261 -0.882 . . . . 0.0 112.103 -176.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.827 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 15.8 mmt85 -126.82 179.69 5.25 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 119.956 -0.698 . . . . 0.0 109.947 171.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.699 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 63.8 m -139.73 131.88 28.09 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.54 -173.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.498 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 1.0 OUTLIER -103.69 130.64 51.2 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.673 0.273 . . . . 0.0 111.081 -171.899 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.725 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 1.2 t80 -146.75 104.05 3.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.331 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.584 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 46.3 t -102.48 136.14 36.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.922 178.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.782 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 10.5 mm100 -76.59 140.24 40.97 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.962 0.41 . . . . 0.0 110.791 -178.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.519 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.0 mm? -132.09 153.95 81.51 Favored Pre-proline 0 C--N 1.321 -0.656 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 174.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -74.63 18.17 0.52 Allowed 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 122.941 2.427 . . . . 0.0 113.018 179.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -160.46 -48.31 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.929 0.395 . . . . 0.0 110.634 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.519 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 20.5 m -120.55 -153.17 0.53 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.74 178.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -155.64 144.61 20.63 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.725 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 69.1 mt -89.84 128.95 41.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.381 -0.527 . . . . 0.0 109.761 176.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.498 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 49.0 mt-30 -139.48 131.53 27.94 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -177.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.909 ' HG2' ' HE2' ' A' ' 56' ' ' LYS . 1.1 tp10 -170.42 153.89 4.51 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -168.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 4.9 m -93.17 128.41 39.11 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 119.689 -0.805 . . . . 0.0 108.895 173.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.909 ' HE2' ' HG2' ' A' ' 54' ' ' GLU . 57.8 mmtt -131.12 147.65 52.64 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.641 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 46.0 p -62.8 153.67 32.25 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 174.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.634 HG22 ' HG2' ' A' ' 41' ' ' ARG . 40.9 t -49.67 -48.15 21.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 123.238 0.336 . . . . 0.0 110.87 -176.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -65.83 -56.11 13.57 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.464 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.7 ' O ' HG13 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -58.43 -34.12 70.45 Favored 'General case' 0 C--O 1.21 -0.995 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.803 -175.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.697 ' HA ' HG22 ' A' ' 64' ' ' VAL . 4.3 t -72.6 -33.4 66.68 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.613 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.85 -36.76 73.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.276 0.56 . . . . 0.0 109.698 173.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.565 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 92.6 mt-10 -59.99 -52.8 63.83 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.459 175.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.7 HG13 ' O ' ' A' ' 60' ' ' GLN . 17.9 m -70.38 -27.41 31.56 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.618 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.615 -178.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.683 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -59.3 -50.63 73.24 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 175.847 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -73.85 -33.28 64.04 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.944 -173.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.607 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.9 pt-20 -60.28 -43.31 96.35 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.097 -179.234 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.514 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.0 m -79.76 -35.86 16.77 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.738 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 99.4 m -71.84 -27.71 63.07 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.983 -176.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.18 -23.52 61.28 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.484 173.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.597 HG13 ' O ' ' A' ' 67' ' ' GLU . 43.6 mt -78.21 -32.49 17.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.342 0.592 . . . . 0.0 109.971 177.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.486 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 121.0 2.34 11.19 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.21 -0.995 . . . . 0.0 111.757 -176.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -97.86 106.61 35.18 Favored Pre-proline 0 N--CA 1.448 -0.53 0 CA-C-O 120.629 0.252 . . . . 0.0 110.824 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.782 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 79.2 Cg_exo -54.61 133.83 58.98 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 123.183 2.589 . . . . 0.0 112.846 177.219 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.683 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -130.49 157.13 43.5 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.234 -0.587 . . . . 0.0 110.937 174.248 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.1 mmtp -128.69 143.09 50.86 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.535 -179.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.827 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 8.4 t -156.27 112.29 3.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.919 0.39 . . . . 0.0 110.392 176.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 3.8 p -143.77 173.28 11.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.002 -174.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . 0.582 ' SG ' ' HD3' ' A' ' 41' ' ' ARG . 57.6 m -108.07 104.09 13.45 Favored 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.514 -175.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.475 ' HG3' ' HB2' ' A' ' 83' ' ' CYS . 0.0 OUTLIER 177.22 161.72 0.46 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 173.557 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.699 ' HB3' HD22 ' A' ' 82' ' ' LEU . 56.7 m-20 -68.22 135.24 51.7 Favored 'General case' 0 CA--C 1.501 -0.915 0 C-N-CA 117.023 -1.871 . . . . 0.0 109.558 -179.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.699 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 63.9 22.21 12.92 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.626 175.364 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . 0.475 ' HB2' ' HG3' ' A' ' 80' ' ' GLU . 4.3 t -64.5 -27.61 69.09 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.891 0.377 . . . . 0.0 111.049 -174.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.653 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 27.7 p-10 . . . . . 0 C--N 1.328 -0.354 0 CA-C-O 122.419 1.104 . . . . 0.0 108.677 172.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.652 HD21 ' H ' ' A' ' 80' ' ' GLU . 21.8 tp . . . . . 0 N--CA 1.452 -0.359 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.615 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 28.8 mtmm -82.67 114.76 21.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.267 0.556 . . . . 0.0 111.403 -175.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.7 m -113.27 162.57 15.87 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.794 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.42 ' HE1' ' HB3' ' A' ' 82' ' ' LEU . 34.7 m-85 -79.33 138.87 37.88 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.618 176.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 32.2 m -129.0 131.83 47.46 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.3 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.71 HH11 ' HB2' ' A' ' 51' ' ' GLU . 30.8 mtp180 . . . . . 0 C--N 1.329 -0.321 0 C-N-CA 119.923 -0.711 . . . . 0.0 111.749 -176.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 . . . . . 0 N--CA 1.445 -0.684 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.5 m -100.63 145.15 28.75 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.731 -175.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 96.8 t -72.46 106.93 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 31.2 p -104.26 137.4 42.23 Favored 'General case' 0 C--N 1.314 -0.955 0 C-N-CA 120.069 -0.652 . . . . 0.0 110.346 175.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.615 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.7 t -86.37 111.99 21.03 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 121.634 0.73 . . . . 0.0 109.404 176.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -89.28 172.88 8.72 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.089 -173.017 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.89 166.35 20.98 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.291 -0.564 . . . . 0.0 111.147 -175.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -51.98 -26.98 11.8 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.37 176.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.485 ' HG2' ' CG2' ' A' ' 57' ' ' THR . 27.6 tt0 -62.62 -39.68 94.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.012 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.47 ' HG3' ' CB ' ' A' ' 55' ' ' CYS . 16.5 mm-40 -82.04 100.66 9.86 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 118.904 -1.118 . . . . 0.0 109.675 -178.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.422 ' OG1' HG23 ' A' ' 58' ' ' VAL . 0.7 OUTLIER -101.58 21.71 13.9 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.591 0.71 . . . . 0.0 110.04 175.537 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.903 ' HG3' ' HB2' ' A' ' 77' ' ' CYS . 1.2 tpt180 -152.4 177.76 10.26 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.741 -176.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.611 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 79.4 m -141.34 131.88 25.41 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 179.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.406 HD22 HG23 ' A' ' 45' ' ' VAL . 0.3 OUTLIER -94.93 130.47 41.55 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 -178.881 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.493 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 18.6 t80 -139.54 113.51 8.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.86 170.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.645 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 22.0 t -108.72 133.84 52.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 176.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.882 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -90.03 132.36 35.42 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 119.397 -0.921 . . . . 0.0 110.455 177.296 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.63 HD21 HG12 ' A' ' 52' ' ' ILE . 3.5 mm? -121.06 152.03 56.12 Favored Pre-proline 0 C--N 1.319 -0.739 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -66.51 -17.25 53.04 Favored 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.46 2.106 . . . . 0.0 112.713 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -134.93 -2.43 2.6 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.526 -177.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.604 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 49.1 m -157.97 -168.61 2.56 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.188 -174.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.71 ' HB2' HH11 ' A' ' 25' ' ' ARG . 18.4 mt-10 -147.01 148.06 31.31 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 176.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.645 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 26.8 mm -109.28 129.18 64.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 175.484 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 -140.93 130.27 23.7 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.171 -0.612 . . . . 0.0 110.203 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.11 158.03 24.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.661 -179.328 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.512 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 8.3 m -80.42 118.34 21.96 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 166.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.512 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 12.1 mptt -124.25 147.88 47.76 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.485 ' CG2' ' HG2' ' A' ' 38' ' ' GLU . 18.2 p -68.34 164.3 21.14 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.422 HG23 ' OG1' ' A' ' 40' ' ' THR . 57.8 t -59.1 -43.27 88.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 119.261 -0.976 . . . . 0.0 110.33 177.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -64.09 -54.57 31.86 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.748 179.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.646 ' O ' HG13 ' A' ' 64' ' ' VAL . 33.6 tt0 -61.58 -32.8 72.91 Favored 'General case' 0 C--O 1.206 -1.219 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.247 -174.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.693 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 0.6 OUTLIER -66.12 -33.42 75.74 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.13 -0.628 . . . . 0.0 110.18 178.845 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.91 -41.54 74.55 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.043 0.449 . . . . 0.0 109.943 174.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.538 ' OE2' ' HA ' ' A' ' 60' ' ' GLN . 44.9 mt-10 -56.53 -53.34 58.65 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.545 176.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.646 HG13 ' O ' ' A' ' 60' ' ' GLN . 15.3 m -73.77 -27.63 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.656 0 CA-C-N 114.659 -1.155 . . . . 0.0 111.693 -176.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.693 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 6.7 tp -59.78 -50.5 73.58 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 179.144 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -74.72 -34.99 62.67 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.465 -0.788 . . . . 0.0 112.218 -176.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.632 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.4 pt-20 -58.0 -47.27 83.52 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.529 -177.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.602 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 33.4 m -80.54 -34.13 14.2 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.833 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 32.5 m -72.16 -23.89 61.35 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 120.606 -0.438 . . . . 0.0 111.157 -177.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.39 -21.35 62.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.119 0.485 . . . . 0.0 110.099 174.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 67' ' ' GLU . 12.2 mt -86.99 -19.2 8.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.542 176.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 111.18 12.57 15.25 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.09 -1.052 . . . . 0.0 112.362 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 52.5 m-85 -98.65 118.66 62.8 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 120.911 0.386 . . . . 0.0 111.289 -178.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.882 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 46.4 Cg_exo -64.23 123.3 11.62 Favored 'Trans proline' 0 CA--C 1.519 -0.232 0 C-N-CA 123.585 2.857 . . . . 0.0 112.569 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -135.59 155.76 49.95 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 120.481 -0.487 . . . . 0.0 111.509 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.541 ' HD3' HE22 ' A' ' 46' ' ' GLN . 0.0 OUTLIER -139.75 152.06 46.31 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.348 0.594 . . . . 0.0 111.278 172.977 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.903 ' HB2' ' HG3' ' A' ' 41' ' ' ARG . 2.6 p -129.73 115.89 17.97 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.695 161.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.6 p -106.56 159.01 16.5 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.798 176.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . 0.436 ' SG ' ' CD ' ' A' ' 41' ' ' ARG . 28.2 m -108.81 101.17 10.3 Favored 'General case' 0 CA--C 1.521 -0.135 0 C-N-CA 120.282 -0.567 . . . . 0.0 109.7 177.17 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.652 ' H ' HD21 ' A' ' 20' ' ' LEU . 9.0 tp10 173.74 144.16 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.669 ' HB3' HD22 ' A' ' 82' ' ' LEU . 58.5 m-20 -60.14 139.73 57.34 Favored 'General case' 0 CA--C 1.511 -0.519 0 C-N-CA 118.937 -1.105 . . . . 0.0 109.614 177.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.669 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 66.73 13.88 9.55 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.51 170.9 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . 0.499 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . 9.2 p -77.91 -32.33 51.64 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.268 -173.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.555 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 22.1 p-10 . . . . . 0 N--CA 1.465 0.285 0 CA-C-O 120.935 0.397 . . . . 0.0 111.157 -174.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.0 tp . . . . . 0 N--CA 1.453 -0.313 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.476 ' O ' HD13 ' A' ' 82' ' ' LEU . 9.4 mtmp? -113.45 109.12 18.16 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 119.643 -0.823 . . . . 0.0 111.056 175.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 19.6 m -112.29 154.67 25.3 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 175.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.571 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 11.6 m-85 -70.48 134.11 47.44 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.825 -0.75 . . . . 0.0 109.93 175.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.5 m -132.07 129.33 39.85 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.218 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.801 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 1.9 mtt-85 . . . . . 0 C--N 1.327 -0.379 0 C-N-CA 119.579 -0.848 . . . . 0.0 109.747 175.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.801 ' HG3' ' HG3' ' A' ' 25' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.493 HG23 HG23 ' A' ' 33' ' ' THR . 12.2 t -127.53 162.75 25.69 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 169.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 48.7 t -74.6 106.26 4.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.289 -0.564 . . . . 0.0 109.836 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.493 HG23 HG23 ' A' ' 31' ' ' THR . 27.1 p -115.69 147.78 40.47 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.152 0.501 . . . . 0.0 111.389 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.4 t -105.37 126.75 52.47 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.4 176.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 5.4 p -91.65 176.63 6.47 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 177.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.29 -176.81 6.3 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.154 -0.618 . . . . 0.0 111.793 -172.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 -61.66 -32.28 72.44 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -172.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.453 ' HG2' HG22 ' A' ' 57' ' ' THR . 10.2 pm0 -77.21 -23.32 51.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.834 0.349 . . . . 0.0 111.176 -176.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.606 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 69.0 mt-30 -92.93 109.06 20.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.141 0.496 . . . . 0.0 110.152 -178.353 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.34 5.16 10.22 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.768 -174.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.617 ' HG2' HG22 ' A' ' 58' ' ' VAL . 10.0 mmm180 -130.44 -179.68 5.41 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-O 121.617 0.722 . . . . 0.0 110.032 174.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.568 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 40.4 m -126.51 150.33 48.82 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.245 -177.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.503 ' HB2' ' CG ' ' A' ' 56' ' ' LYS . 0.2 OUTLIER -109.01 122.34 47.05 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.87 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.613 ' HB2' ' HB2' ' A' ' 84' ' ' ASN . 52.6 t80 -131.93 117.95 19.14 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.015 175.059 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.544 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 42.2 t -116.46 130.02 71.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 177.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.781 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 2.6 mm100 -75.63 141.25 42.86 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 119.73 -0.788 . . . . 0.0 109.932 178.442 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.531 HD21 HG12 ' A' ' 52' ' ' ILE . 2.5 mm? -138.86 155.82 72.96 Favored Pre-proline 0 C--N 1.318 -0.785 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 172.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -85.82 11.27 3.38 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.494 2.129 . . . . 0.0 111.37 171.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -128.38 -64.56 0.94 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.877 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.451 ' O ' HD23 ' A' ' 47' ' ' LEU . 20.6 t -152.94 132.22 12.79 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 177.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.457 ' HA ' HD23 ' A' ' 47' ' ' LEU . 0.9 OUTLIER -77.11 148.63 35.93 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.425 -173.783 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.544 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 38.5 mm -88.65 131.69 35.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.176 177.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.585 ' OE1' ' HD3' ' A' ' 30' ' ' ARG . 17.4 mt-30 -144.57 130.39 19.22 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.344 -0.543 . . . . 0.0 110.166 -178.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.429 ' HG3' ' HE2' ' A' ' 56' ' ' LYS . 10.7 pt-20 -175.79 170.74 2.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.423 -178.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.453 ' HB3' ' OE1' ' A' ' 39' ' ' GLN . 8.1 t -92.33 148.92 21.75 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 119.665 -0.814 . . . . 0.0 109.699 177.179 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.503 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 56.6 mmtt -142.08 162.41 35.53 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 176.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.606 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 29.3 p -72.34 160.32 32.56 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 172.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.617 HG22 ' HG2' ' A' ' 41' ' ' ARG . 22.0 t -59.12 -39.38 78.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 C-N-CA 120.029 -0.669 . . . . 0.0 109.637 -179.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.469 ' O ' ' HG3' ' A' ' 63' ' ' GLU . 41.3 tp60 -62.53 -56.12 20.99 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.697 177.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.57 ' O ' HG13 ' A' ' 64' ' ' VAL . 34.8 tt0 -69.75 -30.93 68.63 Favored 'General case' 0 C--O 1.203 -1.351 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.633 -173.097 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.492 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.7 p -65.15 -33.21 75.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 179.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.29 -45.87 65.46 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 173.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.542 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 75.7 mt-10 -54.91 -52.32 63.28 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.294 178.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.64 ' HA ' ' HG2' ' A' ' 67' ' ' GLU . 27.6 m -68.98 -30.42 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.528 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.481 -177.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.5 tp -62.59 -49.61 74.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.46 174.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -74.2 -31.44 62.64 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -176.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.64 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.6 pt-20 -63.35 -45.61 90.43 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.38 -177.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.56 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 29.3 m -79.34 -31.8 14.55 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 C-N-CA 120.279 -0.568 . . . . 0.0 111.335 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 85.5 m -66.41 -31.37 72.09 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 120.935 0.398 . . . . 0.0 110.484 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.0 -23.95 65.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.612 176.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.416 HG13 ' O ' ' A' ' 67' ' ' GLU . 16.0 mt -86.43 -20.63 7.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.959 178.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 114.95 -4.21 22.53 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.094 -1.05 . . . . 0.0 112.362 -178.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -91.91 114.71 62.9 Favored Pre-proline 0 N--CA 1.448 -0.554 0 CA-C-O 120.658 0.266 . . . . 0.0 110.926 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.781 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 51.6 Cg_exo -59.25 128.8 28.81 Favored 'Trans proline' 0 C--O 1.232 0.212 0 C-N-CA 123.177 2.585 . . . . 0.0 113.09 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.489 ' C ' ' HG2' ' A' ' 76' ' ' LYS . . . -126.53 165.56 18.9 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.451 173.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.563 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 0.9 OUTLIER -145.71 118.66 8.75 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.118 -178.115 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.568 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 1.4 t -104.31 106.79 17.42 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.248 0.547 . . . . 0.0 110.078 171.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 54.0 t -110.91 160.86 16.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.226 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . 0.541 ' HB2' ' HD2' ' A' ' 41' ' ' ARG . 36.3 t -125.84 100.09 6.24 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 175.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.587 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 3.5 tm-20 171.53 149.79 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 105.681 -1.97 . . . . 0.0 105.681 -173.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.765 ' HB3' HD22 ' A' ' 82' ' ' LEU . 35.3 m-20 -65.38 135.43 55.26 Favored 'General case' 0 CA--C 1.504 -0.793 0 C-N-CA 117.368 -1.733 . . . . 0.0 110.9 -172.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.765 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 65.82 1.95 2.0 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.839 173.603 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . 0.587 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 16.9 t -54.94 -18.71 5.34 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -167.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.613 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 27.9 p-10 . . . . . 0 C--N 1.321 -0.661 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.469 175.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 55.5 tp . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 34' ' ' THR . 30.8 mtmm -89.46 139.04 30.92 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.986 -179.392 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.563 ' HA ' HD23 ' A' ' 82' ' ' LEU . 2.7 m -152.9 166.72 31.44 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.591 173.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -76.36 121.61 23.26 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.384 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' A' ' 54' ' ' GLU . 67.6 m -115.26 144.0 44.4 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 174.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.488 HH12 ' CD ' ' A' ' 51' ' ' GLU . 3.5 tpt180 . . . . . 0 C--N 1.325 -0.475 0 CA-C-O 120.89 0.376 . . . . 0.0 111.12 -174.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.599 ' HD2' ' OE1' ' A' ' 53' ' ' GLN . 69.3 mtm180 . . . . . 0 CA--C 1.512 -0.51 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.5 m -108.36 138.49 44.57 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.535 -169.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.695 HG13 HD21 ' A' ' 82' ' ' LEU . 94.3 t -74.52 106.09 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 173.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.42 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 42.8 p -113.79 143.14 45.14 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.915 -178.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.424 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.9 t -93.05 111.95 23.75 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 175.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 37.0 m -108.0 155.99 19.73 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.742 -173.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.59 ' HB3' ' HG2' ' A' ' 38' ' ' GLU . . . -74.99 172.06 12.98 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -166.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -57.94 -27.44 63.39 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.419 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.59 ' HG2' ' HB3' ' A' ' 36' ' ' ALA . 4.8 pt-20 -52.47 -45.03 65.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.365 0.603 . . . . 0.0 110.203 173.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.653 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 41.9 mt-30 -102.44 72.78 1.28 Allowed 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.843 -177.242 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.11 9.73 18.94 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.318 -177.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.547 ' HB2' ' HA ' ' A' ' 58' ' ' VAL . 2.4 tpt180 -123.8 174.89 7.22 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 173.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.725 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 57.9 m -142.08 131.67 23.95 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 120.516 -0.474 . . . . 0.0 109.765 -175.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.526 HD22 HG23 ' A' ' 45' ' ' VAL . 0.3 OUTLIER -91.14 131.39 36.73 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.84 -174.985 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.772 ' HD2' ' HG3' ' A' ' 76' ' ' LYS . 77.8 t80 -138.28 121.15 16.52 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.367 169.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.601 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 30.1 t -122.43 141.75 41.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.384 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.735 ' CG ' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -81.41 142.51 32.91 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 176.193 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.618 HD21 HG12 ' A' ' 52' ' ' ILE . 4.2 mm? -129.93 153.38 80.96 Favored Pre-proline 0 C--N 1.318 -0.792 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 174.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -72.18 18.39 0.32 Allowed 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 123.0 2.467 . . . . 0.0 113.154 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 28.9 p90 -168.87 -22.41 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.906 0.384 . . . . 0.0 110.797 -177.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.538 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 33.8 p -144.59 -157.4 0.78 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.34 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.488 ' CD ' HH12 ' A' ' 25' ' ' ARG . 0.0 OUTLIER -151.53 157.37 42.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.882 0.373 . . . . 0.0 110.945 176.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.618 HG12 HD21 ' A' ' 47' ' ' LEU . 29.1 mm -105.26 134.16 47.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.658 177.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.599 ' OE1' ' HD2' ' A' ' 30' ' ' ARG . 36.7 mt-30 -140.95 131.71 25.77 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.866 174.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.549 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 8.0 pt-20 -169.36 160.92 9.68 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.325 0.391 . . . . 0.0 110.842 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 80.6 m -80.36 145.41 32.06 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 169.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.414 ' HE3' HD12 ' A' ' 43' ' ' LEU . 4.6 tppt? -152.16 148.65 27.87 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.397 -0.521 . . . . 0.0 109.778 178.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.653 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 31.7 p -67.46 142.71 56.55 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.179 -0.608 . . . . 0.0 109.518 178.217 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.547 ' HA ' ' HB2' ' A' ' 41' ' ' ARG . 42.3 t -52.59 -46.34 48.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 120.694 0.283 . . . . 0.0 111.132 -175.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -58.48 -56.96 15.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.269 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.793 ' O ' HG13 ' A' ' 64' ' ' VAL . 53.4 mt-30 -71.05 -32.59 69.35 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.849 -174.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.655 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.9 t -66.33 -32.97 74.69 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.228 -178.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.07 -42.76 84.16 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.173 0.511 . . . . 0.0 110.177 172.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -57.68 -52.57 64.9 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.978 0.894 . . . . 0.0 111.042 176.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.793 HG13 ' O ' ' A' ' 60' ' ' GLN . 4.3 m -68.23 -26.45 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.862 0 CA-C-N 114.721 -1.127 . . . . 0.0 110.818 -179.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.739 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -55.18 -49.96 70.56 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 174.914 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -73.37 -35.41 65.93 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 119.721 -0.792 . . . . 0.0 112.134 -174.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.651 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.9 pt-20 -59.74 -42.89 94.19 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.042 -0.663 . . . . 0.0 110.447 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.509 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 28.5 m -78.13 -36.74 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.864 0.364 . . . . 0.0 111.212 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 97.6 m -71.08 -20.26 62.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.136 0.493 . . . . 0.0 110.798 -177.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -79.66 -25.12 41.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.388 175.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.569 HG13 ' O ' ' A' ' 67' ' ' GLU . 17.6 mt -79.55 -29.77 13.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.392 0.615 . . . . 0.0 109.648 177.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.451 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 120.03 13.53 5.93 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.396 -0.907 . . . . 0.0 111.897 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.469 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 55.7 m-85 -104.48 102.47 33.94 Favored Pre-proline 0 N--CA 1.448 -0.528 0 CA-C-O 120.622 0.248 . . . . 0.0 110.89 179.459 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.735 ' HB2' ' CG ' ' A' ' 46' ' ' GLN . 81.7 Cg_exo -54.4 124.72 16.78 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.3 2.667 . . . . 0.0 112.767 176.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.739 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -128.05 154.24 45.89 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.279 -0.568 . . . . 0.0 111.165 176.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.772 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 1.5 mttt -138.72 112.44 8.35 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.106 179.099 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.725 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 59.3 m -102.09 102.22 12.67 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 119.834 -0.746 . . . . 0.0 109.797 173.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 40.6 t -107.61 160.0 16.02 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.365 -178.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . 0.502 ' HB2' ' HD2' ' A' ' 41' ' ' ARG . 49.0 t -122.72 100.47 6.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.304 0.573 . . . . 0.0 109.996 178.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.643 ' HG2' ' H ' ' A' ' 81' ' ' ASP . 2.7 tt0 -173.98 166.5 4.31 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 105.892 -1.892 . . . . 0.0 105.892 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.643 ' H ' ' HG2' ' A' ' 80' ' ' GLU . 9.4 t70 -69.29 109.12 3.97 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.155 -174.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.695 HD21 HG13 ' A' ' 32' ' ' VAL . 30.5 mt 69.27 31.35 3.95 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.983 -177.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . 0.618 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 3.3 t -70.82 -6.76 40.34 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -173.1 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.444 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 29.7 p-10 . . . . . 0 C--N 1.325 -0.465 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.135 177.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.3 tp . . . . . 0 N--CA 1.455 -0.22 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.564 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 31.4 mtmm -106.47 108.25 19.67 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.14 0.495 . . . . 0.0 111.415 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 12.4 m -111.33 153.29 26.2 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.692 ' HB3' ' HB2' ' A' ' 30' ' ' ARG . 63.2 m-85 -70.66 137.31 49.76 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.212 176.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.7 p -116.37 144.51 44.19 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.346 175.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.438 HH12 ' NH2' ' A' ' 30' ' ' ARG . 10.8 tpt180 . . . . . 0 C--N 1.324 -0.504 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.692 ' HB2' ' HB3' ' A' ' 23' ' ' PHE . 1.0 OUTLIER . . . . . 0 N--CA 1.453 -0.311 0 CA-C-O 121.436 0.636 . . . . 0.0 112.41 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 27.2 m -108.04 132.01 53.99 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.007 174.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 95.5 t -73.14 107.79 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 176.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 19.4 p -123.74 134.7 53.63 Favored 'General case' 0 C--N 1.317 -0.848 0 C-N-CA 120.103 -0.639 . . . . 0.0 111.582 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.564 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.5 t -79.65 113.49 17.85 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 170.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.3 m -87.88 166.07 14.81 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.373 -170.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.461 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -61.81 157.5 17.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.051 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -81.28 -12.28 59.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -164.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.481 ' HG2' HG22 ' A' ' 57' ' ' THR . 0.0 OUTLIER -78.83 -27.53 44.31 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.511 0.672 . . . . 0.0 109.522 175.566 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.632 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 12.7 mt-30 -88.06 88.06 7.52 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.43 177.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 p -97.15 5.11 50.77 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.253 -175.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.816 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 17.7 mmt85 -117.51 178.89 4.22 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 119.376 -0.929 . . . . 0.0 110.036 172.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.561 ' HB3' ' HB3' ' A' ' 84' ' ' ASN . 86.0 m -135.61 131.12 35.43 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.649 -1.16 . . . . 0.0 109.407 -174.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.5 ' HB2' ' CG ' ' A' ' 56' ' ' LYS . 1.6 tm? -100.23 128.21 46.35 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.667 -173.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.587 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 52.3 t80 -142.17 114.85 8.54 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.768 174.022 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.563 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 41.4 t -101.61 128.88 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 175.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.731 ' HB3' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -90.04 114.22 26.06 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.27 -178.576 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.553 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.5 mm? -109.69 153.33 43.02 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.039 179.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -80.15 27.18 0.55 Allowed 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 122.737 2.291 . . . . 0.0 112.724 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.426 ' HD2' ' HG ' ' A' ' 50' ' ' SER . 39.0 p90 -170.63 -23.38 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.829 -177.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.553 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 45.2 m -148.09 -160.95 1.24 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.432 ' HA ' HD23 ' A' ' 47' ' ' LEU . 16.3 pt-20 -158.01 150.47 22.37 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.816 179.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.587 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 37.8 mt -112.38 137.97 43.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 177.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.48 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 45.3 mt-30 -144.5 128.95 17.97 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -178.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -150.84 174.98 12.45 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 -179.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 3.6 m -107.72 127.2 53.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 167.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.521 ' HB2' ' SG ' ' A' ' 61' ' ' CYS . 71.9 mmtt -133.5 148.38 51.68 Favored 'General case' 0 C--N 1.314 -0.954 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.599 -174.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.632 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 43.9 p -66.18 154.72 39.01 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 172.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.628 HG22 ' HG2' ' A' ' 41' ' ' ARG . 21.7 t -50.1 -45.66 23.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.453 -176.545 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -66.01 -56.53 11.15 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.648 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.676 ' O ' HG13 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -58.45 -33.42 69.71 Favored 'General case' 0 C--O 1.211 -0.937 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -176.239 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.672 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.7 t -72.68 -33.5 66.57 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.623 -179.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.45 -36.85 71.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.238 0.542 . . . . 0.0 109.684 173.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.579 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 92.5 mt-10 -59.5 -52.36 65.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.547 175.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.676 HG13 ' O ' ' A' ' 60' ' ' GLN . 19.8 m -71.77 -27.67 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.659 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.523 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.491 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 0.2 OUTLIER -60.52 -49.44 77.55 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 175.382 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -73.88 -32.32 63.54 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.834 -174.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.634 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.2 pt-20 -61.13 -41.86 97.48 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.744 -0.783 . . . . 0.0 109.895 -179.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.469 HG22 ' O ' ' A' ' 64' ' ' VAL . 28.6 m -81.07 -37.57 16.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 178.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.418 ' HG1' HD13 ' A' ' 65' ' ' LEU . 97.8 m -78.15 -25.73 47.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.532 -172.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.38 -19.74 63.83 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.426 173.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 67' ' ' GLU . 9.5 mt -80.56 -22.17 11.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.745 177.221 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 112.27 2.08 26.37 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 119.884 -1.15 . . . . 0.0 112.17 -177.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -88.69 126.55 59.39 Favored Pre-proline 0 N--CA 1.448 -0.553 0 O-C-N 122.819 -0.224 . . . . 0.0 110.909 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.731 ' HB2' ' HB3' ' A' ' 46' ' ' GLN . 78.8 Cg_exo -56.64 131.27 44.61 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 123.319 2.68 . . . . 0.0 112.723 176.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.418 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -146.93 155.13 42.04 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 119.154 -1.018 . . . . 0.0 111.641 174.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.43 ' HD3' ' CD2' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -141.26 151.54 43.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.772 176.012 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.816 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 37.4 t -145.76 92.76 2.25 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.92 173.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 3.9 p -107.13 166.13 10.85 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.956 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . 0.547 ' HB2' ' HD3' ' A' ' 41' ' ' ARG . 47.3 t -109.46 105.01 14.18 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.533 -173.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 172.13 151.82 0.07 Allowed 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.694 ' HB3' HD22 ' A' ' 82' ' ' LEU . 62.0 m-20 -57.79 138.97 55.07 Favored 'General case' 0 CA--C 1.512 -0.492 0 C-N-CA 119.429 -0.908 . . . . 0.0 109.764 176.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.694 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 63.85 17.18 10.35 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.065 172.2 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 4.8 t -78.53 -6.7 56.19 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.058 0.456 . . . . 0.0 111.21 -174.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.561 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 29.5 p-10 . . . . . 0 C--N 1.319 -0.751 0 CA-C-O 121.401 0.62 . . . . 0.0 110.36 178.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.8 tp . . . . . 0 N--CA 1.462 0.146 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.536 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 28.8 mtmm -110.37 106.13 15.37 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.807 -173.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.458 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 17.2 m -106.23 156.01 18.9 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 175.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.618 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 16.2 m-85 -67.58 115.32 7.04 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.72 175.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.9 m -96.09 133.45 40.33 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.076 -0.712 . . . . 0.0 109.076 171.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.404 ' HD2' HH11 ' A' ' 25' ' ' ARG . 22.9 ttt180 . . . . . 0 C--N 1.323 -0.583 0 CA-C-O 120.991 0.424 . . . . 0.0 111.627 -175.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.445 -0.694 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -106.8 143.97 34.13 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.329 -0.549 . . . . 0.0 111.464 -169.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.52 HG13 HD11 ' A' ' 82' ' ' LEU . 85.1 t -75.32 106.49 5.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.834 174.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.415 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 32.6 p -122.08 139.22 53.98 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.324 -0.55 . . . . 0.0 110.845 178.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.536 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.8 t -89.12 112.24 23.18 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.18 177.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . 0.511 ' HB3' ' OE1' ' A' ' 39' ' ' GLN . 44.9 m -101.45 161.71 13.43 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.833 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.67 158.16 28.11 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.251 -175.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -66.9 -17.45 64.91 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.297 0.57 . . . . 0.0 110.768 177.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.565 ' HG2' HG22 ' A' ' 57' ' ' THR . 10.7 tt0 -45.18 -48.01 12.43 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.574 -1.194 . . . . 0.0 108.884 163.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.6 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 41.3 mt-30 -98.06 73.17 2.22 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 114.423 -1.262 . . . . 0.0 109.686 -176.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.16 18.56 3.05 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.518 -177.044 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.649 HH21 HG13 ' A' ' 58' ' ' VAL . 1.6 tpp85 -136.38 168.8 18.76 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.709 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 21.7 m -129.92 137.51 50.41 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -178.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.603 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.0 OUTLIER -98.83 123.36 43.03 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.529 0.204 . . . . 0.0 110.507 -176.501 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.655 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 50.7 t80 -131.24 105.27 7.55 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.062 171.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.583 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 42.1 t -98.0 138.12 23.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 120.391 -0.524 . . . . 0.0 109.818 177.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.749 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 2.1 mm100 -79.75 139.15 37.39 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 119.666 -0.813 . . . . 0.0 109.303 175.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.727 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.9 mm? -134.14 149.06 70.42 Favored Pre-proline 0 C--N 1.314 -0.942 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.631 178.119 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 5.1 Cg_exo -79.9 13.23 2.2 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.93 2.42 . . . . 0.0 112.134 174.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -138.63 -43.75 0.49 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.079 0.466 . . . . 0.0 110.71 -176.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.727 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 38.8 m -147.72 -156.71 0.74 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -178.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -139.56 135.88 33.85 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.954 -0.698 . . . . 0.0 110.279 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.655 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 73.7 mt -89.92 126.62 42.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.546 177.602 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.603 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 17.9 mt-30 -139.74 130.77 26.34 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 175.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -172.52 163.97 5.5 Favored 'General case' 0 C--N 1.33 -0.279 0 O-C-N 123.473 0.483 . . . . 0.0 110.509 -177.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.458 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 73.5 m -87.91 135.85 33.22 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.052 0.453 . . . . 0.0 111.109 -179.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.549 ' HE3' HD12 ' A' ' 43' ' ' LEU . 68.2 mmtt -138.23 157.28 46.59 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.6 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 5.3 p -70.96 152.18 43.88 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 118.969 -1.092 . . . . 0.0 108.061 173.122 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.649 HG13 HH21 ' A' ' 41' ' ' ARG . 55.4 t -48.67 -51.92 10.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 120.648 0.261 . . . . 0.0 110.745 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.558 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 17.6 tt0 -63.26 -55.69 22.75 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.19 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.772 ' O ' HG13 ' A' ' 64' ' ' VAL . 29.3 tt0 -58.24 -37.31 74.65 Favored 'General case' 0 C--O 1.209 -1.052 0 CA-C-N 116.541 -0.299 . . . . 0.0 110.961 -174.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.707 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.7 t -70.94 -32.97 70.03 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.38 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.91 -39.35 87.36 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.93 172.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 20.1 mm-40 -58.68 -52.66 64.73 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.492 176.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.772 HG13 ' O ' ' A' ' 60' ' ' GLN . 7.4 m -69.77 -26.43 30.47 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.705 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.107 -178.63 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.67 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -57.11 -50.47 72.7 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 175.698 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -73.82 -34.68 64.67 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 120.215 -0.594 . . . . 0.0 111.98 -174.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.629 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.1 pt-20 -59.43 -42.74 92.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.17 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.507 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 34.4 m -79.68 -38.51 19.35 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.13 0 CA-C-O 120.738 0.304 . . . . 0.0 111.663 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.8 m -74.03 -19.92 60.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.83 0.347 . . . . 0.0 111.341 -175.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.23 -23.47 59.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.999 0.428 . . . . 0.0 110.181 173.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 67' ' ' GLU . 6.1 mt -83.83 -21.86 8.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.355 0.598 . . . . 0.0 109.623 177.295 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.453 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 115.43 9.33 13.09 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.13 -1.033 . . . . 0.0 112.224 -178.136 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -101.51 107.11 49.79 Favored Pre-proline 0 N--CA 1.45 -0.43 0 CA-C-O 120.739 0.304 . . . . 0.0 110.966 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.749 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 52.2 Cg_exo -60.54 137.45 73.88 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 123.116 2.544 . . . . 0.0 112.682 175.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.67 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -138.3 160.13 40.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.715 0.293 . . . . 0.0 110.327 174.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.3 mmtp -136.25 114.86 11.92 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.032 -178.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.709 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 39.0 m -114.13 98.48 6.98 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.946 173.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 7.9 p -111.13 167.69 10.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.692 -0.231 . . . . 0.0 110.727 -178.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 37.7 m -109.63 106.04 15.56 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.839 -176.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.47 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 23.2 tt0 178.1 153.71 0.32 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.733 ' HB3' HD22 ' A' ' 82' ' ' LEU . 49.7 m-20 -65.27 139.32 58.6 Favored 'General case' 0 CA--C 1.507 -0.708 0 C-N-CA 117.919 -1.512 . . . . 0.0 108.738 172.806 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.733 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 61.37 23.72 13.93 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.084 174.556 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . 0.47 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 5.7 t -69.98 -34.26 73.13 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.619 -171.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.581 ' OD1' ' HB3' ' A' ' 42' ' ' CYS . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.35 0 C-N-CA 118.756 -1.177 . . . . 0.0 109.402 174.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 27.2 tp . . . . . 0 C--O 1.233 0.199 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.667 ' HG2' ' HB ' ' A' ' 34' ' ' THR . 27.6 mtmm -114.61 114.9 26.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.244 0.545 . . . . 0.0 112.072 -174.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 17.2 m -129.41 168.58 16.1 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.044 175.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -75.27 132.27 40.93 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.259 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 61.8 m -129.55 135.29 48.41 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 175.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 51.5 ttt180 . . . . . 0 C--N 1.324 -0.508 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.909 -176.833 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.682 ' HD2' ' OE1' ' A' ' 53' ' ' GLN . 77.6 mtm180 . . . . . 0 N--CA 1.452 -0.34 0 CA-C-O 120.78 0.324 . . . . 0.0 110.65 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.8 t -120.09 176.11 5.6 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.852 -178.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 76.9 t -90.08 116.75 32.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.498 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.489 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 64.4 p -106.76 143.37 34.96 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.69 175.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.667 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 1.5 t -98.43 112.32 24.38 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.479 175.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 57.9 m -110.54 164.97 12.18 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.241 -172.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.2 -175.98 4.41 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -170.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -67.05 -32.6 73.91 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.44 -0.8 . . . . 0.0 113.009 -167.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.622 ' CD ' ' H ' ' A' ' 38' ' ' GLU . 1.1 mp0 -55.11 -44.16 74.73 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 122.159 0.98 . . . . 0.0 108.619 177.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.721 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 2.2 mm-40 -90.98 49.19 1.61 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 113.694 -1.594 . . . . 0.0 110.411 -172.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.74 3.65 11.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.204 0.526 . . . . 0.0 110.906 178.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.621 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 19.4 mmt85 -120.07 -179.44 3.93 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.704 0.764 . . . . 0.0 109.367 169.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.596 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 35.9 m -144.41 156.1 44.06 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.344 -172.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -114.77 135.62 53.98 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 120.922 0.392 . . . . 0.0 110.247 -177.799 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.572 ' HB3' ' HG3' ' A' ' 76' ' ' LYS . 70.3 t80 -141.73 119.97 12.22 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.36 -0.836 . . . . 0.0 108.984 170.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.624 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 25.3 t -119.43 140.58 42.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.426 -178.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 1.05 HE21 ' HA ' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -84.48 133.33 34.48 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.122 0.487 . . . . 0.0 110.694 176.302 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.687 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.5 mm? -130.24 146.05 59.95 Favored Pre-proline 0 C--N 1.318 -0.799 0 CA-C-N 115.471 -0.786 . . . . 0.0 108.894 176.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -76.15 15.08 1.01 Allowed 'Trans proline' 0 CA--C 1.528 0.212 0 C-N-CA 122.797 2.331 . . . . 0.0 112.193 177.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -143.45 -39.42 0.31 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.633 -176.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.687 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 49.0 m -149.11 -156.83 0.76 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.416 ' CD ' HH12 ' A' ' 30' ' ' ARG . 22.3 mt-10 -138.65 149.56 45.31 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 177.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.686 HG12 HD21 ' A' ' 47' ' ' LEU . 27.9 mm -104.74 129.27 57.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.193 174.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.682 ' OE1' ' HD2' ' A' ' 30' ' ' ARG . 50.9 mt-30 -142.86 131.85 22.99 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.58 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -168.2 160.26 11.51 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 123.556 0.535 . . . . 0.0 111.107 -178.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 64.7 m -78.32 132.63 37.52 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 170.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 56' ' ' LYS . 8.7 tppt? -137.95 135.33 35.94 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 -178.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.721 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 6.1 p -59.09 156.45 11.96 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 119.509 -0.876 . . . . 0.0 109.827 -178.307 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.617 HG22 ' HG2' ' A' ' 41' ' ' ARG . 37.3 t -54.81 -46.63 75.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.091 0.472 . . . . 0.0 111.296 -175.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.64 ' HG3' ' N ' ' A' ' 60' ' ' GLN . 8.5 pt20 -65.82 -45.36 82.61 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.881 -179.543 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.64 ' N ' ' HG3' ' A' ' 59' ' ' GLN . 70.9 mt-30 -72.87 -26.71 61.55 Favored 'General case' 0 C--O 1.2 -1.528 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.884 -175.404 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.565 ' HA ' HG22 ' A' ' 64' ' ' VAL . 9.1 p -69.43 -33.05 72.39 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.45 -40.75 73.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 0.0 109.997 172.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.21 -52.01 66.61 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.174 178.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.63 ' HA ' ' HG2' ' A' ' 67' ' ' GLU . 30.6 m -67.77 -29.39 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.375 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.637 -178.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.523 HD12 ' HB3' ' A' ' 75' ' ' ALA . 18.4 tp -57.81 -50.79 72.08 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.804 176.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -75.25 -32.38 61.07 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -176.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.63 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -61.1 -46.91 88.7 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.615 -175.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.585 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.6 m -79.76 -31.32 13.72 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 C-N-CA 120.74 -0.384 . . . . 0.0 111.299 -179.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 96.3 m -68.41 -29.06 67.65 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.559 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.76 -22.78 63.32 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.541 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 67' ' ' GLU . 20.1 mt -85.1 -20.61 8.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.337 0.589 . . . . 0.0 109.729 177.654 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 111.2 11.97 16.77 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.187 -1.006 . . . . 0.0 112.453 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -106.47 113.39 63.19 Favored Pre-proline 0 N--CA 1.448 -0.559 0 CA-C-O 120.612 0.244 . . . . 0.0 111.212 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.661 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 90.6 Cg_exo -52.36 129.78 33.09 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 123.577 2.851 . . . . 0.0 113.088 177.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.523 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -132.4 161.21 34.2 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.236 -0.585 . . . . 0.0 111.0 174.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.572 ' HG3' ' HB3' ' A' ' 44' ' ' PHE . 14.9 ptmt -145.2 124.33 12.88 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.017 0.437 . . . . 0.0 111.409 175.025 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.621 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 0.6 OUTLIER -100.44 96.66 7.56 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.602 -0.727 . . . . 0.0 109.122 168.714 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 42.7 t -106.81 152.45 23.85 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.579 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . 0.465 ' HB2' ' CD ' ' A' ' 41' ' ' ARG . 41.9 t -115.22 100.28 8.02 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.334 -178.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.506 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 42.8 tt0 169.68 155.1 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.687 ' HB3' HD22 ' A' ' 82' ' ' LEU . 69.5 m-20 -63.31 135.2 56.88 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 119.038 -1.065 . . . . 0.0 110.001 177.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.687 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 66.72 6.8 4.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.032 170.843 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . 0.506 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 42.6 t -75.88 -13.15 60.26 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 120.336 -0.545 . . . . 0.0 111.387 -175.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.421 ' HB3' ' HB2' ' A' ' 42' ' ' CYS . 19.3 p-10 . . . . . 0 C--N 1.327 -0.372 0 C-N-CA 120.111 -0.635 . . . . 0.0 110.599 178.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 26.1 tp . . . . . 0 N--CA 1.456 -0.175 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.548 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 33.1 mtmm -108.58 106.88 17.16 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 119.63 -0.828 . . . . 0.0 111.632 -179.577 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.581 ' HA ' HD21 ' A' ' 84' ' ' ASN . 8.1 m -110.05 166.26 11.08 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.016 177.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -80.75 132.35 35.52 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 119.929 -0.708 . . . . 0.0 110.415 178.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.1 p -101.97 130.9 48.61 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 171.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.2 tpt85 . . . . . 0 C--N 1.322 -0.625 0 C-N-CA 120.446 -0.502 . . . . 0.0 109.741 -176.412 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.477 HH11 ' HD3' ' A' ' 30' ' ' ARG . 1.1 ptt-85 . . . . . 0 N--CA 1.451 -0.417 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.9 m -97.14 133.48 41.73 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.615 -168.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 95.5 t -72.72 106.84 3.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 173.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 12.1 p -122.3 138.36 54.53 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.557 -0.457 . . . . 0.0 111.513 -177.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.548 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.9 t -77.66 115.92 17.79 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 173.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.2 m -89.17 178.21 6.42 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.709 -170.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.5 161.04 30.31 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.072 0.463 . . . . 0.0 112.181 -174.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -56.45 -33.32 65.79 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.791 -177.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -74.25 -29.57 61.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.133 0.492 . . . . 0.0 111.093 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.521 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 22.7 mt-30 -83.96 90.4 7.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.457 0.646 . . . . 0.0 110.114 -172.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.496 ' OG1' HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -102.48 14.5 31.8 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.52 -176.658 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.635 ' HD3' HG22 ' A' ' 58' ' ' VAL . 1.6 tpt180 -135.11 172.44 13.0 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 121.168 0.509 . . . . 0.0 109.724 175.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.599 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 70.1 m -131.0 131.64 44.49 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.511 -0.768 . . . . 0.0 108.943 179.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.525 ' HB3' ' HG2' ' A' ' 54' ' ' GLU . 0.7 OUTLIER -96.33 123.71 40.07 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.059 -177.151 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.529 ' HD2' ' HG3' ' A' ' 76' ' ' LYS . 71.9 t80 -131.64 109.37 10.16 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.853 170.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.651 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 39.9 t -99.42 134.22 39.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 172.044 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 1.049 ' HB3' ' HB2' ' A' ' 74' ' ' PRO . 1.9 tp-100 -93.4 114.78 27.28 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.856 -175.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.6 mm? -107.8 156.71 37.59 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.909 -179.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_exo -70.9 14.93 0.32 Allowed 'Trans proline' 0 CA--C 1.535 0.562 0 C-N-CA 123.23 2.62 . . . . 0.0 114.019 -176.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -171.02 -30.94 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.879 -178.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.543 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 23.8 p -124.31 -168.4 1.79 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.828 179.015 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -150.48 149.73 30.37 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 119.584 -0.846 . . . . 0.0 111.285 178.118 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.651 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 25.9 mm -98.78 129.49 49.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.777 175.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.423 ' OE1' ' HD3' ' A' ' 30' ' ' ARG . 48.5 mt-30 -140.31 130.25 24.69 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 119.811 -0.756 . . . . 0.0 110.565 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.525 ' HG2' ' HB3' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -163.4 163.86 24.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.733 -179.189 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.571 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.3 m -94.86 126.43 40.18 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 168.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.571 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 14.0 mptt -128.05 170.86 12.43 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 119.926 -0.71 . . . . 0.0 109.144 175.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 30.9 p -80.68 159.63 25.23 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 118.471 -1.292 . . . . 0.0 107.96 174.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.635 HG22 ' HD3' ' A' ' 41' ' ' ARG . 83.4 t -55.3 -43.75 72.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.53 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -66.54 -56.74 9.41 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.053 -178.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.697 ' O ' HG13 ' A' ' 64' ' ' VAL . 74.5 mt-30 -56.44 -44.38 80.38 Favored 'General case' 0 C--O 1.207 -1.178 0 O-C-N 123.456 0.473 . . . . 0.0 110.21 -177.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.732 ' HA ' HG22 ' A' ' 64' ' ' VAL . 0.5 OUTLIER -66.35 -31.6 72.48 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.852 -178.108 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.78 -41.18 75.45 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.189 -0.604 . . . . 0.0 110.141 173.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.489 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 45.3 mt-10 -56.32 -53.33 58.53 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.981 0.896 . . . . 0.0 110.655 175.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.732 HG22 ' HA ' ' A' ' 61' ' ' CYS . 5.7 m -72.73 -26.36 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.735 0 CA-C-N 114.532 -1.213 . . . . 0.0 111.081 -178.251 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.585 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 19.8 tp -56.85 -47.71 79.74 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 176.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.544 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 38.7 tt0 -73.98 -37.63 64.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.462 -176.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.633 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -58.3 -43.74 88.24 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.611 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.53 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 29.9 m -79.66 -31.75 14.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 120.599 -0.44 . . . . 0.0 112.06 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.544 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 21.0 p -73.87 -26.27 60.47 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.105 -178.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.87 -20.21 63.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.183 0.515 . . . . 0.0 110.493 176.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 67' ' ' GLU . 22.6 mt -82.07 -19.6 10.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.605 176.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 108.65 1.84 32.56 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.18 -1.01 . . . . 0.0 112.398 179.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 49.5 m-85 -87.43 134.53 35.97 Favored Pre-proline 0 N--CA 1.45 -0.469 0 CA-C-O 120.787 0.327 . . . . 0.0 111.385 -178.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 1.049 ' HB2' ' HB3' ' A' ' 46' ' ' GLN . 54.4 Cg_exo -59.55 130.82 37.16 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 123.394 2.729 . . . . 0.0 111.897 175.163 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -147.03 151.23 36.59 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.2 -0.6 . . . . 0.0 111.508 178.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.529 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 1.1 ptmt -151.01 119.57 6.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.549 179.312 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.599 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 65.7 m -113.57 97.97 6.77 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.358 -0.537 . . . . 0.0 109.893 168.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 3.5 p -108.46 157.42 18.45 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.069 177.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . 0.453 ' HB2' ' HD2' ' A' ' 41' ' ' ARG . 14.5 t -108.42 100.95 10.17 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.354 -175.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 79' ' ' CYS . 3.0 mm-40 178.9 151.01 0.3 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.653 ' HB3' HD22 ' A' ' 82' ' ' LEU . 70.0 m-20 -63.02 135.9 57.52 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 118.819 -1.152 . . . . 0.0 109.772 178.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.653 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 65.51 10.08 6.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.583 171.636 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 42.7 t -69.65 -20.69 63.58 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.726 0.774 . . . . 0.0 110.313 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.581 HD21 ' HA ' ' A' ' 22' ' ' CYS . 6.0 p30 . . . . . 0 C--N 1.324 -0.504 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.366 178.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.7 tp . . . . . 0 C--O 1.232 0.182 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.518 ' HB3' HG12 ' A' ' 32' ' ' VAL . 23.0 mtpp -115.33 101.17 8.68 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 119.219 -0.992 . . . . 0.0 111.867 178.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.402 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 8.4 m -100.71 158.38 15.99 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 173.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -76.37 142.21 41.24 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.35 -0.54 . . . . 0.0 109.779 174.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 88.9 m -133.64 129.57 37.06 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 173.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 16.5 mtm180 . . . . . 0 C--N 1.324 -0.54 0 C-N-CA 119.576 -0.85 . . . . 0.0 112.223 -173.698 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.5 mtt-85 . . . . . 0 N--CA 1.452 -0.33 0 CA-C-O 121.22 0.533 . . . . 0.0 111.073 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 m -115.29 139.24 50.14 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.065 -178.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.518 HG12 ' HB3' ' A' ' 21' ' ' LYS . 6.3 t -88.6 104.59 14.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 C-N-CA 119.789 -0.764 . . . . 0.0 109.846 177.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.2 p -87.61 150.24 23.79 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.858 -173.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 t -90.15 112.25 23.68 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 171.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.1 140.87 35.8 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.894 0.378 . . . . 0.0 110.499 -173.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.44 172.23 10.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.258 -171.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -56.19 -38.53 71.08 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.107 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.445 ' HG3' ' H ' ' A' ' 39' ' ' GLN . 3.2 pt-20 -52.07 -46.13 65.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.793 175.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.656 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 38.2 mt-30 -103.07 72.54 1.18 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.237 -177.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.09 15.57 11.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.302 -179.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.696 ' HG2' ' SG ' ' A' ' 61' ' ' CYS . 1.7 tpt180 -119.68 171.13 8.6 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.299 -0.56 . . . . 0.0 109.494 173.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.73 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.3 m -130.42 131.0 45.02 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.504 -179.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.541 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.7 OUTLIER -94.95 130.73 41.47 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.835 0.35 . . . . 0.0 110.507 -176.596 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.623 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 54.4 t80 -143.69 119.23 10.36 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.468 174.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.404 HG23 ' CD2' ' A' ' 43' ' ' LEU . 57.5 t -122.49 138.8 51.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.848 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 7.1 mm100 -75.58 142.0 42.8 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.663 178.421 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.639 HD21 HG13 ' A' ' 52' ' ' ILE . 3.4 mm? -130.55 158.57 74.22 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 169.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -76.27 13.82 1.26 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.761 2.308 . . . . 0.0 112.39 176.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -140.43 -54.48 0.51 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.467 0.651 . . . . 0.0 109.69 -179.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.608 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 6.7 p -137.83 -151.5 0.39 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.675 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.549 ' HA ' HD23 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -147.14 161.01 41.74 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.297 176.347 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.639 HG13 HD21 ' A' ' 47' ' ' LEU . 67.3 mt -92.92 133.96 32.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.524 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -135.1 130.51 35.62 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 120.345 -0.542 . . . . 0.0 109.544 176.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -169.99 162.24 9.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.06 177.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.402 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 4.4 m -86.81 140.8 29.33 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 170.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.541 ' HE3' HD12 ' A' ' 43' ' ' LEU . 5.0 tppt? -143.72 153.3 42.3 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.136 -0.626 . . . . 0.0 109.647 -178.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.656 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 29.3 p -69.45 142.82 53.72 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 176.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.684 HG22 ' HD3' ' A' ' 41' ' ' ARG . 39.9 t -54.96 -35.97 36.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-O 121.079 0.466 . . . . 0.0 110.794 -176.348 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.458 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 13.2 tt0 -69.1 -56.55 7.37 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.548 179.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.821 ' HA ' HE21 ' A' ' 60' ' ' GLN . 0.0 OUTLIER -67.55 -29.32 68.67 Favored 'General case' 0 C--O 1.209 -1.053 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.615 -175.543 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.696 ' SG ' ' HG2' ' A' ' 41' ' ' ARG . 2.5 p -67.25 -32.93 74.29 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.148 178.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.13 -44.79 75.32 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 173.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 49.6 mm-40 -53.74 -53.14 56.44 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.769 177.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.641 HG22 ' HA ' ' A' ' 61' ' ' CYS . 16.1 m -73.31 -26.84 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.626 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.315 -177.3 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.643 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 4.3 tp -62.67 -50.9 69.34 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.609 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 49.1 mt-10 -76.05 -29.61 58.09 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -176.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.625 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.3 pt-20 -61.94 -45.17 94.87 Favored 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.095 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.569 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 34.4 m -80.29 -31.06 12.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.609 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 15.7 p -71.15 -28.35 64.2 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.857 -179.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.76 -21.26 63.45 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.453 175.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 67' ' ' GLU . 28.4 mt -84.71 -26.37 6.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.794 176.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.428 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 121.33 -1.91 11.42 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.111 -1.042 . . . . 0.0 112.507 -179.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -88.19 112.77 51.7 Favored Pre-proline 0 N--CA 1.451 -0.38 0 CA-C-O 120.516 0.198 . . . . 0.0 111.099 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.848 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 32.4 Cg_exo -62.91 130.96 30.97 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.997 2.464 . . . . 0.0 112.059 176.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -145.19 155.19 43.12 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.35 -178.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -148.03 131.67 16.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.575 177.348 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.73 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 24.4 p -119.29 102.24 8.56 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.537 0.684 . . . . 0.0 109.723 165.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 2.5 p -107.49 163.46 13.04 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.298 178.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 7.1 p -108.55 101.33 10.5 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.405 -175.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.543 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 24.3 tt0 177.84 146.44 0.13 Allowed 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 -177.254 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.65 ' HB3' HD22 ' A' ' 82' ' ' LEU . 17.6 m-20 -60.47 138.15 58.05 Favored 'General case' 0 CA--C 1.506 -0.723 0 C-N-CA 119.471 -0.892 . . . . 0.0 109.793 177.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.65 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 63.13 18.58 11.06 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.664 173.613 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . 0.543 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 12.1 t -75.03 -23.95 58.23 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.096 0.474 . . . . 0.0 111.299 -173.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.566 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 29.6 p-10 . . . . . 0 C--N 1.325 -0.466 0 CA-C-O 121.589 0.709 . . . . 0.0 109.951 177.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.0 tp . . . . . 0 N--CA 1.46 0.073 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.556 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 30.8 mtmm -106.44 113.32 26.77 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.911 -0.315 . . . . 0.0 111.181 -177.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.605 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 34.7 m -116.47 138.11 51.64 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.729 178.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.661 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 11.8 m-85 -57.23 105.6 0.25 Allowed 'General case' 0 N--CA 1.465 0.309 0 O-C-N 123.118 0.261 . . . . 0.0 111.333 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.1 m -91.37 129.03 37.41 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 175.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 12.9 ttp180 . . . . . 0 C--N 1.33 -0.264 0 C-N-CA 119.768 -0.773 . . . . 0.0 111.196 -175.905 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 . . . . . 0 N--CA 1.445 -0.723 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.8 m -99.41 147.17 25.52 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.282 -170.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.528 HG13 HD11 ' A' ' 82' ' ' LEU . 58.0 t -78.07 105.67 7.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 172.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.5 p -125.09 140.21 53.09 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 120.07 -0.652 . . . . 0.0 111.172 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.556 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 2.2 t -88.39 111.67 22.02 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.637 176.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 81.7 m -95.57 161.3 14.11 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.685 -179.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.72 153.9 27.0 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.234 -175.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -66.84 -19.95 65.84 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.365 0.602 . . . . 0.0 110.914 178.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.593 ' HG2' HG22 ' A' ' 57' ' ' THR . 8.4 tt0 -46.72 -44.82 19.1 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.178 164.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.671 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 2.1 mt-30 -99.14 70.73 1.79 Allowed 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.541 -1.208 . . . . 0.0 109.567 -176.298 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.74 14.87 4.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.472 -0.786 . . . . 0.0 112.211 -173.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ARG . . . . . 0.668 ' CG ' ' HA ' ' A' ' 58' ' ' VAL . 13.6 mmt85 -131.77 177.4 7.55 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.374 0.606 . . . . 0.0 109.993 172.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.67 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 8.6 m -133.56 139.56 46.65 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.085 -0.961 . . . . 0.0 108.68 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.568 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -99.33 122.99 43.24 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.717 0.294 . . . . 0.0 110.341 -177.035 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.663 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 56.3 t80 -131.7 107.28 8.69 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.953 171.229 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.563 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 43.9 t -102.62 138.65 26.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 120.411 -0.516 . . . . 0.0 109.681 177.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.772 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 3.7 mm100 -77.9 139.27 39.22 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 176.009 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.666 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.1 mm? -135.03 153.0 78.2 Favored Pre-proline 0 C--N 1.317 -0.846 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.896 178.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -87.77 8.75 4.07 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.463 2.109 . . . . 0.0 112.221 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -133.92 -24.8 1.67 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.967 0.413 . . . . 0.0 110.95 -179.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.666 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 68.0 m -162.31 -157.83 0.49 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 -175.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.402 ' HB3' ' HE1' ' A' ' 44' ' ' PHE . 49.5 mt-10 -140.81 135.92 31.92 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 172.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ILE . . . . . 0.663 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 59.6 mt -88.96 127.05 41.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.621 178.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.474 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 24.2 mt-30 -139.35 130.46 26.55 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 123.499 0.499 . . . . 0.0 109.917 177.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -173.4 172.32 3.76 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.671 0.607 . . . . 0.0 110.198 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.605 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 34.7 m -98.82 138.24 36.25 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.683 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.568 ' HE3' HD12 ' A' ' 43' ' ' LEU . 66.0 mmtt -137.66 156.05 48.46 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.671 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 7.8 p -69.77 152.74 44.26 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 172.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.668 ' HA ' ' CG ' ' A' ' 41' ' ' ARG . 40.3 t -49.7 -55.33 5.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.799 0.333 . . . . 0.0 110.513 -176.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.581 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 39.0 tt0 -61.82 -55.14 33.02 Favored 'General case' 0 C--O 1.217 -0.624 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.371 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.787 ' O ' HG13 ' A' ' 64' ' ' VAL . 3.8 tt0 -54.46 -38.84 66.83 Favored 'General case' 0 C--O 1.206 -1.197 0 O-C-N 123.11 0.256 . . . . 0.0 111.202 -175.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.655 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.4 t -69.68 -32.8 71.62 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 120.069 -0.652 . . . . 0.0 110.382 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.8 -39.35 87.73 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.038 171.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 14.5 mm-40 -57.79 -52.54 65.05 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.96 0.886 . . . . 0.0 110.217 176.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.787 HG13 ' O ' ' A' ' 60' ' ' GLN . 4.7 m -69.83 -26.41 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.759 0 CA-C-N 114.591 -1.186 . . . . 0.0 111.053 -178.669 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.697 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -55.75 -49.36 73.32 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 174.787 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -73.26 -36.39 66.36 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.535 -0.466 . . . . 0.0 112.102 -174.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.645 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 12.3 pt-20 -59.41 -43.35 93.05 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.292 -179.205 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.517 HG22 ' O ' ' A' ' 64' ' ' VAL . 34.6 m -79.37 -34.95 16.57 Favored 'Isoleucine or valine' 0 C--O 1.231 0.096 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.488 -179.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 95.7 m -74.67 -20.54 59.83 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 0.0 110.882 -176.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.3 -23.34 57.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.021 0.439 . . . . 0.0 110.015 173.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 67' ' ' GLU . 14.3 mt -82.8 -25.86 8.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.723 176.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.46 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 115.52 7.67 15.66 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.279 -0.962 . . . . 0.0 112.017 -178.256 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -101.03 106.21 43.22 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-O 120.701 0.286 . . . . 0.0 111.063 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.772 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 74.8 Cg_exo -57.2 130.63 40.47 Favored 'Trans proline' 0 N--CA 1.471 0.173 0 C-N-CA 123.383 2.722 . . . . 0.0 113.043 177.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.697 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -126.16 159.32 33.23 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.034 175.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -135.46 120.98 19.31 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.836 -178.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.67 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 70.1 m -123.27 92.45 3.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.178 0.513 . . . . 0.0 110.721 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.7 p -110.29 159.87 17.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.763 -176.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 41.8 t -109.71 102.79 11.57 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.04 -178.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.544 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 9.9 tt0 -175.02 146.99 0.9 Allowed 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 -178.279 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.734 ' HB3' HD22 ' A' ' 82' ' ' LEU . 58.2 m-20 -63.78 135.18 56.43 Favored 'General case' 0 CA--C 1.504 -0.818 0 C-N-CA 117.878 -1.529 . . . . 0.0 109.313 177.031 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.734 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.76 20.37 12.11 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.166 174.116 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' CYS . . . . . 0.544 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.7 t -65.24 -45.78 83.24 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.397 -173.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.506 HD22 ' N ' ' A' ' 84' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.357 0 C-N-CA 119.517 -0.873 . . . . 0.0 109.443 174.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 52.9 ttm . . . . . 0 N--CA 1.477 0.898 0 N-CA-C 110.347 -0.242 . . . . 0.0 110.347 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.532 ' HB1' ' OG1' ' A' ' 34' ' ' THR . . . 67.4 107.76 0.04 OUTLIER 'General case' 0 C--O 1.234 0.261 0 O-C-N 124.219 0.949 . . . . 0.0 112.867 174.327 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.514 HD23 HG22 ' A' ' 40' ' ' THR . 2.3 mm? -90.95 138.59 31.48 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 175.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 33' ' ' THR . 30.5 mtmm -115.02 98.61 6.9 Favored 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 119.552 -0.859 . . . . 0.0 111.323 -178.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 27.9 m -123.1 165.98 15.93 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.12 175.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.451 ' HA ' ' O ' ' A' ' 31' ' ' THR . 76.8 m-85 -72.01 131.55 43.06 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.317 -0.402 . . . . 0.0 111.145 -176.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.1 m -116.82 128.02 54.88 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 167.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.781 ' HE ' ' HA ' ' A' ' 28' ' ' ASP . 18.6 ttt180 -101.5 110.09 22.02 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.441 -173.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 15.7 t-20 -100.7 85.78 2.98 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 176.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.38 -89.9 0.87 Allowed Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 119.53 -1.319 . . . . 0.0 110.971 -173.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.781 ' HA ' ' HE ' ' A' ' 25' ' ' ARG . 17.7 t70 -144.9 0.62 0.96 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.161 0.505 . . . . 0.0 110.974 -179.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.542 ' O ' ' HG3' ' A' ' 25' ' ' ARG . 3.8 p-10 -75.73 165.48 24.97 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.788 -176.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 51.2 mtp85 -126.38 111.82 14.92 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 119.794 -0.763 . . . . 0.0 109.099 172.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.451 ' O ' ' HA ' ' A' ' 23' ' ' PHE . 97.1 m -130.88 133.41 45.87 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.324 -175.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 59.3 t -73.9 106.5 3.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.868 175.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.579 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 38.4 p -106.46 148.16 28.49 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.607 178.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.532 ' OG1' ' HB1' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -107.3 112.51 25.39 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.458 -179.526 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.509 ' O ' ' HA ' ' A' ' 19' ' ' ALA . 2.5 p -95.1 166.11 12.09 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.037 -178.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -76.27 174.77 9.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.511 -176.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.08 -28.27 66.33 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.368 -178.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.595 ' O ' HG23 ' A' ' 57' ' ' THR . 3.3 pt-20 -54.91 -56.78 15.83 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.645 175.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.741 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 54.9 mt-30 -86.96 53.6 2.89 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.774 -172.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.514 HG22 HD23 ' A' ' 20' ' ' LEU . 0.1 OUTLIER -73.67 -0.36 15.25 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.922 0.712 . . . . 0.0 112.922 -173.283 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.627 ' CG ' ' HA ' ' A' ' 58' ' ' VAL . 3.7 mmp_? -110.75 178.84 4.23 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 119.943 -0.703 . . . . 0.0 109.91 173.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.654 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 61.2 m -135.73 131.93 36.22 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.066 -177.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.51 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.5 OUTLIER -93.12 128.72 39.16 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.288 -176.815 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.616 ' HB2' ' HB2' ' A' ' 84' ' ' ASN . 80.7 t80 -140.16 117.3 11.21 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.147 172.334 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.59 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 40.5 t -115.11 136.05 53.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 N-CA-C 109.936 -0.394 . . . . 0.0 109.936 178.67 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.795 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 8.2 mm100 -74.22 139.73 44.57 Favored 'General case' 0 C--O 1.232 0.171 0 C-N-CA 120.851 -0.34 . . . . 0.0 110.141 177.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.569 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.8 mm? -132.19 147.86 67.47 Favored Pre-proline 0 C--N 1.316 -0.862 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 172.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 11.6 Cg_exo -72.84 8.98 1.44 Allowed 'Trans proline' 0 CA--C 1.53 0.276 0 C-N-CA 122.682 2.255 . . . . 0.0 112.479 177.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -139.02 -59.35 0.59 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.394 0.616 . . . . 0.0 109.566 -177.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.569 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 13.1 m -121.62 -150.08 0.44 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.436 -179.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HG2' ' NH1' ' A' ' 25' ' ' ARG . 2.7 pt-20 -151.21 147.8 27.45 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 177.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.59 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 22.5 mm -91.44 129.42 42.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 120.759 -0.376 . . . . 0.0 110.259 176.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.446 ' HB3' ' ND2' ' A' ' 84' ' ' ASN . 45.7 mt-30 -139.09 130.22 26.66 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.102 -178.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -173.6 160.56 3.81 Favored 'General case' 0 N--CA 1.463 0.21 0 O-C-N 123.403 0.439 . . . . 0.0 111.146 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.516 ' O ' ' HE2' ' A' ' 56' ' ' LYS . 1.3 m -79.27 147.25 32.6 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 168.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.516 ' HE2' ' O ' ' A' ' 55' ' ' CYS . 7.1 tppt? -156.96 132.5 9.31 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.154 -179.062 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.741 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 38.1 m -54.28 143.17 23.97 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.753 178.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.627 ' HA ' ' CG ' ' A' ' 41' ' ' ARG . 20.1 t -44.84 -61.46 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.352 0 O-C-N 123.796 0.685 . . . . 0.0 111.511 -173.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -57.51 -52.36 65.71 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.161 178.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.675 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 0.0 OUTLIER -54.56 -47.48 73.19 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.86 -176.625 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.66 ' HA ' HG22 ' A' ' 64' ' ' VAL . 4.2 t -65.9 -32.8 74.52 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.382 -178.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.36 -41.35 85.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.217 0.532 . . . . 0.0 110.835 176.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.675 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 9.1 pt-20 -74.52 -38.07 62.9 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.552 -176.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.66 HG22 ' HA ' ' A' ' 61' ' ' CYS . 13.5 m -72.23 -26.32 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-O 121.428 0.632 . . . . 0.0 110.414 174.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.66 HD23 ' SG ' ' A' ' 77' ' ' CYS . 0.2 OUTLIER -56.02 -47.64 77.42 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 174.059 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -72.7 -36.56 67.87 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.991 -0.55 . . . . 0.0 112.054 -174.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.64 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.5 pt-20 -59.6 -43.68 93.64 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.025 -0.67 . . . . 0.0 110.236 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.54 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 35.0 m -79.17 -34.42 16.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.951 0.405 . . . . 0.0 111.552 -178.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 97.8 m -78.42 -15.67 58.42 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.165 0.507 . . . . 0.0 110.861 -176.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.64 -19.56 45.08 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.082 173.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.514 HG13 ' O ' ' A' ' 67' ' ' GLU . 29.9 mt -81.0 -27.11 10.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.864 177.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 119.76 4.18 11.84 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 119.891 -1.147 . . . . 0.0 112.306 -178.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -97.82 112.4 61.52 Favored Pre-proline 0 N--CA 1.449 -0.499 0 CA-C-O 120.536 0.208 . . . . 0.0 110.797 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.795 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 54.4 Cg_exo -58.29 134.98 65.13 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.11 2.54 . . . . 0.0 112.306 177.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -143.29 160.92 39.6 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 119.983 -0.687 . . . . 0.0 111.427 178.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.412 ' HE3' ' HB3' ' A' ' 76' ' ' LYS . 7.6 ptpp? -142.19 147.58 36.82 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.917 175.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.66 ' SG ' HD23 ' A' ' 65' ' ' LEU . 76.6 m -130.24 87.08 2.46 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.151 173.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 15.4 p -106.95 171.02 7.6 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 119.943 -0.703 . . . . 0.0 111.475 -175.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.508 ' HB3' ' CZ ' ' A' ' 41' ' ' ARG . 10.0 p -115.35 107.08 14.77 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.085 0.469 . . . . 0.0 111.486 -174.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.536 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 23.7 tt0 177.63 153.17 0.27 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 106.938 -1.505 . . . . 0.0 106.938 179.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.697 ' HB3' HD22 ' A' ' 82' ' ' LEU . 62.2 m-20 -64.43 137.31 57.81 Favored 'General case' 0 CA--C 1.505 -0.765 0 C-N-CA 117.563 -1.655 . . . . 0.0 108.66 173.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.697 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.99 15.8 10.19 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.607 175.12 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . 0.536 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.2 t -64.83 -23.42 67.23 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.654 -172.497 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.616 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 19.5 p-10 -73.46 81.31 1.44 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 122.03 0.919 . . . . 0.0 110.606 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -165.13 163.38 20.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 114.196 -1.365 . . . . 0.0 109.076 -174.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 71.3 m -153.98 -60.81 0.13 Allowed 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.455 173.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.556 ' CD ' ' H ' ' A' ' 87' ' ' GLU . 1.4 pm0 -83.58 33.87 0.47 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.557 -174.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.426 178.191 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.462 ' O ' ' HG3' ' A' ' 18' ' ' MET . 22.6 ptm . . . . . 0 N--CA 1.478 0.93 0 CA-C-O 121.207 0.527 . . . . 0.0 110.358 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -90.07 -175.49 4.58 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.066 179.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 46.2 tp -135.61 148.41 49.01 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.658 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.512 ' HA ' ' O ' ' A' ' 33' ' ' THR . 9.9 mtmp? -91.44 102.9 15.58 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 120.449 -0.5 . . . . 0.0 111.306 178.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 30.4 m -111.26 139.34 46.73 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.287 -0.635 . . . . 0.0 109.287 178.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.666 ' N ' HD21 ' A' ' 84' ' ' ASN . 19.0 m-85 -54.24 123.86 14.07 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.674 -0.41 . . . . 0.0 110.893 175.248 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -100.61 167.36 10.39 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 171.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.569 ' HG3' ' HB2' ' A' ' 53' ' ' GLN . 7.2 mtp180 -123.82 111.35 16.0 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.062 -0.655 . . . . 0.0 112.241 178.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -98.53 107.32 19.74 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 170.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 65.23 -98.75 0.33 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 119.497 -1.335 . . . . 0.0 110.831 -172.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.555 ' HA ' ' NH2' ' A' ' 25' ' ' ARG . 8.7 t70 -130.62 -4.07 4.18 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.529 -0.468 . . . . 0.0 110.597 173.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -75.46 157.61 33.82 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 118.174 -1.41 . . . . 0.0 108.989 177.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.2 mmt85 -106.33 130.98 54.07 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 119.068 -1.053 . . . . 0.0 109.491 -179.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.3 m -114.28 114.9 26.58 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 115.097 -0.956 . . . . 0.0 111.53 -169.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.4 HG22 ' CE1' ' A' ' 23' ' ' PHE . 48.6 t -80.01 106.37 11.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 174.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.512 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 47.2 p -128.48 142.74 50.99 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.212 -0.595 . . . . 0.0 111.313 -178.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 t -85.43 121.73 28.56 Favored 'General case' 0 N--CA 1.442 -0.853 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 165.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.4 t -87.66 -163.39 0.93 Allowed 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.536 -172.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.27 168.67 12.52 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.65 -0.42 . . . . 0.0 111.04 -176.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -60.21 -18.68 50.05 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.042 178.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.812 ' HG2' HG22 ' A' ' 57' ' ' THR . 19.1 tt0 -63.63 -40.94 98.15 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.44 176.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.406 ' OE1' ' HB3' ' A' ' 38' ' ' GLU . 22.0 mp0 -96.98 120.88 38.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.656 0.741 . . . . 0.0 112.741 -169.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.428 ' OG1' HG23 ' A' ' 58' ' ' VAL . 1.1 p -124.92 12.53 8.43 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.552 -1.204 . . . . 0.0 110.582 177.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.512 ' CG ' ' HB3' ' A' ' 77' ' ' CYS . 8.2 tpp85 -138.18 173.4 11.66 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.489 177.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.651 ' HB3' ' OD1' ' A' ' 84' ' ' ASN . 18.1 m -126.36 149.31 49.28 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.557 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.3 OUTLIER -110.1 122.03 46.64 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 123.147 0.279 . . . . 0.0 110.298 -176.231 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.618 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 50.2 t80 -133.12 104.06 6.32 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.487 173.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.531 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 61.8 t -101.48 134.36 42.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 176.118 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.746 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 1.6 mm100 -76.78 138.07 39.66 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 119.777 -0.769 . . . . 0.0 109.637 177.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.48 HD22 ' C ' ' A' ' 46' ' ' GLN . 2.9 mm? -138.51 152.38 70.96 Favored Pre-proline 0 C--N 1.314 -0.978 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.762 176.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -86.32 9.42 4.04 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 122.438 2.092 . . . . 0.0 111.424 172.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -125.0 -65.39 1.03 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.842 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 33.3 m -151.85 132.24 13.75 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.13 149.85 37.29 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.79 0.329 . . . . 0.0 110.542 -172.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.618 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 65.8 mt -90.95 124.91 43.7 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.377 178.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.569 ' HB2' ' HG3' ' A' ' 25' ' ' ARG . 48.5 mt-30 -135.85 129.96 33.16 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 178.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -176.25 163.69 2.6 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 123.419 0.449 . . . . 0.0 110.979 -179.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 2.0 p -85.88 135.87 33.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.724 0.297 . . . . 0.0 110.585 177.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.559 ' HB2' ' HB2' ' A' ' 61' ' ' CYS . 68.1 mmtt -138.71 158.76 43.64 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 176.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.812 HG22 ' HG2' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -69.54 155.2 40.85 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 107.605 -1.258 . . . . 0.0 107.605 171.722 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.478 ' HA ' ' HB2' ' A' ' 41' ' ' ARG . 85.3 t -52.76 -46.09 50.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.254 -0.579 . . . . 0.0 109.92 179.077 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.582 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 37.5 tt0 -66.87 -55.56 14.2 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.117 178.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.806 ' O ' HG13 ' A' ' 64' ' ' VAL . 7.8 tt0 -54.84 -40.23 69.4 Favored 'General case' 0 C--O 1.212 -0.887 0 O-C-N 123.331 0.394 . . . . 0.0 110.594 -175.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.668 ' HA ' HG22 ' A' ' 64' ' ' VAL . 3.8 t -69.93 -32.19 70.35 Favored 'General case' 0 C--N 1.317 -0.835 0 C-N-CA 120.765 -0.374 . . . . 0.0 110.711 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.37 -38.75 85.24 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 120.526 -0.47 . . . . 0.0 110.059 171.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.582 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 11.5 mm-40 -57.61 -52.71 64.3 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 122.114 0.959 . . . . 0.0 110.202 175.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.806 HG13 ' O ' ' A' ' 60' ' ' GLN . 4.2 m -71.06 -26.06 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.79 0 CA-C-N 114.45 -1.25 . . . . 0.0 110.84 -178.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.662 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -56.09 -49.33 74.13 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 175.23 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -72.88 -37.11 67.43 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 120.562 -0.455 . . . . 0.0 112.011 -174.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.645 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 12.1 pt-20 -59.25 -42.95 92.33 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.109 -0.637 . . . . 0.0 110.355 -179.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.499 HG22 ' O ' ' A' ' 64' ' ' VAL . 34.8 m -79.3 -36.37 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.174 0 CA-C-O 120.827 0.346 . . . . 0.0 111.691 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 98.3 m -74.75 -20.74 59.7 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.994 -175.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.61 -23.7 58.75 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.152 0.501 . . . . 0.0 110.149 174.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.497 HG13 ' O ' ' A' ' 67' ' ' GLU . 12.1 mt -81.03 -23.85 10.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.666 177.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.463 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 112.87 5.82 23.41 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.979 -178.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -98.66 107.94 45.61 Favored Pre-proline 0 N--CA 1.449 -0.475 0 CA-C-O 120.777 0.322 . . . . 0.0 111.081 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.746 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 74.9 Cg_exo -55.38 130.75 42.26 Favored 'Trans proline' 0 C--N 1.34 0.118 0 C-N-CA 123.478 2.785 . . . . 0.0 113.262 177.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.662 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -128.38 154.51 45.92 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.889 174.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -134.61 118.81 17.62 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.885 -179.198 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.592 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 45.9 m -114.34 93.85 4.53 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.187 173.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 17.8 p -109.33 155.1 21.6 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.944 -178.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 49.6 t -109.48 103.44 12.34 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 119.991 -0.684 . . . . 0.0 110.469 -174.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.511 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 14.4 tt0 -173.87 152.67 2.01 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.82 -1.548 . . . . 0.0 106.82 -179.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.722 ' HB3' HD22 ' A' ' 82' ' ' LEU . 28.7 m-20 -63.48 136.43 57.58 Favored 'General case' 0 CA--C 1.504 -0.812 0 C-N-CA 117.878 -1.529 . . . . 0.0 109.389 176.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.722 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 62.38 21.53 12.61 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.114 174.654 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . 0.517 ' O ' ' HG2' ' A' ' 85' ' ' ARG . 8.1 t -68.43 -37.03 79.91 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.559 -172.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.666 HD21 ' N ' ' A' ' 23' ' ' PHE . 0.3 OUTLIER -74.29 91.96 2.22 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 119.085 -1.046 . . . . 0.0 109.528 175.454 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.517 ' HG2' ' O ' ' A' ' 83' ' ' CYS . 5.6 ptt180 -132.4 156.76 46.1 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.835 -171.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.5 m -56.62 115.82 2.77 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.796 0.685 . . . . 0.0 111.413 -176.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -99.08 -33.08 10.94 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.333 -0.848 . . . . 0.0 110.096 -179.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.601 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.725 178.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 49.6 tpp . . . . . 0 N--CA 1.477 0.882 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -65.27 126.63 28.78 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 123.476 0.485 . . . . 0.0 110.845 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.627 HD23 HG22 ' A' ' 40' ' ' THR . 2.6 mm? -95.5 130.99 42.15 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.829 -178.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.761 ' HE3' ' N ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -83.92 124.49 31.05 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 171.689 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.624 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 12.3 t -147.47 153.54 39.67 Favored 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 119.399 -0.921 . . . . 0.0 109.972 -177.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.737 ' H ' HD21 ' A' ' 84' ' ' ASN . 92.1 m-85 -84.55 123.13 29.96 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 119.179 -1.009 . . . . 0.0 109.354 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.5 m -113.78 131.42 56.22 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 175.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.986 HH11 ' HA ' ' A' ' 28' ' ' ASP . 1.8 tpp180 -82.92 110.45 17.92 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.059 0.457 . . . . 0.0 110.379 -178.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.418 ' N ' HD22 ' A' ' 26' ' ' ASN . 0.9 OUTLIER -106.84 94.11 4.93 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 175.875 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 71.53 -98.26 0.74 Allowed Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 119.157 -1.497 . . . . 0.0 110.561 -173.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.986 ' HA ' HH11 ' A' ' 25' ' ' ARG . 33.5 t70 -115.9 -29.01 6.49 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.127 -0.629 . . . . 0.0 109.848 173.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -58.79 129.24 41.18 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.214 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 30' ' ' ARG . 27.4 mtp-105 -120.44 113.81 20.87 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 176.561 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.499 ' O ' ' HA ' ' A' ' 23' ' ' PHE . 9.1 t -140.15 163.97 31.3 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 120.323 -0.551 . . . . 0.0 111.753 -173.094 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.413 HG13 ' HB3' ' A' ' 21' ' ' LYS . 94.8 t -79.12 120.78 30.98 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.236 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.396 178.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 21.3 p -113.21 141.49 46.9 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.171 173.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.7 t -87.11 111.93 21.42 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 174.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 9.1 m -107.2 157.54 17.8 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.924 -171.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -70.12 170.99 10.39 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 113.04 0.756 . . . . 0.0 113.04 -167.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -52.68 -39.06 61.54 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.449 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.431 ' HG3' ' N ' ' A' ' 39' ' ' GLN . 4.5 pt-20 -56.85 -40.81 76.8 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.828 177.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.622 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 70.5 mt-30 -97.21 64.96 1.96 Allowed 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.797 -174.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.627 HG22 HD23 ' A' ' 20' ' ' LEU . 0.7 OUTLIER -89.71 27.28 1.56 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-O 121.433 0.635 . . . . 0.0 110.427 177.461 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.61 ' HD3' HG22 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -136.23 177.78 7.57 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.979 178.253 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.8 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.0 m -137.21 131.28 32.22 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.809 179.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.456 ' HG ' ' SG ' ' A' ' 61' ' ' CYS . 0.5 OUTLIER -94.01 118.43 31.5 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 176.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.558 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 91.5 t80 -134.76 118.83 17.49 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.226 175.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.569 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 58.8 t -125.29 141.59 44.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.982 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.991 HE21 ' HA ' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -83.52 137.1 34.02 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-O 121.138 0.494 . . . . 0.0 110.901 177.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.581 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.7 mm? -131.9 154.02 81.6 Favored Pre-proline 0 C--N 1.319 -0.744 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 175.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -82.91 18.72 1.43 Allowed 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.28 1.986 . . . . 0.0 112.267 177.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -138.35 -44.43 0.5 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.461 0.648 . . . . 0.0 109.747 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.581 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 48.1 m -150.77 -151.39 0.39 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.523 -0.918 . . . . 0.0 108.523 178.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.29 153.78 42.37 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.364 -0.534 . . . . 0.0 111.264 175.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.569 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 14.3 mm -87.65 127.01 41.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.491 177.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.533 ' HB3' ' O ' ' A' ' 23' ' ' PHE . 83.5 mt-30 -140.69 129.11 22.57 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 123.556 0.535 . . . . 0.0 110.232 176.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.48 ' OE2' HG23 ' A' ' 52' ' ' ILE . 0.5 OUTLIER -174.03 146.1 1.15 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.936 -177.314 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.624 ' SG ' ' HB3' ' A' ' 22' ' ' CYS . 88.2 m -79.91 118.67 21.87 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 119.984 -0.687 . . . . 0.0 109.223 169.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -124.0 156.18 36.92 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 174.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.622 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 15.6 p -67.34 153.8 42.84 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 119.405 -0.918 . . . . 0.0 109.435 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.61 HG22 ' HD3' ' A' ' 41' ' ' ARG . 58.7 t -53.31 -46.67 57.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 121.221 -0.192 . . . . 0.0 111.105 -175.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 15.0 tt0 -62.3 -55.82 24.48 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 120.903 0.382 . . . . 0.0 111.234 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.6 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 58.5 tt0 -64.14 -42.86 96.64 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.59 -172.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.652 ' HA ' HG22 ' A' ' 64' ' ' VAL . 4.7 t -64.52 -31.5 72.73 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.5 -0.48 . . . . 0.0 109.84 178.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.436 ' O ' ' HB3' ' A' ' 65' ' ' LEU . . . -69.68 -40.07 76.6 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 120.546 -0.462 . . . . 0.0 111.209 176.445 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.6 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 12.4 pt-20 -72.85 -38.47 67.06 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.95 0.405 . . . . 0.0 110.653 -178.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.652 HG22 ' HA ' ' A' ' 61' ' ' CYS . 12.8 m -73.56 -26.39 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.366 0 CA-C-O 121.638 0.732 . . . . 0.0 110.446 174.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.558 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 25.6 tp -54.94 -47.46 74.42 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 174.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.555 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 40.0 tt0 -73.98 -39.84 63.39 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.601 -0.727 . . . . 0.0 112.486 -175.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.644 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.0 pt-20 -55.24 -45.28 76.03 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.549 -177.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.591 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 33.0 m -80.16 -32.93 13.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -179.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.555 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 13.9 p -70.19 -27.98 64.94 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 120.297 -0.561 . . . . 0.0 111.217 -178.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.32 -19.74 63.87 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.629 176.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 11.3 mt -87.85 -20.31 7.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.827 177.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 114.51 -1.88 23.5 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 119.935 -1.126 . . . . 0.0 112.648 179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.419 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 80.4 m-85 -78.71 123.51 85.36 Favored Pre-proline 0 C--N 1.327 -0.398 0 CA-C-N 116.663 0.232 . . . . 0.0 111.155 -178.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.651 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 52.8 Cg_exo -62.0 117.68 4.53 Favored 'Trans proline' 0 CA--C 1.516 -0.394 0 C-N-CA 123.045 2.497 . . . . 0.0 111.973 175.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.476 ' HA ' ' O ' ' A' ' 44' ' ' PHE . . . -135.22 149.4 49.87 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.811 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.0 ptmt -150.15 112.64 4.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.483 178.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.8 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 29.6 m -103.23 92.56 4.56 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 119.985 -0.686 . . . . 0.0 109.569 170.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.3 p -107.84 160.39 15.78 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.654 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 7.9 p -109.42 101.36 10.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.991 0.424 . . . . 0.0 111.029 -175.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.569 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 3.4 tt0 179.64 152.04 0.41 Allowed 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -179.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.671 ' HB3' HD22 ' A' ' 82' ' ' LEU . 78.0 m-20 -64.37 132.54 50.4 Favored 'General case' 0 CA--C 1.506 -0.714 0 C-N-CA 118.388 -1.325 . . . . 0.0 109.981 -179.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.671 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.54 16.84 10.53 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.531 172.883 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . 0.569 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 39.6 t -61.37 -18.54 59.22 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -172.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.737 HD21 ' H ' ' A' ' 23' ' ' PHE . 4.3 p30 -60.09 -81.45 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.599 0 CA-C-O 119.234 -0.412 . . . . 0.0 110.474 -179.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.471 ' H ' ' CG ' ' A' ' 84' ' ' ASN . 9.4 ptt180 31.96 -123.73 0.06 Allowed 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 124.325 1.05 . . . . 0.0 113.182 174.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.4 m 71.96 21.47 4.09 Favored 'General case' 0 N--CA 1.47 0.567 0 N-CA-C 111.838 0.31 . . . . 0.0 111.838 175.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.6 mp0 -71.75 -27.85 63.26 Favored 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 120.669 -0.412 . . . . 0.0 110.334 178.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 . . . . . 0 C--N 1.331 -0.207 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.394 178.098 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 66.5 mtm . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -72.67 116.58 13.32 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 123.373 0.421 . . . . 0.0 110.659 178.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -90.1 147.88 23.35 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.33 -0.548 . . . . 0.0 109.718 -177.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.508 ' HG2' ' HB ' ' A' ' 34' ' ' THR . 29.0 mtmm -120.9 98.57 6.06 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 119.471 -0.892 . . . . 0.0 110.808 176.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 4.2 m -107.17 151.62 25.17 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.201 -0.909 . . . . 0.0 109.262 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.611 ' CD1' ' HB2' ' A' ' 85' ' ' ARG . 28.8 m-85 -73.28 153.56 40.53 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.636 -0.425 . . . . 0.0 110.823 179.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.4 m -142.11 127.91 19.32 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.41 177.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.758 HH11 ' HG2' ' A' ' 51' ' ' GLU . 63.0 mtp180 -91.09 110.87 22.15 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 119.379 -0.929 . . . . 0.0 111.161 -178.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -98.77 85.73 3.37 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.599 0.714 . . . . 0.0 109.906 177.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.52 -87.73 1.27 Allowed Glycine 0 N--CA 1.444 -0.828 0 C-N-CA 119.667 -1.254 . . . . 0.0 110.869 -173.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -125.21 -53.37 1.62 Allowed 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.894 176.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -65.03 162.15 17.3 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.317 0.579 . . . . 0.0 110.672 -178.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.552 ' HB3' ' HG2' ' A' ' 25' ' ' ARG . 15.0 ptp180 -125.46 115.56 20.44 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.562 -175.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 19.1 p -94.99 157.02 16.08 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.199 -178.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 61.8 t -99.31 112.81 32.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 176.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.484 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 41.3 p -107.64 148.01 29.9 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.394 176.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.508 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 1.7 t -101.92 112.28 24.85 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.753 176.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 39' ' ' GLN . 1.6 p -95.12 162.55 13.66 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.4 -175.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.53 178.04 7.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.749 -173.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -51.23 -33.07 26.28 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.494 0.664 . . . . 0.0 110.343 174.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.51 ' HG2' HG22 ' A' ' 57' ' ' THR . 39.8 tt0 -51.3 -49.61 60.95 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.387 -1.278 . . . . 0.0 110.939 175.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.564 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 34.8 mm-40 -96.76 94.29 7.19 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 119.715 -0.794 . . . . 0.0 109.67 -179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -107.8 18.87 20.82 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 119.887 -0.725 . . . . 0.0 110.591 177.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.741 ' HG2' ' SG ' ' A' ' 61' ' ' CYS . 2.8 tpt180 -131.29 174.45 10.04 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.502 174.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.669 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.1 m -134.01 131.07 38.47 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.338 -0.847 . . . . 0.0 108.739 178.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.562 HD22 HG23 ' A' ' 45' ' ' VAL . 0.2 OUTLIER -91.79 128.91 37.81 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -179.328 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.553 ' HB2' ' HB2' ' A' ' 84' ' ' ASN . 24.9 t80 -138.36 102.14 4.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.323 172.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.606 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 31.8 t -105.35 133.95 48.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 175.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.881 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -97.68 134.01 41.44 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.013 -179.118 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.519 HD23 ' HA ' ' A' ' 51' ' ' GLU . 3.7 mm? -119.48 157.85 50.58 Favored Pre-proline 0 C--N 1.319 -0.734 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -59.38 -28.41 87.51 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.473 2.115 . . . . 0.0 113.013 -178.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 99.0 m-85 -135.31 9.76 3.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.822 0.344 . . . . 0.0 111.021 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.452 ' C ' ' HB2' ' A' ' 47' ' ' LEU . 37.2 m -156.58 -166.63 2.18 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.528 -0.469 . . . . 0.0 109.97 -175.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.758 ' HG2' HH11 ' A' ' 25' ' ' ARG . 7.7 pt-20 -165.6 151.05 9.07 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.681 -0.489 . . . . 0.0 109.681 175.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.606 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 24.7 mm -105.87 128.39 60.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.457 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.441 HE22 ' HA ' ' A' ' 85' ' ' ARG . 17.7 mt-30 -139.2 130.56 26.94 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.999 -0.68 . . . . 0.0 110.124 -179.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -165.74 158.73 15.55 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.678 -178.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.422 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 6.3 m -77.98 117.51 19.38 Favored 'General case' 0 CA--C 1.507 -0.687 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 163.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.422 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 11.1 mptt -123.86 144.93 49.45 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 176.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.564 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 21.9 p -63.01 156.86 23.44 Favored 'General case' 0 C--N 1.315 -0.924 0 C-N-CA 118.925 -1.11 . . . . 0.0 108.127 -178.105 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.56 HG22 ' HD3' ' A' ' 41' ' ' ARG . 57.6 t -58.17 -37.04 60.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.033 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -65.52 -55.68 16.48 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.981 177.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.633 ' O ' HG13 ' A' ' 64' ' ' VAL . 34.1 tt0 -64.06 -28.59 69.89 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.23 -175.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.741 ' SG ' ' HG2' ' A' ' 41' ' ' ARG . 0.5 OUTLIER -67.86 -33.84 75.54 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 120.453 -0.499 . . . . 0.0 109.997 178.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.12 -40.41 78.31 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 174.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.567 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 88.1 mt-10 -58.45 -53.2 61.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.647 177.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.637 HG22 ' HA ' ' A' ' 61' ' ' CYS . 17.7 m -72.8 -28.89 28.14 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.569 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.661 -177.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.607 HD12 ' HB3' ' A' ' 75' ' ' ALA . 52.5 tp -58.93 -50.79 72.71 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.617 178.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -75.21 -36.38 61.39 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.899 -0.591 . . . . 0.0 112.331 -176.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.625 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.4 pt-20 -56.33 -47.65 78.32 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 120.455 -0.498 . . . . 0.0 110.59 -176.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.599 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.6 m -80.67 -34.97 14.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 C-N-CA 120.809 -0.357 . . . . 0.0 111.806 -179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 89.7 m -67.76 -28.61 67.77 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.855 0.36 . . . . 0.0 110.955 -177.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.58 -21.52 62.67 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.992 0.425 . . . . 0.0 110.682 176.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 67' ' ' GLU . 8.9 mt -87.22 -20.13 7.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.269 0.557 . . . . 0.0 109.753 178.07 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 115.49 -1.12 22.04 Favored Glycine 0 N--CA 1.446 -0.634 0 C-N-CA 120.015 -1.088 . . . . 0.0 112.494 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.518 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 63.1 m-85 -87.58 116.88 67.57 Favored Pre-proline 0 N--CA 1.448 -0.529 0 CA-C-O 120.596 0.236 . . . . 0.0 110.547 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.881 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 46.6 Cg_exo -63.08 129.08 24.63 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 123.193 2.595 . . . . 0.0 112.616 -179.62 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.607 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -138.34 162.4 34.47 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.079 -0.649 . . . . 0.0 111.796 178.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.77 154.36 38.35 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.317 168.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.669 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 9.4 p -129.62 111.64 12.9 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-O 121.759 0.79 . . . . 0.0 109.912 164.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 2.5 p -106.08 153.21 22.39 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.174 179.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.444 ' HB3' ' HD2' ' A' ' 41' ' ' ARG . 7.7 p -109.64 100.23 9.3 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.424 -0.51 . . . . 0.0 109.893 177.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 173.45 145.08 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.026 -1.101 . . . . 0.0 108.026 -177.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.686 ' HB3' HD22 ' A' ' 82' ' ' LEU . 70.8 m-20 -61.65 139.24 58.31 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 119.328 -0.949 . . . . 0.0 110.593 179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.686 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 62.82 17.81 10.21 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.582 171.738 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 14.7 p -79.58 -37.62 35.92 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.202 -0.599 . . . . 0.0 111.011 -175.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.553 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 20.4 p-10 -74.35 -3.78 32.4 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 121.149 0.499 . . . . 0.0 110.607 -177.279 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.611 ' HB2' ' CD1' ' A' ' 23' ' ' PHE . 1.3 ttp180 -66.63 -49.15 67.18 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.394 178.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.3 p -159.97 135.03 7.97 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.328 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -85.92 -4.72 59.23 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.271 0.558 . . . . 0.0 110.722 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.299 179.203 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 12.7 tpt . . . . . 0 N--CA 1.48 1.031 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 67.08 175.38 0.25 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.43 -176.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 30.2 tp -157.49 157.66 34.29 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.5 mtpp -118.08 109.58 16.6 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 119.556 -0.858 . . . . 0.0 111.273 178.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 38.7 m -128.81 163.27 25.57 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.674 -0.411 . . . . 0.0 110.679 175.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.474 ' HB3' ' HB3' ' A' ' 30' ' ' ARG . 98.8 m-85 -78.51 124.97 28.72 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.925 -177.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.468 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 48.2 m -125.14 125.44 43.72 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 172.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.576 ' HA ' ' HA ' ' A' ' 30' ' ' ARG . 39.9 ttp85 -90.8 110.8 22.01 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 119.924 -0.71 . . . . 0.0 110.821 -175.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -102.48 90.55 3.9 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.848 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 84.57 -86.71 1.54 Allowed Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 119.858 -1.163 . . . . 0.0 112.481 179.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -77.73 -83.21 0.08 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -175.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.533 ' C ' ' HG3' ' A' ' 25' ' ' ARG . 6.3 t70 -127.89 177.91 6.53 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.087 0.47 . . . . 0.0 111.295 -176.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.576 ' HA ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -81.48 120.27 24.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.965 -168.634 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 35.2 p -100.45 144.38 29.52 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.911 174.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 41.9 t -76.05 105.69 5.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 C-N-CA 120.258 -0.577 . . . . 0.0 109.938 178.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 25.5 p -97.44 149.67 21.89 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.207 -176.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.9 t -89.51 112.48 23.66 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 174.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.73 147.22 23.55 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.603 -174.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.88 176.99 8.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.234 -0.439 . . . . 0.0 112.072 -174.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -56.21 -39.55 72.65 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.539 -177.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.831 ' HG3' ' HG3' ' A' ' 39' ' ' GLN . 9.5 pt-20 -61.7 -34.06 75.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.929 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.831 ' HG3' ' HG3' ' A' ' 38' ' ' GLU . 29.2 mt-30 -95.5 59.31 2.13 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.421 -173.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.405 ' O ' ' HD2' ' A' ' 41' ' ' ARG . 0.2 OUTLIER -83.97 7.21 19.08 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.062 0.458 . . . . 0.0 111.484 -178.963 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 1.004 ' HD3' HG22 ' A' ' 58' ' ' VAL . 7.3 mpt_? -120.24 177.38 5.04 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 168.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.778 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 59.8 m -145.62 130.15 17.88 Favored 'General case' 0 C--N 1.31 -1.116 0 C-N-CA 119.741 -0.784 . . . . 0.0 110.284 -176.265 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.409 ' HA ' HD23 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -88.52 135.96 33.22 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.082 0.467 . . . . 0.0 110.933 -175.075 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.529 ' CE1' ' HA ' ' A' ' 86' ' ' SER . 20.1 t80 -139.71 109.23 6.21 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 114.979 -1.009 . . . . 0.0 108.673 170.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.585 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 27.8 t -115.04 123.79 71.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 173.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -94.32 116.28 28.64 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.436 0.636 . . . . 0.0 110.162 -178.074 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.616 ' HB2' ' O ' ' A' ' 50' ' ' SER . 2.3 mm? -111.15 156.37 41.12 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.59 -178.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -75.31 15.34 0.81 Allowed 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.01 2.473 . . . . 0.0 112.829 178.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -141.15 -45.98 0.38 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.539 0.685 . . . . 0.0 110.175 -177.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.616 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 54.2 m -146.45 -163.08 1.66 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 177.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.498 ' HA ' HD23 ' A' ' 47' ' ' LEU . 29.7 mt-10 -142.88 152.04 41.69 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 119.928 -0.709 . . . . 0.0 111.025 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.585 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 49.8 mt -103.28 102.63 13.92 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.583 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.019 176.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.468 ' O ' ' HA ' ' A' ' 24' ' ' THR . 54.0 mt-30 -124.75 130.61 52.74 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 119.799 -0.761 . . . . 0.0 109.878 178.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -168.7 167.75 11.1 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.91 -176.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 16.3 m -90.99 119.49 31.22 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.692 -0.803 . . . . 0.0 108.9 171.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -121.23 139.99 52.64 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 120.173 -0.611 . . . . 0.0 109.493 -174.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.59 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 30.5 p -64.3 147.24 52.92 Favored 'General case' 0 C--N 1.319 -0.728 0 C-N-CA 119.891 -0.723 . . . . 0.0 109.852 -178.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 1.004 HG22 ' HD3' ' A' ' 41' ' ' ARG . 25.0 t -51.65 -50.02 32.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 O-C-N 123.439 0.462 . . . . 0.0 112.145 -171.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.6 ' HG3' ' HG2' ' A' ' 60' ' ' GLN . 17.6 pt20 -63.03 -48.44 78.74 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-O 120.874 0.369 . . . . 0.0 111.872 -176.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.624 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 0.4 OUTLIER -69.5 -38.49 77.63 Favored 'General case' 0 C--O 1.212 -0.919 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 -176.696 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.633 ' HA ' HG22 ' A' ' 64' ' ' VAL . 0.8 OUTLIER -60.96 -33.15 72.75 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.404 -178.728 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.63 -47.46 75.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.972 0.415 . . . . 0.0 110.454 177.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.624 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 8.2 pt-20 -72.16 -36.85 69.41 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.032 -176.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.633 HG22 ' HA ' ' A' ' 61' ' ' CYS . 14.4 m -74.41 -27.21 21.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 CA-C-O 121.524 0.678 . . . . 0.0 110.553 177.012 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 58.3 tp -59.08 -49.42 77.94 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 174.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.561 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 44.0 mt-10 -74.1 -32.04 63.05 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.556 -175.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.629 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.5 pt-20 -61.4 -44.96 96.24 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 120.159 -0.617 . . . . 0.0 109.929 -179.463 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.557 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 33.6 m -80.21 -32.47 13.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.561 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 27.7 p -73.77 -25.29 60.07 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 120.201 -0.6 . . . . 0.0 111.203 -178.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.07 -21.45 63.15 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.061 0.458 . . . . 0.0 110.275 175.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.423 HG13 ' O ' ' A' ' 67' ' ' GLU . 16.4 mt -82.47 -18.43 10.89 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.515 176.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 105.48 9.06 34.17 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.276 -0.964 . . . . 0.0 112.197 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -89.76 122.52 67.96 Favored Pre-proline 0 N--CA 1.448 -0.561 0 CA-C-O 120.974 0.416 . . . . 0.0 111.749 -178.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_exo -51.95 124.93 15.77 Favored 'Trans proline' 0 N--CA 1.471 0.174 0 C-N-CA 123.929 3.086 . . . . 0.0 112.566 174.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.517 ' HA ' ' O ' ' A' ' 44' ' ' PHE . . . -151.93 157.85 42.36 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 119.955 -0.698 . . . . 0.0 112.09 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -155.5 147.07 22.98 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.956 172.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.778 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 27.6 p -130.84 94.51 3.63 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.536 0.684 . . . . 0.0 109.513 165.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 6.0 p -106.98 166.92 10.25 Favored 'General case' 0 C--N 1.316 -0.875 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.932 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 9.2 p -109.26 105.33 14.7 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.932 0.396 . . . . 0.0 110.991 -175.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.585 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 4.3 tt0 175.25 147.36 0.08 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 -176.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.702 ' HB3' HD22 ' A' ' 82' ' ' LEU . 16.5 m-20 -61.84 135.71 57.69 Favored 'General case' 0 CA--C 1.504 -0.825 0 C-N-CA 118.979 -1.088 . . . . 0.0 109.312 175.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.702 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 63.6 19.42 11.7 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.238 175.427 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . 0.585 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.2 t -73.57 -31.58 63.68 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.666 -176.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.416 ' HB3' ' CB ' ' A' ' 42' ' ' CYS . 22.0 p-10 -84.07 25.46 0.83 Allowed 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.164 -0.615 . . . . 0.0 110.012 178.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.577 ' HB3' ' O ' ' A' ' 82' ' ' LEU . 0.0 OUTLIER -59.7 160.65 7.08 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.436 -178.806 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.529 ' HA ' ' CE1' ' A' ' 44' ' ' PHE . 40.6 t -83.0 134.49 35.05 Favored 'General case' 0 C--N 1.32 -0.702 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.299 -178.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -80.38 -6.02 57.37 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.255 174.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.577 -179.272 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.483 1.2 0 N-CA-C 110.391 -0.226 . . . . 0.0 110.391 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.416 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . . . -81.64 156.84 24.91 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.579 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 30.2 tp -135.86 165.15 26.3 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt -111.26 98.67 7.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.099 0.476 . . . . 0.0 111.205 178.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.441 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 18.0 m -108.02 153.44 23.1 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 175.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 38.0 m-85 -71.87 134.98 46.4 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 120.089 -0.645 . . . . 0.0 110.287 175.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 33.5 p -115.45 118.32 32.85 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 172.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.711 ' CZ ' ' HA ' ' A' ' 28' ' ' ASP . 32.5 ttt85 -91.23 111.39 22.85 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 119.843 -0.743 . . . . 0.0 111.071 -178.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -105.41 104.02 13.66 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 174.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 77.53 -78.38 1.48 Allowed Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 119.938 -1.125 . . . . 0.0 111.165 -175.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.711 ' HA ' ' CZ ' ' A' ' 25' ' ' ARG . 24.4 t70 -140.83 -34.85 0.5 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 176.41 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.524 ' O ' ' HA ' ' A' ' 25' ' ' ARG . 26.3 t70 -58.8 145.46 40.61 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.349 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.443 HH11 ' HD3' ' A' ' 30' ' ' ARG . 9.4 ptp180 -119.45 112.69 19.7 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.135 177.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -103.83 136.37 43.64 Favored 'General case' 0 C--N 1.315 -0.903 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.478 -172.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 40.2 t -75.47 106.63 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 169.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 40.2 p -121.25 131.75 54.4 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 119.841 -0.743 . . . . 0.0 110.938 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.415 HG22 ' H ' ' A' ' 34' ' ' THR . 1.5 t -72.84 116.57 13.5 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 169.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.83 177.9 7.15 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 -174.48 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.523 ' HB3' ' OE1' ' A' ' 38' ' ' GLU . . . -66.36 161.09 23.27 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 119.267 -0.973 . . . . 0.0 109.257 178.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.416 ' HA ' ' HA ' ' A' ' 19' ' ' ALA . 2.3 pt-20 -80.44 -6.81 58.68 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -165.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.523 ' OE1' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -80.19 -30.42 38.76 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.096 -0.642 . . . . 0.0 110.118 173.089 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.65 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 30.3 mt-30 -80.46 97.25 7.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.119 179.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -105.26 11.31 33.09 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.411 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.839 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 18.0 mmt85 -129.33 179.37 5.82 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.437 0.637 . . . . 0.0 110.676 175.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.63 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 82.9 m -136.48 132.88 35.93 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.607 -1.179 . . . . 0.0 109.738 -171.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.401 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.3 OUTLIER -104.14 125.68 50.64 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.007 -172.185 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.828 ' HD2' ' HD3' ' A' ' 76' ' ' LYS . 49.7 t80 -141.15 124.88 16.91 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.947 -0.569 . . . . 0.0 109.572 172.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.513 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 41.4 t -121.54 140.53 45.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.366 -178.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.743 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 10.0 mm100 -72.72 134.07 44.86 Favored 'General case' 0 N--CA 1.465 0.307 0 O-C-N 123.095 0.247 . . . . 0.0 110.875 178.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.503 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.2 mm? -129.95 143.93 51.03 Favored Pre-proline 0 C--N 1.326 -0.437 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 174.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 7.2 Cg_exo -75.19 28.54 0.37 Allowed 'Trans proline' 0 CA--C 1.532 0.398 0 C-N-CA 123.294 2.663 . . . . 0.0 113.226 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -172.13 -26.02 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.04 0.448 . . . . 0.0 111.088 -176.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.503 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 70.2 m -149.7 -153.31 0.48 Allowed 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 178.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.512 ' O ' ' HD3' ' A' ' 25' ' ' ARG . 10.2 pt-20 -149.11 151.96 35.31 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.703 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 68.1 mt -101.93 131.09 50.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.049 175.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.401 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 39.1 mt-30 -138.87 130.73 27.78 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.737 ' HG2' ' HE2' ' A' ' 56' ' ' LYS . 2.9 tp10 -168.58 157.24 8.54 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 123.396 0.435 . . . . 0.0 109.863 -168.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 60.6 m -94.84 139.25 31.55 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 173.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.737 ' HE2' ' HG2' ' A' ' 54' ' ' GLU . 18.6 mmtt -147.0 149.41 33.09 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 176.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.65 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 68.3 p -66.48 153.16 43.6 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 175.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.687 HG22 ' HG2' ' A' ' 41' ' ' ARG . 19.9 t -48.67 -49.49 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 120.863 0.363 . . . . 0.0 110.63 -175.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -64.09 -57.08 10.65 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.766 -178.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.706 ' O ' HG13 ' A' ' 64' ' ' VAL . 96.2 mt-30 -63.75 -28.96 70.24 Favored 'General case' 0 C--O 1.205 -1.259 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.191 -175.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.674 ' HA ' HG22 ' A' ' 64' ' ' VAL . 5.4 t -71.36 -33.02 69.19 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.59 -35.95 70.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.079 0.466 . . . . 0.0 109.951 173.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.404 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 48.7 mt-10 -62.38 -52.28 64.22 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.573 175.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.706 HG13 ' O ' ' A' ' 60' ' ' GLN . 15.2 m -69.47 -26.65 31.69 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.615 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.417 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.576 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -58.08 -49.03 78.34 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 174.077 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -73.19 -33.87 65.65 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.009 -174.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.659 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.0 pt-20 -59.92 -42.7 94.49 Favored 'General case' 0 N--CA 1.446 -0.649 0 C-N-CA 119.826 -0.749 . . . . 0.0 110.132 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.503 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.2 m -80.01 -36.16 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 179.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 99.1 m -74.52 -29.19 61.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.34 -174.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.64 -21.95 64.44 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.561 174.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 67' ' ' GLU . 14.8 mt -79.14 -25.49 12.9 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-O 121.283 0.563 . . . . 0.0 109.91 177.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.437 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 113.88 11.39 12.69 Favored Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 119.811 -1.185 . . . . 0.0 111.972 -176.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -102.26 105.1 41.18 Favored Pre-proline 0 N--CA 1.451 -0.401 0 CA-C-O 120.658 0.266 . . . . 0.0 111.014 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.743 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 87.4 Cg_exo -52.18 128.56 27.7 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 123.377 2.718 . . . . 0.0 113.001 177.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.576 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -136.29 161.88 34.54 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 120.018 -0.673 . . . . 0.0 111.193 176.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.828 ' HD3' ' HD2' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -138.27 152.51 48.62 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.24 177.277 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.839 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 9.3 t -145.71 89.78 1.94 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.998 174.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 7.2 p -107.55 162.95 13.49 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.186 -0.606 . . . . 0.0 110.942 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.482 ' HB2' ' HD3' ' A' ' 41' ' ' ARG . 45.4 t -109.15 107.94 18.41 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.421 -174.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.486 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 9.7 tp10 171.26 150.79 0.05 OUTLIER 'General case' 0 C--O 1.237 0.444 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -178.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.65 ' HB3' HD22 ' A' ' 82' ' ' LEU . 96.4 m-20 -59.66 138.64 57.68 Favored 'General case' 0 CA--C 1.51 -0.564 0 C-N-CA 119.24 -0.984 . . . . 0.0 109.674 175.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.65 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.58 13.72 8.46 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.963 172.556 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . 0.486 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 7.8 t -71.86 -30.39 65.38 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 120.861 -0.336 . . . . 0.0 111.33 -173.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.565 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 28.2 p-10 -82.82 40.61 0.69 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.52 0.676 . . . . 0.0 110.362 179.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.492 ' HG2' ' N ' ' A' ' 86' ' ' SER . 35.3 ttp180 -72.61 162.97 28.79 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.274 -0.876 . . . . 0.0 109.844 178.269 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.503 ' HA ' ' CE1' ' A' ' 44' ' ' PHE . 5.7 p -60.5 148.59 37.19 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.272 173.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.439 ' OE2' ' HG2' ' A' ' 88' ' ' GLN . 0.0 OUTLIER -56.68 -37.09 70.38 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.36 -178.244 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.439 ' HG2' ' OE2' ' A' ' 87' ' ' GLU . 24.9 pt20 . . . . . 0 C--N 1.328 -0.333 0 CA-C-O 121.2 0.524 . . . . 0.0 111.036 176.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 13.8 tpt . . . . . 0 N--CA 1.481 1.083 0 CA-C-O 120.84 0.352 . . . . 0.0 110.069 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.418 ' HA ' ' O ' ' A' ' 35' ' ' CYS . . . 57.05 87.28 0.06 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.981 -176.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.451 HD23 HG22 ' A' ' 40' ' ' THR . 3.3 mm? -64.5 152.29 42.17 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.135 178.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.442 ' HB3' ' CG1' ' A' ' 32' ' ' VAL . 19.0 mtpp -120.95 116.39 25.02 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 119.605 -0.838 . . . . 0.0 111.075 177.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 34.3 m -140.13 170.09 16.48 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.577 176.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 95.4 m-85 -76.84 132.2 39.05 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.825 -176.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 28.3 m -130.07 158.29 40.03 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 175.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.592 ' NH2' ' HA ' ' A' ' 28' ' ' ASP . 15.1 mmm180 -82.06 110.26 17.13 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.94 -179.052 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -117.21 103.97 10.71 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 176.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 69.75 -102.51 0.98 Allowed Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 119.77 -1.205 . . . . 0.0 110.52 -171.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.592 ' HA ' ' NH2' ' A' ' 25' ' ' ARG . 35.7 t70 -129.1 -4.07 5.03 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.611 0.719 . . . . 0.0 109.787 172.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -85.25 153.03 22.88 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.379 -179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 45.1 mtt180 -96.11 110.53 22.77 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.5 m -113.49 131.44 56.04 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.098 -170.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.442 ' CG1' ' HB3' ' A' ' 21' ' ' LYS . 98.7 t -73.04 105.38 2.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 174.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.5 p -94.82 149.88 20.78 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.622 0.725 . . . . 0.0 111.479 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -72.56 127.16 31.71 Favored 'General case' 0 N--CA 1.432 -1.358 0 N-CA-C 107.586 -1.264 . . . . 0.0 107.586 161.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.418 ' O ' ' HA ' ' A' ' 19' ' ' ALA . 0.8 OUTLIER -110.04 153.25 24.89 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 119.804 -0.758 . . . . 0.0 109.622 -179.252 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -64.82 164.99 11.33 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -172.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -58.21 -34.24 70.17 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.451 -178.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.641 ' HG3' ' HG3' ' A' ' 39' ' ' GLN . 4.1 pt-20 -60.91 -38.57 86.19 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.42 0.629 . . . . 0.0 110.491 175.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.641 ' HG3' ' HG3' ' A' ' 38' ' ' GLU . 75.4 mt-30 -88.16 74.89 8.72 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.53 -174.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.451 HG22 HD23 ' A' ' 20' ' ' LEU . 0.9 OUTLIER -95.56 16.51 16.94 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.568 0.699 . . . . 0.0 110.33 177.734 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.877 ' HD3' HG22 ' A' ' 58' ' ' VAL . 0.6 OUTLIER -128.35 177.6 6.85 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.471 173.502 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.778 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.9 m -142.3 131.04 22.76 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.095 -178.225 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.498 HD22 HG23 ' A' ' 45' ' ' VAL . 0.2 OUTLIER -95.37 136.73 35.37 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.005 0.431 . . . . 0.0 110.722 -177.231 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.645 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 1.6 t80 -145.16 109.42 4.87 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.196 -0.911 . . . . 0.0 108.781 171.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.549 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 46.0 t -110.09 133.76 54.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.058 -0.519 . . . . 0.0 109.839 179.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.817 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 9.4 mm100 -77.81 140.82 39.45 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.877 0.37 . . . . 0.0 110.431 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.2 mm? -128.23 152.17 77.43 Favored Pre-proline 0 C--N 1.319 -0.759 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 173.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -70.87 -11.18 29.03 Favored 'Trans proline' 0 CA--C 1.529 0.258 0 C-N-CA 122.391 2.061 . . . . 0.0 112.622 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -135.86 -0.56 2.55 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.52 0.2 . . . . 0.0 111.434 -177.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.598 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 32.6 p -169.57 -163.92 0.41 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -175.154 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -148.5 152.45 36.9 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 177.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.645 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 74.7 mt -105.61 130.4 57.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.368 176.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -139.28 131.32 27.93 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.295 -0.632 . . . . 0.0 109.295 177.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -167.71 162.07 13.75 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 123.376 0.423 . . . . 0.0 110.706 -178.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 13.3 m -89.12 134.07 34.15 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.128 -0.629 . . . . 0.0 109.465 172.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.4 tppt? -138.46 153.05 48.81 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 -176.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.568 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 10.9 p -73.62 152.12 40.63 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 119.468 -0.893 . . . . 0.0 109.154 178.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.877 HG22 ' HD3' ' A' ' 41' ' ' ARG . 50.7 t -59.19 -41.54 84.12 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 CA-C-O 120.653 0.263 . . . . 0.0 111.517 -175.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.611 ' HG3' ' N ' ' A' ' 60' ' ' GLN . 12.3 pt20 -69.05 -48.0 63.92 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.663 -177.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.627 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -69.33 -37.49 77.73 Favored 'General case' 0 C--O 1.211 -0.94 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -176.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.672 ' SG ' ' HG2' ' A' ' 41' ' ' ARG . 1.9 p -61.65 -32.7 72.88 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.485 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.9 -47.19 75.61 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.917 0.389 . . . . 0.0 110.567 177.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.627 ' HG2' ' O ' ' A' ' 60' ' ' GLN . 8.9 pt-20 -71.55 -37.76 71.07 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.9 -176.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.653 HG22 ' HA ' ' A' ' 61' ' ' CYS . 12.1 m -73.59 -26.52 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 121.566 0.698 . . . . 0.0 110.479 176.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.579 HD12 ' HB3' ' A' ' 75' ' ' ALA . 50.4 tp -58.33 -49.75 76.07 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.543 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 41.7 mt-10 -74.33 -33.1 63.06 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.879 -0.6 . . . . 0.0 112.432 -175.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.623 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.4 pt-20 -60.31 -45.85 91.95 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 120.254 -0.578 . . . . 0.0 110.139 -179.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.586 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 35.0 m -79.9 -32.62 14.18 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 C-N-CA 120.743 -0.383 . . . . 0.0 111.944 -178.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.543 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 21.3 p -71.27 -26.23 62.8 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 120.394 -0.522 . . . . 0.0 110.875 -178.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.64 -22.76 61.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.488 175.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 67' ' ' GLU . 19.0 mt -83.6 -25.68 7.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.767 177.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 121.39 -0.61 11.39 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 119.858 -1.163 . . . . 0.0 112.508 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.407 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 90.6 m-85 -85.93 115.27 61.1 Favored Pre-proline 0 N--CA 1.451 -0.385 0 CA-C-N 116.519 0.159 . . . . 0.0 110.863 -179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.817 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 33.6 Cg_exo -63.65 133.16 38.21 Favored 'Trans proline' 0 C--N 1.343 0.281 0 C-N-CA 122.768 2.312 . . . . 0.0 111.402 174.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.579 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -146.89 163.32 36.48 Favored 'General case' 0 C--N 1.318 -0.795 0 C-N-CA 120.343 -0.543 . . . . 0.0 111.59 -179.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.472 ' CG ' ' HB3' ' A' ' 44' ' ' PHE . 15.5 ptpt -143.99 150.11 37.77 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.638 174.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.778 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 27.7 p -139.92 98.21 3.41 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 121.79 0.805 . . . . 0.0 109.182 161.046 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.2 p -107.61 164.41 12.25 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.782 -178.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 7.5 p -107.93 100.77 10.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.349 0.595 . . . . 0.0 109.517 -178.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.534 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 24.8 tt0 175.13 137.64 0.04 OUTLIER 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 -172.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.653 ' CB ' HD22 ' A' ' 82' ' ' LEU . 16.5 m-20 -62.06 139.02 58.46 Favored 'General case' 0 CA--C 1.505 -0.758 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.952 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.653 HD22 ' CB ' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.65 13.99 8.71 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.862 174.362 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . 0.534 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 47.4 t -71.43 -19.85 62.19 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.823 0.344 . . . . 0.0 111.59 -174.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.475 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 22.8 p-10 -86.15 19.56 2.63 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.596 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.653 ' H ' ' HD3' ' A' ' 85' ' ' ARG . 0.0 OUTLIER -67.01 163.13 20.55 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.093 175.583 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.463 ' HA ' ' CE2' ' A' ' 44' ' ' PHE . 22.7 t -71.5 139.13 49.43 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.129 -0.629 . . . . 0.0 109.313 175.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -88.65 11.28 17.89 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.217 0.532 . . . . 0.0 110.29 -177.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.219 178.746 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 14.5 tpt . . . . . 0 N--CA 1.481 1.111 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -152.67 176.84 11.32 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 178.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.6 tp -141.35 130.52 23.44 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 176.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.5 mttt -82.22 141.27 33.13 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.277 -0.569 . . . . 0.0 109.972 178.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.567 ' HB3' ' SG ' ' A' ' 55' ' ' CYS . 6.6 t -161.66 153.89 19.7 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.602 -0.439 . . . . 0.0 109.851 -178.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -81.5 128.64 34.11 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.741 -0.383 . . . . 0.0 111.208 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 42.8 m -111.0 134.46 52.58 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 174.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.561 ' HD2' ' HB3' ' A' ' 30' ' ' ARG . 22.9 mmm-85 -85.08 111.53 19.84 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.827 -177.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -92.65 83.36 4.86 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 170.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 64.09 -107.52 1.83 Allowed Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 119.483 -1.341 . . . . 0.0 111.268 -170.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -89.73 -29.96 18.36 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.637 0.256 . . . . 0.0 110.538 177.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -69.86 150.27 46.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.907 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.561 ' HB3' ' HD2' ' A' ' 25' ' ' ARG . 2.2 ptt180 -127.74 113.09 15.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.125 169.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 94.2 m -99.12 138.4 36.27 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.827 -178.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 66.0 t -72.12 106.74 2.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 172.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.0 p -118.75 148.11 43.15 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.886 0.374 . . . . 0.0 111.266 -178.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.6 t -88.0 119.99 28.91 Favored 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 175.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -97.73 147.05 24.75 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 -177.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.82 166.57 19.09 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -172.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -55.75 -36.54 67.39 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.51 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.495 ' HG3' ' H ' ' A' ' 39' ' ' GLN . 2.9 pt-20 -50.57 -48.31 57.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.741 175.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.691 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 36.6 mt-30 -101.1 78.54 1.92 Allowed 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.141 -176.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -92.67 12.62 22.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.713 -175.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 1.011 ' HD3' ' SG ' ' A' ' 79' ' ' CYS . 0.0 OUTLIER -121.51 177.94 5.01 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.377 0.608 . . . . 0.0 110.142 173.908 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.586 ' HB3' ' HB3' ' A' ' 84' ' ' ASN . 66.7 m -129.22 172.83 11.07 Favored 'General case' 0 C--N 1.311 -1.065 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.123 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.57 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.4 OUTLIER -127.98 113.34 15.71 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.533 176.508 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.665 ' HD2' ' HD2' ' A' ' 76' ' ' LYS . 2.6 t80 -124.8 99.52 6.19 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 172.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.608 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 19.2 t -104.34 133.0 49.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-N 115.054 -0.976 . . . . 0.0 108.741 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.822 ' CG ' ' HB2' ' A' ' 74' ' ' PRO . 0.8 OUTLIER -83.42 141.04 32.0 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 120.006 -0.677 . . . . 0.0 110.001 179.592 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.777 HD21 HG12 ' A' ' 52' ' ' ILE . 3.7 mm? -133.62 152.02 78.24 Favored Pre-proline 0 C--N 1.317 -0.817 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.29 179.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -78.57 3.22 7.43 Favored 'Trans proline' 0 N--CA 1.461 -0.44 0 C-N-CA 122.755 2.303 . . . . 0.0 111.583 171.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -124.25 -31.99 3.25 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.875 -176.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.683 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 11.4 p -169.36 -154.95 0.13 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.636 -173.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -140.79 131.83 26.23 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.409 176.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.777 HG12 HD21 ' A' ' 47' ' ' LEU . 26.5 mm -82.54 129.12 37.99 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.413 0 C-N-CA 120.375 -0.53 . . . . 0.0 110.204 176.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.629 ' HB3' ' ND2' ' A' ' 84' ' ' ASN . 6.5 mt-30 -135.84 131.85 35.87 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 179.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -167.25 150.21 6.26 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 123.529 0.518 . . . . 0.0 109.781 -170.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.567 ' SG ' ' HB3' ' A' ' 22' ' ' CYS . 6.4 m -93.01 132.39 37.15 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 172.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.453 ' HD3' ' HA ' ' A' ' 56' ' ' LYS . 3.3 tppt? -138.94 156.22 47.43 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 119.027 -1.069 . . . . 0.0 110.686 -178.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.691 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 35.4 p -66.28 153.41 42.67 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 177.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.622 ' HA ' ' HG3' ' A' ' 41' ' ' ARG . 20.9 t -59.29 -47.58 89.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 120.997 0.427 . . . . 0.0 110.663 -175.068 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -56.94 -55.72 30.9 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.054 179.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.59 ' O ' HG13 ' A' ' 64' ' ' VAL . 20.6 mt-30 -68.66 -25.56 64.87 Favored 'General case' 0 C--O 1.2 -1.552 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.605 -174.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.596 ' HA ' HG22 ' A' ' 64' ' ' VAL . 0.6 OUTLIER -63.35 -33.88 76.51 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.115 -0.634 . . . . 0.0 109.891 178.519 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.56 -39.62 73.84 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.091 0.472 . . . . 0.0 110.225 174.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -62.46 -52.42 63.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.834 178.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.633 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 16.2 m -68.71 -28.15 38.83 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.397 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 28.8 tp -58.02 -49.74 75.82 Favored 'General case' 0 N--CA 1.445 -0.718 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 176.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.58 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 39.7 tt0 -73.88 -36.03 64.76 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.363 -175.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.633 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -58.24 -43.68 87.91 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 120.453 -0.499 . . . . 0.0 110.276 -177.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.544 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.0 m -79.7 -31.73 14.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 C-N-CA 120.48 -0.488 . . . . 0.0 111.714 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.58 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 37.7 p -72.98 -21.29 60.88 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.995 -179.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.09 -19.99 59.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.088 0.47 . . . . 0.0 110.27 176.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 10.7 mt -86.24 -15.92 9.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.334 176.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 108.9 -0.31 31.85 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.366 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -90.72 116.56 66.67 Favored Pre-proline 0 N--CA 1.448 -0.525 0 CA-C-O 120.692 0.282 . . . . 0.0 111.221 -178.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.822 ' HB2' ' CG ' ' A' ' 46' ' ' GLN . 52.8 Cg_exo -58.24 140.66 95.13 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 123.169 2.579 . . . . 0.0 112.124 175.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.464 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -148.79 168.62 22.46 Favored 'General case' 0 C--N 1.321 -0.645 0 C-N-CA 120.318 -0.553 . . . . 0.0 111.614 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.665 ' HD2' ' HD2' ' A' ' 44' ' ' PHE . 6.0 ptpp? -154.34 139.08 17.05 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.749 171.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 31.0 p -116.81 104.86 11.75 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 166.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.2 p -106.72 162.27 13.92 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 119.929 -0.708 . . . . 0.0 112.089 -178.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 1.011 ' SG ' ' HD3' ' A' ' 41' ' ' ARG . 33.6 m -109.24 101.57 10.58 Favored 'General case' 0 CA--C 1.523 -0.076 0 CA-C-N 116.135 -0.484 . . . . 0.0 109.909 175.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.588 ' HB3' ' HB3' ' A' ' 83' ' ' CYS . 16.0 tt0 176.85 141.46 0.07 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 -177.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.748 ' HB3' HD22 ' A' ' 82' ' ' LEU . 15.9 m-20 -58.64 129.55 42.62 Favored 'General case' 0 CA--C 1.503 -0.828 0 C-N-CA 119.641 -0.824 . . . . 0.0 110.095 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.748 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.3 OUTLIER 64.77 15.81 10.03 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.927 173.278 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . 0.588 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . 9.9 p -63.24 -22.33 66.8 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.896 0.379 . . . . 0.0 111.701 -171.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.629 ' ND2' ' HB3' ' A' ' 53' ' ' GLN . 35.9 p-10 -76.72 16.23 0.54 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.039 0.447 . . . . 0.0 111.116 -177.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.409 ' H ' ' C ' ' A' ' 83' ' ' CYS . 7.9 ptt180 -82.89 -34.4 26.7 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.085 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 52.2 m -154.42 -175.79 5.57 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.375 -174.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.413 ' HA ' ' HE2' ' A' ' 76' ' ' LYS . 41.5 mm-40 -63.83 -31.11 72.19 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.587 -177.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 17.8 mm100 . . . . . 0 N--CA 1.464 0.244 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.217 179.172 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 15.0 tpt . . . . . 0 N--CA 1.482 1.149 0 CA-C-O 120.331 0.11 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -76.28 146.0 39.25 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.117 -0.633 . . . . 0.0 110.161 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.428 ' HG ' ' N ' ' A' ' 21' ' ' LYS . 32.1 tp -139.95 170.05 16.57 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 -178.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.428 ' N ' ' HG ' ' A' ' 20' ' ' LEU . 11.5 mtpt -125.89 114.15 18.16 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.04 177.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.599 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 12.9 m -128.43 158.5 38.15 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 174.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.43 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 15.6 m-85 -72.41 120.76 18.46 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 120.659 -0.416 . . . . 0.0 109.971 173.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 88.2 m -111.15 142.75 42.92 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 176.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.475 ' HA ' ' O ' ' A' ' 29' ' ' ASP . 8.8 mmm180 -84.52 110.58 18.79 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.883 -177.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -96.82 85.65 3.85 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 174.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 73.37 -105.71 1.83 Allowed Glycine 0 N--CA 1.447 -0.629 0 C-N-CA 119.659 -1.257 . . . . 0.0 111.066 -172.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -102.09 -10.67 19.47 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.905 0.383 . . . . 0.0 110.149 177.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.475 ' O ' ' HA ' ' A' ' 25' ' ' ARG . 2.3 t70 -82.8 148.09 27.99 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.802 -0.636 . . . . 0.0 112.192 -178.081 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.1 ptt180 -127.78 113.64 16.23 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.279 -0.569 . . . . 0.0 110.003 166.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.444 HG23 ' OD1' ' A' ' 29' ' ' ASP . 1.2 p -129.48 169.33 15.09 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.565 -178.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 53.8 t -72.11 121.24 22.01 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.243 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.408 176.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 35.2 p -123.14 132.59 54.13 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 119.994 -0.683 . . . . 0.0 110.674 174.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.3 t -76.42 113.97 14.6 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 170.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.76 170.23 11.4 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.878 -170.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.413 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -66.81 166.35 13.43 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.502 -179.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.06 -19.94 56.46 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.723 -166.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.42 ' HG2' HG22 ' A' ' 57' ' ' THR . 3.2 pm0 -81.96 -22.85 36.42 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.284 0.564 . . . . 0.0 109.611 176.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.455 ' OE1' ' HB2' ' A' ' 55' ' ' CYS . 8.3 mt-30 -72.89 121.55 20.2 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.193 176.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.541 ' OG1' HG23 ' A' ' 58' ' ' VAL . 0.5 OUTLIER -134.51 4.83 3.41 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.327 -0.852 . . . . 0.0 111.597 -170.39 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.763 ' CG ' ' HA ' ' A' ' 58' ' ' VAL . 6.1 mmm180 -138.49 178.48 7.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.633 0.73 . . . . 0.0 110.09 175.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.545 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 8.8 m -132.36 131.5 41.94 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 114.437 -1.256 . . . . 0.0 109.044 -179.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.495 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.2 OUTLIER -91.75 130.44 37.54 Favored 'General case' 0 C--N 1.32 -0.689 0 C-N-CA 121.031 -0.267 . . . . 0.0 110.306 179.504 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.798 ' HD2' ' HG3' ' A' ' 76' ' ' LYS . 57.1 t80 -128.45 100.9 5.96 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.28 170.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.613 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 16.8 t -99.44 129.95 49.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 174.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.896 ' HB3' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -99.04 116.77 32.04 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.197 -178.541 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.67 HD21 HG12 ' A' ' 52' ' ' ILE . 1.8 mm? -114.94 156.93 44.5 Favored Pre-proline 0 C--N 1.327 -0.38 0 N-CA-C 109.427 -0.582 . . . . 0.0 109.427 -176.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -75.49 18.98 0.55 Allowed 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 122.877 2.385 . . . . 0.0 112.391 175.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -136.55 -55.75 0.74 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.517 0.675 . . . . 0.0 109.44 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.607 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 41.5 p -148.26 -162.58 1.58 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.968 -1.015 . . . . 0.0 108.283 176.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.539 ' HA ' HD23 ' A' ' 47' ' ' LEU . 2.3 mp0 -131.14 147.32 52.59 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 118.434 -1.306 . . . . 0.0 110.9 177.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.67 HG12 HD21 ' A' ' 47' ' ' LEU . 52.0 mm -93.77 132.11 38.83 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.544 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.909 176.014 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.495 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 14.9 mt-30 -141.67 130.88 23.45 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 120.04 -0.664 . . . . 0.0 109.406 -179.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.434 ' HB2' ' HZ2' ' A' ' 56' ' ' LYS . 2.6 pt-20 -163.03 153.87 16.8 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.245 -176.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.737 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 79.1 m -82.04 125.22 30.56 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.294 169.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.737 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 11.3 mptt -132.71 -179.17 5.3 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 173.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.516 ' HA ' ' H ' ' A' ' 40' ' ' THR . 16.1 p -86.06 169.05 13.52 Favored 'General case' 0 C--N 1.312 -1.055 0 C-N-CA 119.274 -0.971 . . . . 0.0 108.744 177.402 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.763 ' HA ' ' CG ' ' A' ' 41' ' ' ARG . 66.8 t -61.16 -50.25 81.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 C-N-CA 119.583 -0.847 . . . . 0.0 110.102 178.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -56.53 -54.37 46.61 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.863 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.589 ' O ' HG22 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -58.91 -34.91 72.24 Favored 'General case' 0 C--O 1.204 -1.326 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.964 -177.637 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.563 ' HA ' HG22 ' A' ' 64' ' ' VAL . 0.5 OUTLIER -68.22 -34.21 75.82 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 120.511 -0.476 . . . . 0.0 111.055 -175.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.71 -35.8 67.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.347 0.594 . . . . 0.0 109.611 176.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.559 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 74.8 mt-10 -65.91 -52.02 53.64 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.814 -1.084 . . . . 0.0 110.943 178.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.624 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 33.4 m -68.44 -28.7 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.54 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.277 178.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.459 HD12 ' HB3' ' A' ' 75' ' ' ALA . 46.5 tp -58.03 -50.9 71.83 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 176.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.591 ' HA ' ' HG1' ' A' ' 69' ' ' THR . 40.8 tt0 -74.2 -33.88 63.55 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.171 -0.468 . . . . 0.0 112.183 -174.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.624 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -60.19 -44.61 94.95 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 120.476 -0.49 . . . . 0.0 110.313 -177.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.541 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 28.4 m -80.37 -28.42 11.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.938 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.591 ' HG1' ' HA ' ' A' ' 66' ' ' GLU . 31.0 p -75.48 -22.47 57.19 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 119.971 -0.692 . . . . 0.0 110.842 179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.15 -18.43 61.88 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 121.184 0.516 . . . . 0.0 110.285 176.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 19.2 mt -86.37 -18.34 8.75 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.504 177.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 107.67 3.76 34.61 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.182 -1.008 . . . . 0.0 112.498 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 55.9 m-85 -90.24 134.11 32.02 Favored Pre-proline 0 N--CA 1.447 -0.603 0 CA-C-O 120.808 0.337 . . . . 0.0 111.478 -178.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.896 ' HB2' ' HB3' ' A' ' 46' ' ' GLN . 79.7 Cg_exo -56.17 130.79 42.06 Favored 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 123.598 2.865 . . . . 0.0 112.054 173.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.52 ' C ' ' HG2' ' A' ' 76' ' ' LYS . . . -149.16 156.63 42.46 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 119.711 -0.796 . . . . 0.0 111.861 179.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.798 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -153.85 155.52 35.91 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.243 174.943 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 26.9 p -137.46 115.72 11.79 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.627 0.727 . . . . 0.0 109.901 166.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.1 p -108.17 172.48 6.81 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.891 -176.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.435 ' HB2' ' CD ' ' A' ' 41' ' ' ARG . 52.9 t -131.14 100.97 5.39 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.821 -0.352 . . . . 0.0 110.13 178.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.599 ' HB3' ' HB3' ' A' ' 83' ' ' CYS . 14.1 tt0 174.81 148.73 0.08 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.598 -1.26 . . . . 0.0 107.598 -175.469 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.647 ' HB3' HD22 ' A' ' 82' ' ' LEU . 1.0 OUTLIER -55.93 124.02 16.27 Favored 'General case' 0 CA--C 1.509 -0.598 0 C-N-CA 119.805 -0.758 . . . . 0.0 110.365 179.079 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.647 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.1 OUTLIER 66.02 16.06 10.31 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.752 169.713 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . 0.599 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . 21.3 p -64.53 -29.57 70.6 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -171.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.454 ' ND2' ' HB3' ' A' ' 53' ' ' GLN . 29.5 p-10 -76.11 18.01 0.31 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.17 0.51 . . . . 0.0 110.773 -178.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.431 ' H ' ' C ' ' A' ' 83' ' ' CYS . 7.3 ptp85 -63.8 -29.89 71.05 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.164 171.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 45.3 m -156.75 -160.23 0.95 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.631 -1.168 . . . . 0.0 108.459 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.5 ' HG2' ' HD2' ' A' ' 76' ' ' LYS . 32.8 mt-10 -66.37 -52.94 41.73 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.216 -0.594 . . . . 0.0 110.291 175.35 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . 0.847 HE21 ' HA ' ' A' ' 88' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.449 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.878 177.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.482 1.137 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 178.28 154.89 0.37 Allowed 'General case' 0 CA--C 1.516 -0.336 0 O-C-N 123.894 0.746 . . . . 0.0 110.032 173.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.6 tp -124.6 145.4 49.63 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 173.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.541 ' HE2' HG12 ' A' ' 32' ' ' VAL . 36.6 mtpt -107.0 104.36 14.01 Favored 'General case' 0 C--N 1.322 -0.626 0 C-N-CA 118.867 -1.133 . . . . 0.0 111.685 -177.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 6.5 m -103.47 152.46 21.63 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 176.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.499 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 58.5 m-85 -71.65 149.67 45.34 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.565 176.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -121.29 132.03 54.55 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.052 172.194 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -86.37 111.89 20.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.574 -175.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.0 t30 -144.69 112.43 6.25 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.863 -0.335 . . . . 0.0 111.194 -178.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 62.02 34.08 87.77 Favored Glycine 0 C--N 1.333 0.406 0 C-N-CA 120.23 -0.986 . . . . 0.0 112.484 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.6 t70 68.04 1.43 2.76 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.841 0.857 . . . . 0.0 111.326 -176.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -85.33 151.14 24.26 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 169.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.425 ' HD3' HH11 ' A' ' 30' ' ' ARG . 8.7 ptp180 -116.57 110.79 19.01 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 119.07 -1.052 . . . . 0.0 108.623 174.355 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.9 m -93.98 127.95 40.04 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.645 -172.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.541 HG12 ' HE2' ' A' ' 21' ' ' LYS . 25.0 t -75.93 104.02 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 176.186 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.43 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 1.3 p -115.82 149.24 38.9 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.652 -174.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.7 t -90.4 136.43 33.06 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.851 178.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -127.37 148.85 50.26 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 -178.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.526 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -82.89 -176.75 6.47 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 113.2 0.815 . . . . 0.0 113.2 -168.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.36 -43.83 92.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 114.597 -1.183 . . . . 0.0 112.715 -173.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.601 ' OE2' ' HG3' ' A' ' 39' ' ' GLN . 4.2 pm0 -62.63 -24.47 67.61 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.019 0.438 . . . . 0.0 110.027 179.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.734 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 37.4 mt-30 -110.1 52.39 0.73 Allowed 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.876 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -79.85 25.64 0.35 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.145 0.498 . . . . 0.0 111.445 178.031 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.76 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 16.1 mmt85 -131.34 179.52 5.98 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.752 172.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.733 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 62.7 m -142.95 131.49 22.4 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.625 -174.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.423 HD23 ' SG ' ' A' ' 61' ' ' CYS . 0.5 OUTLIER -100.39 127.68 46.64 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.983 0.421 . . . . 0.0 111.103 -175.697 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.658 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 40.7 t80 -142.35 115.6 8.92 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.588 174.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.438 ' HA ' ' HA ' ' A' ' 75' ' ' ALA . 58.2 t -105.92 138.04 33.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 C-N-CA 120.452 -0.499 . . . . 0.0 109.895 179.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.732 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 7.4 mm100 -74.93 137.45 41.67 Favored 'General case' 0 CA--C 1.517 -0.311 0 C-N-CA 120.094 -0.642 . . . . 0.0 109.944 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.525 ' HB2' ' C ' ' A' ' 50' ' ' SER . 3.3 mm? -131.85 143.13 47.79 Favored Pre-proline 0 C--N 1.312 -1.03 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.015 171.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 12.0 Cg_exo -72.12 -3.33 13.09 Favored 'Trans proline' 0 CA--C 1.529 0.254 0 C-N-CA 122.836 2.357 . . . . 0.0 112.776 -179.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 28.4 p90 -149.65 5.91 0.62 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.951 -177.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.525 ' C ' ' HB2' ' A' ' 47' ' ' LEU . 66.8 m -161.67 -162.09 0.84 Allowed 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -176.193 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.419 ' OE1' ' HB3' ' A' ' 86' ' ' SER . 14.2 pt-20 -163.8 147.34 10.01 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 174.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.658 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 67.5 mt -106.07 136.85 38.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 177.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -146.83 129.9 16.42 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 -177.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.553 ' HG3' ' HE2' ' A' ' 56' ' ' LYS . 7.0 pt-20 -179.26 157.26 0.8 Allowed 'General case' 0 C--N 1.329 -0.321 0 O-C-N 123.558 0.536 . . . . 0.0 109.965 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 2.8 m -81.34 141.4 34.06 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 119.809 -0.756 . . . . 0.0 109.121 175.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.553 ' HE2' ' HG3' ' A' ' 54' ' ' GLU . 69.6 mmtt -135.87 155.09 50.85 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.734 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 27.7 p -68.83 146.09 53.16 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 118.697 -1.201 . . . . 0.0 108.792 176.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.573 HG22 ' HG2' ' A' ' 41' ' ' ARG . 29.8 t -46.37 -54.73 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 O-C-N 123.461 0.476 . . . . 0.0 111.377 -173.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -63.09 -55.85 21.89 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.586 -178.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.747 ' O ' HG13 ' A' ' 64' ' ' VAL . 99.1 mt-30 -64.51 -26.58 68.49 Favored 'General case' 0 C--O 1.204 -1.317 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.495 -174.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.691 ' HA ' HG22 ' A' ' 64' ' ' VAL . 8.7 t -71.77 -33.63 68.78 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 177.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.07 -34.5 73.26 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.085 0.469 . . . . 0.0 109.867 172.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -64.97 -51.24 62.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.664 176.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.747 HG13 ' O ' ' A' ' 60' ' ' GLN . 14.1 m -67.49 -27.06 37.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.251 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.691 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -57.48 -49.26 76.86 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 173.443 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -73.33 -34.16 65.53 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.144 -174.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.646 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 11.9 pt-20 -60.15 -42.15 94.3 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 120.034 -0.667 . . . . 0.0 110.068 -178.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.506 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.5 m -79.91 -36.67 17.24 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.138 0 CA-C-O 120.779 0.323 . . . . 0.0 111.796 179.193 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 96.0 m -71.98 -29.46 64.26 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.206 -175.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.94 -23.75 64.19 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.562 174.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.515 HG13 ' O ' ' A' ' 67' ' ' GLU . 18.6 mt -79.11 -26.02 13.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.19 0 CA-C-O 121.323 0.582 . . . . 0.0 109.739 176.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.486 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 114.25 2.11 23.33 Favored Glycine 0 N--CA 1.445 -0.757 0 C-N-CA 119.838 -1.172 . . . . 0.0 112.035 -177.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 76.4 m-85 -96.03 107.31 33.89 Favored Pre-proline 0 N--CA 1.45 -0.456 0 CA-C-O 120.555 0.217 . . . . 0.0 110.602 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.732 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 77.8 Cg_exo -56.74 134.65 65.82 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 123.257 2.638 . . . . 0.0 112.979 178.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.691 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -130.79 161.25 32.15 Favored 'General case' 0 C--N 1.32 -0.685 0 C-N-CA 120.4 -0.52 . . . . 0.0 110.847 174.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 11.8 mmtm -130.05 140.06 50.9 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.533 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.76 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 6.1 t -150.72 109.65 3.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.137 0.494 . . . . 0.0 109.793 173.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.3 p -136.43 172.3 13.22 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.914 -0.584 . . . . 0.0 111.321 -171.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.584 ' SG ' ' HD3' ' A' ' 41' ' ' ARG . 55.7 m -107.88 101.9 11.14 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 179.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.484 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 7.5 tp10 179.06 142.15 0.12 Allowed 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 -176.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.714 ' HB3' HD22 ' A' ' 82' ' ' LEU . 43.7 m-20 -62.9 137.95 58.41 Favored 'General case' 0 CA--C 1.505 -0.776 0 C-N-CA 118.278 -1.369 . . . . 0.0 109.349 177.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.714 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 62.68 21.75 12.92 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.902 175.292 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . 0.484 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 6.4 t -69.62 -31.17 69.14 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.953 -0.299 . . . . 0.0 110.68 -174.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.634 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 28.7 p-10 -79.21 73.56 5.8 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 122.202 1.001 . . . . 0.0 108.909 174.353 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' A' ' 82' ' ' LEU . 20.3 ttm180 -116.9 154.19 31.25 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.496 -168.007 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.419 ' HB3' ' OE1' ' A' ' 51' ' ' GLU . 14.8 p -73.05 95.61 2.05 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.171 176.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.62 -32.54 11.03 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.635 -177.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 . . . . . 0 N--CA 1.472 0.647 0 O-C-N 123.935 0.772 . . . . 0.0 112.381 177.166 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.424 ' N ' ' SD ' ' A' ' 18' ' ' MET . 0.8 OUTLIER . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 120.829 0.347 . . . . 0.0 110.772 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.433 ' HB1' ' O ' ' A' ' 35' ' ' CYS . . . -52.36 132.04 33.91 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.537 176.32 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 35.6 tp -106.61 144.17 33.66 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -177.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.523 ' HG2' ' HB ' ' A' ' 34' ' ' THR . 33.4 mtmm -102.25 114.24 28.23 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.326 -0.55 . . . . 0.0 111.021 -178.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 18.0 m -113.46 173.42 6.42 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.612 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 46.2 m-85 -82.95 136.08 34.67 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 173.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.7 p -116.24 130.53 56.83 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 173.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.499 ' HA ' ' O ' ' A' ' 29' ' ' ASP . 7.8 tpt180 -97.04 110.99 23.42 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.536 -176.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -140.01 130.41 25.4 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 65.14 22.11 68.66 Favored Glycine 0 C--O 1.229 -0.214 0 C-N-CA 119.554 -1.308 . . . . 0.0 111.203 -173.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.1 t70 64.83 15.28 9.76 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 124.111 0.964 . . . . 0.0 111.224 -175.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.499 ' O ' ' HA ' ' A' ' 25' ' ' ARG . 11.9 t70 -94.33 150.18 20.53 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 171.119 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.424 ' HB3' ' OE1' ' A' ' 53' ' ' GLN . 30.2 ptt180 -114.83 111.7 21.62 Favored 'General case' 0 C--N 1.32 -0.681 0 C-N-CA 119.137 -1.025 . . . . 0.0 109.749 176.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -113.09 146.72 38.68 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.929 -173.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.408 HG13 HD11 ' A' ' 82' ' ' LEU . 94.4 t -80.96 108.11 13.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.029 175.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.1 p -119.4 148.37 43.29 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.853 0.359 . . . . 0.0 110.271 176.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.523 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 3.1 t -91.63 115.59 28.17 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.094 -0.642 . . . . 0.0 109.87 177.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.433 ' O ' ' HB1' ' A' ' 19' ' ' ALA . 0.2 OUTLIER -87.98 160.44 17.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.41 -0.813 . . . . 0.0 109.186 -176.74 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.546 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -74.89 -179.19 4.1 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.243 -0.583 . . . . 0.0 112.423 -169.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 68.1 mm-40 -63.83 -37.26 86.72 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.377 -172.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.546 ' OE2' ' HB3' ' A' ' 36' ' ' ALA . 0.0 OUTLIER -76.11 -25.84 55.81 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.254 -174.028 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.641 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 40.4 mt-30 -98.24 80.68 2.69 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.366 0.603 . . . . 0.0 110.392 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.54 21.29 9.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.261 -0.882 . . . . 0.0 112.103 -176.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.827 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 15.8 mmt85 -126.82 179.69 5.25 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 119.956 -0.698 . . . . 0.0 109.947 171.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.699 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 63.8 m -139.73 131.88 28.09 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.54 -173.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.498 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 1.0 OUTLIER -103.69 130.64 51.2 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.673 0.273 . . . . 0.0 111.081 -171.899 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.725 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 1.2 t80 -146.75 104.05 3.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.331 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.584 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 46.3 t -102.48 136.14 36.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.922 178.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.782 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 10.5 mm100 -76.59 140.24 40.97 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.962 0.41 . . . . 0.0 110.791 -178.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.519 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.0 mm? -132.09 153.95 81.51 Favored Pre-proline 0 C--N 1.321 -0.656 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 174.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_exo -74.63 18.17 0.52 Allowed 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 122.941 2.427 . . . . 0.0 113.018 179.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 18.3 p90 -160.46 -48.31 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.929 0.395 . . . . 0.0 110.634 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.519 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 20.5 m -120.55 -153.17 0.53 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.74 178.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -155.64 144.61 20.63 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 178.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.725 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 69.1 mt -89.84 128.95 41.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.381 -0.527 . . . . 0.0 109.761 176.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.498 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 49.0 mt-30 -139.48 131.53 27.94 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 -177.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.909 ' HG2' ' HE2' ' A' ' 56' ' ' LYS . 1.1 tp10 -170.42 153.89 4.51 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -168.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 4.9 m -93.17 128.41 39.11 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 119.689 -0.805 . . . . 0.0 108.895 173.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.909 ' HE2' ' HG2' ' A' ' 54' ' ' GLU . 57.8 mmtt -131.12 147.65 52.64 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.641 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 46.0 p -62.8 153.67 32.25 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 174.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.634 HG22 ' HG2' ' A' ' 41' ' ' ARG . 40.9 t -49.67 -48.15 21.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 O-C-N 123.238 0.336 . . . . 0.0 110.87 -176.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -65.83 -56.11 13.57 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.464 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.7 ' O ' HG13 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -58.43 -34.12 70.45 Favored 'General case' 0 C--O 1.21 -0.995 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.803 -175.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.697 ' HA ' HG22 ' A' ' 64' ' ' VAL . 4.3 t -72.6 -33.4 66.68 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.613 -179.35 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.85 -36.76 73.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.276 0.56 . . . . 0.0 109.698 173.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.565 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 92.6 mt-10 -59.99 -52.8 63.83 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.459 175.614 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.7 HG13 ' O ' ' A' ' 60' ' ' GLN . 17.9 m -70.38 -27.41 31.56 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.618 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.615 -178.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.683 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.1 OUTLIER -59.3 -50.63 73.24 Favored 'General case' 0 N--CA 1.45 -0.425 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 175.847 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -73.85 -33.28 64.04 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.944 -173.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.607 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.9 pt-20 -60.28 -43.31 96.35 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 120.114 -0.635 . . . . 0.0 110.097 -179.234 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.514 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.0 m -79.76 -35.86 16.77 Favored 'Isoleucine or valine' 0 C--O 1.231 0.103 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.738 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 99.4 m -71.84 -27.71 63.07 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.983 -176.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.18 -23.52 61.28 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.508 -0.477 . . . . 0.0 110.484 173.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.597 HG13 ' O ' ' A' ' 67' ' ' GLU . 43.6 mt -78.21 -32.49 17.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 121.342 0.592 . . . . 0.0 109.971 177.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.486 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 121.0 2.34 11.19 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.21 -0.995 . . . . 0.0 111.757 -176.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -97.86 106.61 35.18 Favored Pre-proline 0 N--CA 1.448 -0.53 0 CA-C-O 120.629 0.252 . . . . 0.0 110.824 178.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.782 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 79.2 Cg_exo -54.61 133.83 58.98 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 123.183 2.589 . . . . 0.0 112.846 177.219 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.683 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -130.49 157.13 43.5 Favored 'General case' 0 C--N 1.32 -0.677 0 C-N-CA 120.234 -0.587 . . . . 0.0 110.937 174.248 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.1 mmtp -128.69 143.09 50.86 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.535 -179.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.827 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 8.4 t -156.27 112.29 3.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.919 0.39 . . . . 0.0 110.392 176.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 3.8 p -143.77 173.28 11.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.002 -174.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.582 ' SG ' ' HD3' ' A' ' 41' ' ' ARG . 57.6 m -108.07 104.09 13.45 Favored 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.514 -175.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.475 ' HG3' ' HB2' ' A' ' 83' ' ' CYS . 0.0 OUTLIER 177.22 161.72 0.46 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 106.801 -1.555 . . . . 0.0 106.801 173.557 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.699 ' HB3' HD22 ' A' ' 82' ' ' LEU . 56.7 m-20 -68.22 135.24 51.7 Favored 'General case' 0 CA--C 1.501 -0.915 0 C-N-CA 117.023 -1.871 . . . . 0.0 109.558 -179.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.701 ' O ' ' HB2' ' A' ' 85' ' ' ARG . 0.2 OUTLIER 63.9 22.21 12.92 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.626 175.364 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . 0.475 ' HB2' ' HG3' ' A' ' 80' ' ' GLU . 4.3 t -64.5 -27.61 69.09 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.891 0.377 . . . . 0.0 111.049 -174.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.653 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 27.7 p-10 -78.27 70.07 4.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 122.419 1.104 . . . . 0.0 108.677 172.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.701 ' HB2' ' O ' ' A' ' 82' ' ' LEU . 30.4 ttp180 -117.94 133.87 55.5 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 113.963 -1.471 . . . . 0.0 111.088 -166.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.418 ' HA ' ' CZ ' ' A' ' 44' ' ' PHE . 0.9 OUTLIER -64.41 143.3 58.0 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.78 -1.1 . . . . 0.0 111.383 -176.2 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -70.75 -47.91 57.18 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 176.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 . . . . . 0 N--CA 1.471 0.614 0 O-C-N 124.341 1.026 . . . . 0.0 112.849 173.573 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 91.0 mtp . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 110.356 -0.238 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.499 ' HB1' ' O ' ' A' ' 35' ' ' CYS . . . -63.79 121.11 13.22 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 123.687 0.617 . . . . 0.0 110.9 176.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.652 HD21 ' H ' ' A' ' 80' ' ' GLU . 21.8 tp -103.24 117.51 34.68 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -177.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.615 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 28.8 mtmm -82.67 114.76 21.26 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.267 0.556 . . . . 0.0 111.403 -175.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 5.7 m -113.27 162.57 15.87 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.613 -0.721 . . . . 0.0 109.794 -179.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.493 ' CD1' ' HB2' ' A' ' 85' ' ' ARG . 34.7 m-85 -79.33 138.87 37.88 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.618 176.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 32.2 m -129.0 131.83 47.46 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.3 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.71 HH11 ' HB2' ' A' ' 51' ' ' GLU . 30.8 mtp180 -88.52 111.44 21.85 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 119.923 -0.711 . . . . 0.0 111.749 -176.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -110.18 118.65 36.94 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.121 174.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.51 -77.1 2.01 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 119.618 -1.277 . . . . 0.0 110.958 -174.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -150.2 -45.16 0.13 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.656 0.265 . . . . 0.0 110.619 174.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.435 ' O ' ' HA ' ' A' ' 25' ' ' ARG . 2.1 p-10 -65.08 171.28 3.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.346 0.593 . . . . 0.0 110.725 -177.466 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.1 ptp180 -120.64 113.9 20.92 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 119.774 -0.771 . . . . 0.0 109.33 179.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.5 m -100.63 145.15 28.75 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.731 -175.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 96.8 t -72.46 106.93 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.272 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 31.2 p -104.26 137.4 42.23 Favored 'General case' 0 C--N 1.314 -0.955 0 C-N-CA 120.069 -0.652 . . . . 0.0 110.346 175.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.615 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.7 t -86.37 111.99 21.03 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 121.634 0.73 . . . . 0.0 109.404 176.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.499 ' O ' ' HB1' ' A' ' 19' ' ' ALA . 0.0 OUTLIER -89.28 172.88 8.72 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.232 -0.895 . . . . 0.0 110.089 -173.017 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.89 166.35 20.98 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.291 -0.564 . . . . 0.0 111.147 -175.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 56.7 mm-40 -51.98 -26.98 11.8 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.37 176.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.485 ' HG2' ' CG2' ' A' ' 57' ' ' THR . 27.6 tt0 -62.62 -39.68 94.57 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.012 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.47 ' HG3' ' CB ' ' A' ' 55' ' ' CYS . 16.5 mm-40 -82.04 100.66 9.86 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 118.904 -1.118 . . . . 0.0 109.675 -178.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.422 ' OG1' HG23 ' A' ' 58' ' ' VAL . 0.7 OUTLIER -101.58 21.71 13.9 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.591 0.71 . . . . 0.0 110.04 175.537 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.903 ' HG3' ' HB2' ' A' ' 77' ' ' CYS . 1.2 tpt180 -152.4 177.76 10.26 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.741 -176.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.611 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 79.4 m -141.34 131.88 25.41 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 179.537 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.406 HD22 HG23 ' A' ' 45' ' ' VAL . 0.3 OUTLIER -94.93 130.47 41.55 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 -178.881 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.493 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 18.6 t80 -139.54 113.51 8.74 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.959 -0.564 . . . . 0.0 109.86 170.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.645 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 22.0 t -108.72 133.84 52.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 176.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.882 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -90.03 132.36 35.42 Favored 'General case' 0 CA--C 1.518 -0.26 0 C-N-CA 119.397 -0.921 . . . . 0.0 110.455 177.296 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.63 HD21 HG12 ' A' ' 52' ' ' ILE . 3.5 mm? -121.06 152.03 56.12 Favored Pre-proline 0 C--N 1.319 -0.739 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -66.51 -17.25 53.04 Favored 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.46 2.106 . . . . 0.0 112.713 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 87.6 m-85 -134.93 -2.43 2.6 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 120.951 -0.299 . . . . 0.0 111.526 -177.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.604 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 49.1 m -157.97 -168.61 2.56 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.32 -0.552 . . . . 0.0 110.188 -174.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.71 ' HB2' HH11 ' A' ' 25' ' ' ARG . 18.4 mt-10 -147.01 148.06 31.31 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 176.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.645 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 26.8 mm -109.28 129.18 64.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 175.484 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.529 ' NE2' ' HA ' ' A' ' 85' ' ' ARG . 51.2 mt-30 -140.93 130.27 23.7 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 120.171 -0.612 . . . . 0.0 110.203 179.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.11 158.03 24.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.661 -179.328 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.512 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 8.3 m -80.42 118.34 21.96 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 166.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.512 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 12.1 mptt -124.25 147.88 47.76 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.485 ' CG2' ' HG2' ' A' ' 38' ' ' GLU . 18.2 p -68.34 164.3 21.14 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.422 HG23 ' OG1' ' A' ' 40' ' ' THR . 57.8 t -59.1 -43.27 88.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 119.261 -0.976 . . . . 0.0 110.33 177.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.5 tt0 -64.09 -54.57 31.86 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 120.588 -0.445 . . . . 0.0 110.748 179.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.646 ' O ' HG13 ' A' ' 64' ' ' VAL . 33.6 tt0 -61.58 -32.8 72.91 Favored 'General case' 0 C--O 1.206 -1.219 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.247 -174.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.693 ' O ' ' HB2' ' A' ' 65' ' ' LEU . 0.6 OUTLIER -66.12 -33.42 75.74 Favored 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.13 -0.628 . . . . 0.0 110.18 178.845 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.91 -41.54 74.55 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.043 0.449 . . . . 0.0 109.943 174.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.538 ' OE2' ' HA ' ' A' ' 60' ' ' GLN . 44.9 mt-10 -56.53 -53.34 58.65 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.248 -0.887 . . . . 0.0 110.545 176.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.646 HG13 ' O ' ' A' ' 60' ' ' GLN . 15.3 m -73.77 -27.63 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.656 0 CA-C-N 114.659 -1.155 . . . . 0.0 111.693 -176.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.693 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 6.7 tp -59.78 -50.5 73.58 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 179.144 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -74.72 -34.99 62.67 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.465 -0.788 . . . . 0.0 112.218 -176.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.632 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.4 pt-20 -58.0 -47.27 83.52 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 120.158 -0.617 . . . . 0.0 110.529 -177.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.602 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 33.4 m -80.54 -34.13 14.2 Favored 'Isoleucine or valine' 0 C--O 1.231 0.12 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.833 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 32.5 m -72.16 -23.89 61.35 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 120.606 -0.438 . . . . 0.0 111.157 -177.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.39 -21.35 62.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.119 0.485 . . . . 0.0 110.099 174.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 67' ' ' GLU . 12.2 mt -86.99 -19.2 8.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.542 176.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 111.18 12.57 15.25 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.09 -1.052 . . . . 0.0 112.362 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 52.5 m-85 -98.65 118.66 62.8 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-O 120.911 0.386 . . . . 0.0 111.289 -178.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.882 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 46.4 Cg_exo -64.23 123.3 11.62 Favored 'Trans proline' 0 CA--C 1.519 -0.232 0 C-N-CA 123.585 2.857 . . . . 0.0 112.569 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -135.59 155.76 49.95 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 120.481 -0.487 . . . . 0.0 111.509 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.541 ' HD3' HE22 ' A' ' 46' ' ' GLN . 0.0 OUTLIER -139.75 152.06 46.31 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.348 0.594 . . . . 0.0 111.278 172.977 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.903 ' HB2' ' HG3' ' A' ' 41' ' ' ARG . 2.6 p -129.73 115.89 17.97 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.695 161.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 1.6 p -106.56 159.01 16.5 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.798 176.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.436 ' SG ' ' CD ' ' A' ' 41' ' ' ARG . 28.2 m -108.81 101.17 10.3 Favored 'General case' 0 CA--C 1.521 -0.135 0 C-N-CA 120.282 -0.567 . . . . 0.0 109.7 177.17 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.652 ' H ' HD21 ' A' ' 20' ' ' LEU . 9.0 tp10 173.74 144.16 0.05 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.669 ' HB3' HD22 ' A' ' 82' ' ' LEU . 58.5 m-20 -60.14 139.73 57.34 Favored 'General case' 0 CA--C 1.511 -0.519 0 C-N-CA 118.937 -1.105 . . . . 0.0 109.614 177.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.669 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 66.73 13.88 9.55 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.51 170.9 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . 0.499 ' HB3' ' HB3' ' A' ' 80' ' ' GLU . 9.2 p -77.91 -32.33 51.64 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 120.355 -0.538 . . . . 0.0 111.268 -173.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.555 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 22.1 p-10 -80.03 18.64 0.8 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.935 0.397 . . . . 0.0 111.157 -174.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.529 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 9.6 ttm180 -92.56 -50.23 5.72 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.436 -176.197 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.4 p -157.04 120.12 4.07 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.379 -174.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -87.86 -23.67 23.91 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.113 0.482 . . . . 0.0 110.465 178.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.175 178.362 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 27.0 ttt . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 110.381 -0.229 . . . . 0.0 110.381 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -66.93 124.95 24.42 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.864 176.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.0 tp -111.28 158.26 19.2 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.165 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.476 ' O ' HD13 ' A' ' 82' ' ' LEU . 9.4 mtmp? -113.45 109.12 18.16 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 119.643 -0.823 . . . . 0.0 111.056 175.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 19.6 m -112.29 154.67 25.3 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 175.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.571 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 11.6 m-85 -70.48 134.11 47.44 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 119.825 -0.75 . . . . 0.0 109.93 175.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.5 m -132.07 129.33 39.85 Favored 'General case' 0 C--N 1.319 -0.757 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.218 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.801 ' HG3' ' HG3' ' A' ' 30' ' ' ARG . 1.9 mtt-85 -83.44 109.77 17.61 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 119.579 -0.848 . . . . 0.0 109.747 175.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.443 HD21 HG22 ' A' ' 31' ' ' THR . 8.4 p30 -136.92 143.14 42.77 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 178.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 75.1 -71.73 1.7 Allowed Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 119.217 -1.468 . . . . 0.0 109.6 -168.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -144.57 -87.45 0.12 Allowed 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 166.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.428 ' HA ' ' NE ' ' A' ' 25' ' ' ARG . 2.9 t70 -86.02 178.42 7.26 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.676 0.751 . . . . 0.0 112.334 -172.191 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.801 ' HG3' ' HG3' ' A' ' 25' ' ' ARG . 0.8 OUTLIER -76.19 136.84 39.74 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.64 -1.164 . . . . 0.0 112.485 -171.798 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.493 HG23 HG23 ' A' ' 33' ' ' THR . 12.2 t -127.53 162.75 25.69 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 169.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 48.7 t -74.6 106.26 4.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 C-N-CA 120.289 -0.564 . . . . 0.0 109.836 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.493 HG23 HG23 ' A' ' 31' ' ' THR . 27.1 p -115.69 147.78 40.47 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.152 0.501 . . . . 0.0 111.389 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.4 t -105.37 126.75 52.47 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.4 176.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 5.4 p -91.65 176.63 6.47 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 177.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -85.29 -176.81 6.3 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 120.154 -0.618 . . . . 0.0 111.793 -172.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 -61.66 -32.28 72.44 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -172.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.453 ' HG2' HG22 ' A' ' 57' ' ' THR . 10.2 pm0 -77.21 -23.32 51.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.834 0.349 . . . . 0.0 111.176 -176.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.606 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 69.0 mt-30 -92.93 109.06 20.5 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.141 0.496 . . . . 0.0 110.152 -178.353 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.34 5.16 10.22 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.768 -174.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.617 ' HG2' HG22 ' A' ' 58' ' ' VAL . 10.0 mmm180 -130.44 -179.68 5.41 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-O 121.617 0.722 . . . . 0.0 110.032 174.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.568 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 40.4 m -126.51 150.33 48.82 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.245 -177.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.503 ' HB2' ' CG ' ' A' ' 56' ' ' LYS . 0.2 OUTLIER -109.01 122.34 47.05 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.87 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.613 ' HB2' ' HB2' ' A' ' 84' ' ' ASN . 52.6 t80 -131.93 117.95 19.14 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.015 175.059 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.544 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 42.2 t -116.46 130.02 71.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 177.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.781 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 2.6 mm100 -75.63 141.25 42.86 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 119.73 -0.788 . . . . 0.0 109.932 178.442 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.531 HD21 HG12 ' A' ' 52' ' ' ILE . 2.5 mm? -138.86 155.82 72.96 Favored Pre-proline 0 C--N 1.318 -0.785 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 172.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -85.82 11.27 3.38 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.494 2.129 . . . . 0.0 111.37 171.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -128.38 -64.56 0.94 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.877 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.451 ' O ' HD23 ' A' ' 47' ' ' LEU . 20.6 t -152.94 132.22 12.79 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 177.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.457 ' HA ' HD23 ' A' ' 47' ' ' LEU . 0.9 OUTLIER -77.11 148.63 35.93 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.425 -173.783 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.544 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 38.5 mm -88.65 131.69 35.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.176 177.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.585 ' OE1' ' HD3' ' A' ' 30' ' ' ARG . 17.4 mt-30 -144.57 130.39 19.22 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 120.344 -0.543 . . . . 0.0 110.166 -178.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.429 ' HG3' ' HE2' ' A' ' 56' ' ' LYS . 10.7 pt-20 -175.79 170.74 2.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.423 -178.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.453 ' HB3' ' OE1' ' A' ' 39' ' ' GLN . 8.1 t -92.33 148.92 21.75 Favored 'General case' 0 CA--C 1.519 -0.231 0 C-N-CA 119.665 -0.814 . . . . 0.0 109.699 177.179 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.503 ' CG ' ' HB2' ' A' ' 43' ' ' LEU . 56.6 mmtt -142.08 162.41 35.53 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 176.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.606 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 29.3 p -72.34 160.32 32.56 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 172.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.617 HG22 ' HG2' ' A' ' 41' ' ' ARG . 22.0 t -59.12 -39.38 78.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 C-N-CA 120.029 -0.669 . . . . 0.0 109.637 -179.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.469 ' O ' ' HG3' ' A' ' 63' ' ' GLU . 41.3 tp60 -62.53 -56.12 20.99 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.697 177.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.57 ' O ' HG13 ' A' ' 64' ' ' VAL . 34.8 tt0 -69.75 -30.93 68.63 Favored 'General case' 0 C--O 1.203 -1.351 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.633 -173.097 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.492 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.7 p -65.15 -33.21 75.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 179.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.29 -45.87 65.46 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 173.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.542 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 75.7 mt-10 -54.91 -52.32 63.28 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.294 178.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.64 ' HA ' ' HG2' ' A' ' 67' ' ' GLU . 27.6 m -68.98 -30.42 46.7 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.528 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.481 -177.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.5 tp -62.59 -49.61 74.56 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.46 174.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -74.2 -31.44 62.64 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -176.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.64 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.6 pt-20 -63.35 -45.61 90.43 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 120.653 -0.419 . . . . 0.0 110.38 -177.006 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.56 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 29.3 m -79.34 -31.8 14.55 Favored 'Isoleucine or valine' 0 C--O 1.231 0.09 0 C-N-CA 120.279 -0.568 . . . . 0.0 111.335 179.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 85.5 m -66.41 -31.37 72.09 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 120.935 0.398 . . . . 0.0 110.484 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.0 -23.95 65.98 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.612 176.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.416 HG13 ' O ' ' A' ' 67' ' ' GLU . 16.0 mt -86.43 -20.63 7.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.956 -0.566 . . . . 0.0 109.959 178.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 114.95 -4.21 22.53 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.094 -1.05 . . . . 0.0 112.362 -178.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -91.91 114.71 62.9 Favored Pre-proline 0 N--CA 1.448 -0.554 0 CA-C-O 120.658 0.266 . . . . 0.0 110.926 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.781 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 51.6 Cg_exo -59.25 128.8 28.81 Favored 'Trans proline' 0 C--O 1.232 0.212 0 C-N-CA 123.177 2.585 . . . . 0.0 113.09 178.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.489 ' C ' ' HG2' ' A' ' 76' ' ' LYS . . . -126.53 165.56 18.9 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.451 173.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.563 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 0.9 OUTLIER -145.71 118.66 8.75 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.118 -178.115 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.568 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 1.4 t -104.31 106.79 17.42 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.248 0.547 . . . . 0.0 110.078 171.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 54.0 t -110.91 160.86 16.4 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.226 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.541 ' HB2' ' HD2' ' A' ' 41' ' ' ARG . 36.3 t -125.84 100.09 6.24 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 175.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.587 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 3.5 tm-20 171.53 149.79 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 105.681 -1.97 . . . . 0.0 105.681 -173.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.765 ' HB3' HD22 ' A' ' 82' ' ' LEU . 35.3 m-20 -65.38 135.43 55.26 Favored 'General case' 0 CA--C 1.504 -0.793 0 C-N-CA 117.368 -1.733 . . . . 0.0 110.9 -172.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.775 ' O ' ' HD3' ' A' ' 85' ' ' ARG . 0.2 OUTLIER 65.82 1.95 2.0 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.824 -1.08 . . . . 0.0 110.839 173.603 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . 0.587 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 16.9 t -54.94 -18.71 5.34 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -167.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.613 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 27.9 p-10 -78.36 37.77 0.28 Allowed 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.469 175.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.775 ' HD3' ' O ' ' A' ' 82' ' ' LEU . 0.7 OUTLIER -67.62 159.95 28.87 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.23 174.189 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 7.5 m -72.62 91.0 1.4 Allowed 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 174.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 52.94 81.01 0.09 Allowed 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.712 -174.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 . . . . . 0 C--O 1.235 0.297 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.713 -179.721 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 26.7 ptm . . . . . 0 N--CA 1.48 1.04 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.67 151.52 30.46 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.045 -176.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 55.5 tp -110.9 129.74 55.79 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 34' ' ' THR . 30.8 mtmm -89.46 139.04 30.92 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.49 -0.484 . . . . 0.0 110.986 -179.392 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.563 ' HA ' HD23 ' A' ' 82' ' ' LEU . 2.7 m -152.9 166.72 31.44 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.591 173.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -76.36 121.61 23.26 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.384 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.549 ' HA ' ' HA ' ' A' ' 54' ' ' GLU . 67.6 m -115.26 144.0 44.4 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 174.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.488 HH12 ' CD ' ' A' ' 51' ' ' GLU . 3.5 tpt180 -83.4 110.33 18.06 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.89 0.376 . . . . 0.0 111.12 -174.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -97.82 85.57 3.57 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 174.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 68.96 -109.64 3.0 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 119.816 -1.183 . . . . 0.0 111.284 -173.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.5 p-10 -93.05 -34.97 13.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.634 0.254 . . . . 0.0 110.346 177.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -71.24 154.85 41.34 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.954 -177.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.599 ' HD2' ' OE1' ' A' ' 53' ' ' GLN . 69.3 mtm180 -116.05 112.69 22.13 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 175.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.5 m -108.36 138.49 44.57 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.535 -169.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.695 HG13 HD21 ' A' ' 82' ' ' LEU . 94.3 t -74.52 106.09 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 173.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.42 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 42.8 p -113.79 143.14 45.14 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 120.67 -0.412 . . . . 0.0 110.915 -178.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.424 ' HA ' ' HA ' ' A' ' 21' ' ' LYS . 2.9 t -93.05 111.95 23.75 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 175.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 37.0 m -108.0 155.99 19.73 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.742 -173.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.59 ' HB3' ' HG2' ' A' ' 38' ' ' GLU . . . -74.99 172.06 12.98 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -166.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -57.94 -27.44 63.39 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.419 -179.866 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.59 ' HG2' ' HB3' ' A' ' 36' ' ' ALA . 4.8 pt-20 -52.47 -45.03 65.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.365 0.603 . . . . 0.0 110.203 173.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.653 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 41.9 mt-30 -102.44 72.78 1.28 Allowed 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.501 -0.772 . . . . 0.0 109.843 -177.242 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.11 9.73 18.94 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.318 -177.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.547 ' HB2' ' HA ' ' A' ' 58' ' ' VAL . 2.4 tpt180 -123.8 174.89 7.22 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 173.526 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.725 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 57.9 m -142.08 131.67 23.95 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 120.516 -0.474 . . . . 0.0 109.765 -175.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.526 HD22 HG23 ' A' ' 45' ' ' VAL . 0.3 OUTLIER -91.14 131.39 36.73 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.84 -174.985 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.772 ' HD2' ' HG3' ' A' ' 76' ' ' LYS . 77.8 t80 -138.28 121.15 16.52 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.367 169.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.601 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 30.1 t -122.43 141.75 41.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 C-N-CA 120.604 -0.438 . . . . 0.0 110.384 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.735 ' CG ' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -81.41 142.51 32.91 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 176.193 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.618 HD21 HG12 ' A' ' 52' ' ' ILE . 4.2 mm? -129.93 153.38 80.96 Favored Pre-proline 0 C--N 1.318 -0.792 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 174.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_exo -72.18 18.39 0.32 Allowed 'Trans proline' 0 CA--C 1.533 0.466 0 C-N-CA 123.0 2.467 . . . . 0.0 113.154 179.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 28.9 p90 -168.87 -22.41 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.906 0.384 . . . . 0.0 110.797 -177.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.538 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 33.8 p -144.59 -157.4 0.78 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.34 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.488 ' CD ' HH12 ' A' ' 25' ' ' ARG . 0.0 OUTLIER -151.53 157.37 42.17 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.882 0.373 . . . . 0.0 110.945 176.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.618 HG12 HD21 ' A' ' 47' ' ' LEU . 29.1 mm -105.26 134.16 47.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.658 177.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.599 ' OE1' ' HD2' ' A' ' 30' ' ' ARG . 36.7 mt-30 -140.95 131.71 25.77 Favored 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.866 174.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.549 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 8.0 pt-20 -169.36 160.92 9.68 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.325 0.391 . . . . 0.0 110.842 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 80.6 m -80.36 145.41 32.06 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 169.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.414 ' HE3' HD12 ' A' ' 43' ' ' LEU . 4.6 tppt? -152.16 148.65 27.87 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.397 -0.521 . . . . 0.0 109.778 178.899 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.653 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 31.7 p -67.46 142.71 56.55 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 120.179 -0.608 . . . . 0.0 109.518 178.217 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.547 ' HA ' ' HB2' ' A' ' 41' ' ' ARG . 42.3 t -52.59 -46.34 48.85 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 CA-C-O 120.694 0.283 . . . . 0.0 111.132 -175.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -58.48 -56.96 15.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.269 -179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.793 ' O ' HG13 ' A' ' 64' ' ' VAL . 53.4 mt-30 -71.05 -32.59 69.35 Favored 'General case' 0 C--O 1.198 -1.631 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.849 -174.115 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.655 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.9 t -66.33 -32.97 74.69 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.228 -178.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.07 -42.76 84.16 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.173 0.511 . . . . 0.0 110.177 172.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 17.5 mm-40 -57.68 -52.57 64.9 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.978 0.894 . . . . 0.0 111.042 176.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.793 HG13 ' O ' ' A' ' 60' ' ' GLN . 4.3 m -68.23 -26.45 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.862 0 CA-C-N 114.721 -1.127 . . . . 0.0 110.818 -179.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.739 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -55.18 -49.96 70.56 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 174.914 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -73.37 -35.41 65.93 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 119.721 -0.792 . . . . 0.0 112.134 -174.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.651 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.9 pt-20 -59.74 -42.89 94.19 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.042 -0.663 . . . . 0.0 110.447 -179.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.509 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 28.5 m -78.13 -36.74 21.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.864 0.364 . . . . 0.0 111.212 179.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 97.6 m -71.08 -20.26 62.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.136 0.493 . . . . 0.0 110.798 -177.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -79.66 -25.12 41.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.388 175.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.569 HG13 ' O ' ' A' ' 67' ' ' GLU . 17.6 mt -79.55 -29.77 13.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 121.392 0.615 . . . . 0.0 109.648 177.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.451 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 120.03 13.53 5.93 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.396 -0.907 . . . . 0.0 111.897 -177.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.469 ' HB2' ' HB ' ' A' ' 68' ' ' VAL . 55.7 m-85 -104.48 102.47 33.94 Favored Pre-proline 0 N--CA 1.448 -0.528 0 CA-C-O 120.622 0.248 . . . . 0.0 110.89 179.459 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.735 ' HB2' ' CG ' ' A' ' 46' ' ' GLN . 81.7 Cg_exo -54.4 124.72 16.78 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 123.3 2.667 . . . . 0.0 112.767 176.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.739 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -128.05 154.24 45.89 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.279 -0.568 . . . . 0.0 111.165 176.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.772 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 1.5 mttt -138.72 112.44 8.35 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.106 179.099 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.725 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 59.3 m -102.09 102.22 12.67 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 119.834 -0.746 . . . . 0.0 109.797 173.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 40.6 t -107.61 160.0 16.02 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.365 -178.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.502 ' HB2' ' HD2' ' A' ' 41' ' ' ARG . 49.0 t -122.72 100.47 6.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.304 0.573 . . . . 0.0 109.996 178.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.643 ' HG2' ' H ' ' A' ' 81' ' ' ASP . 2.7 tt0 -173.98 166.5 4.31 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 105.892 -1.892 . . . . 0.0 105.892 178.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.643 ' H ' ' HG2' ' A' ' 80' ' ' GLU . 9.4 t70 -69.29 109.12 3.97 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.155 -174.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.695 HD21 HG13 ' A' ' 32' ' ' VAL . 30.5 mt 69.27 31.35 3.95 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.983 -177.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . 0.618 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 3.3 t -70.82 -6.76 40.34 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 -173.1 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.444 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 29.7 p-10 -84.31 24.62 0.95 Allowed 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.135 177.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 24.4 ptt180 -90.3 130.32 36.43 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.927 -1.033 . . . . 0.0 109.516 174.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 55.9 m -156.94 159.34 38.01 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 121.319 -0.152 . . . . 0.0 111.021 -179.094 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 56.22 44.54 24.78 Favored 'General case' 0 C--O 1.232 0.139 0 O-C-N 124.168 0.918 . . . . 0.0 111.275 176.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 . . . . . 0 C--N 1.327 -0.373 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.72 178.875 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.6 mpt? . . . . . 0 N--CA 1.484 1.266 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.96 131.04 36.2 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.993 -178.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 21.3 tp -124.25 152.49 42.92 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.564 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 31.4 mtmm -106.47 108.25 19.67 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.14 0.495 . . . . 0.0 111.415 -179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 12.4 m -111.33 153.29 26.2 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 176.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.692 ' HB3' ' HB2' ' A' ' 30' ' ' ARG . 63.2 m-85 -70.66 137.31 49.76 Favored 'General case' 0 C--N 1.324 -0.534 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.212 176.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.7 p -116.37 144.51 44.19 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.784 -0.366 . . . . 0.0 110.346 175.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.438 HH12 ' NH2' ' A' ' 30' ' ' ARG . 10.8 tpt180 -83.3 110.29 17.98 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 178.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -129.41 116.94 19.77 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -175.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 71.09 -76.14 0.6 Allowed Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 109.946 -1.262 . . . . 0.0 109.946 -171.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -140.0 -85.62 0.22 Allowed 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 166.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -62.14 174.97 0.78 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.806 0.812 . . . . 0.0 112.823 -169.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.692 ' HB2' ' HB3' ' A' ' 23' ' ' PHE . 1.0 OUTLIER -80.62 136.42 36.23 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.216 -0.902 . . . . 0.0 112.41 -167.751 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 27.2 m -108.04 132.01 53.99 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.007 174.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 95.5 t -73.14 107.79 4.02 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 176.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 19.4 p -123.74 134.7 53.63 Favored 'General case' 0 C--N 1.317 -0.848 0 C-N-CA 120.103 -0.639 . . . . 0.0 111.582 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.564 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.5 t -79.65 113.49 17.85 Favored 'General case' 0 N--CA 1.443 -0.807 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 170.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.3 m -87.88 166.07 14.81 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.373 -170.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.461 ' HB3' ' OE2' ' A' ' 38' ' ' GLU . . . -61.81 157.5 17.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.051 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 -81.28 -12.28 59.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -164.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.481 ' HG2' HG22 ' A' ' 57' ' ' THR . 0.0 OUTLIER -78.83 -27.53 44.31 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.511 0.672 . . . . 0.0 109.522 175.566 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.632 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 12.7 mt-30 -88.06 88.06 7.52 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.43 177.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.7 p -97.15 5.11 50.77 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.253 -175.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.816 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 17.7 mmt85 -117.51 178.89 4.22 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 119.376 -0.929 . . . . 0.0 110.036 172.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.561 ' HB3' ' HB3' ' A' ' 84' ' ' ASN . 86.0 m -135.61 131.12 35.43 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.649 -1.16 . . . . 0.0 109.407 -174.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.5 ' HB2' ' CG ' ' A' ' 56' ' ' LYS . 1.6 tm? -100.23 128.21 46.35 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.667 -173.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.587 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 52.3 t80 -142.17 114.85 8.54 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.768 174.022 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.563 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 41.4 t -101.61 128.88 53.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 175.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.731 ' HB3' ' HB2' ' A' ' 74' ' ' PRO . 0.0 OUTLIER -90.04 114.22 26.06 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.27 -178.576 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.553 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.5 mm? -109.69 153.33 43.02 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.039 179.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -80.15 27.18 0.55 Allowed 'Trans proline' 0 CA--C 1.532 0.424 0 C-N-CA 122.737 2.291 . . . . 0.0 112.724 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.426 ' HD2' ' HG ' ' A' ' 50' ' ' SER . 39.0 p90 -170.63 -23.38 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.829 -177.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.553 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 45.2 m -148.09 -160.95 1.24 Allowed 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 178.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.432 ' HA ' HD23 ' A' ' 47' ' ' LEU . 16.3 pt-20 -158.01 150.47 22.37 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.816 179.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.587 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 37.8 mt -112.38 137.97 43.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 177.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.48 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 45.3 mt-30 -144.5 128.95 17.97 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 -178.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -150.84 174.98 12.45 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 -179.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 3.6 m -107.72 127.2 53.47 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 167.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.521 ' HB2' ' SG ' ' A' ' 61' ' ' CYS . 71.9 mmtt -133.5 148.38 51.68 Favored 'General case' 0 C--N 1.314 -0.954 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.599 -174.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.632 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 43.9 p -66.18 154.72 39.01 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 172.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.628 HG22 ' HG2' ' A' ' 41' ' ' ARG . 21.7 t -50.1 -45.66 23.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 120.488 -0.485 . . . . 0.0 110.453 -176.545 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -66.01 -56.53 11.15 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.648 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.676 ' O ' HG13 ' A' ' 64' ' ' VAL . 0.0 OUTLIER -58.45 -33.42 69.71 Favored 'General case' 0 C--O 1.211 -0.937 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -176.239 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.672 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.7 t -72.68 -33.5 66.57 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.623 -179.264 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -71.45 -36.85 71.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.238 0.542 . . . . 0.0 109.684 173.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.579 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 92.5 mt-10 -59.5 -52.36 65.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.076 -0.966 . . . . 0.0 110.547 175.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.676 HG13 ' O ' ' A' ' 60' ' ' GLN . 19.8 m -71.77 -27.67 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.659 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.523 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.491 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 0.2 OUTLIER -60.52 -49.44 77.55 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 175.382 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -73.88 -32.32 63.54 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.834 -174.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.634 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.2 pt-20 -61.13 -41.86 97.48 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 119.744 -0.783 . . . . 0.0 109.895 -179.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.469 HG22 ' O ' ' A' ' 64' ' ' VAL . 28.6 m -81.07 -37.57 16.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 178.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.418 ' HG1' HD13 ' A' ' 65' ' ' LEU . 97.8 m -78.15 -25.73 47.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.532 -172.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.38 -19.74 63.83 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.426 173.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.401 HG13 ' O ' ' A' ' 67' ' ' GLU . 9.5 mt -80.56 -22.17 11.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.745 177.221 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 112.27 2.08 26.37 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 119.884 -1.15 . . . . 0.0 112.17 -177.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -88.69 126.55 59.39 Favored Pre-proline 0 N--CA 1.448 -0.553 0 O-C-N 122.819 -0.224 . . . . 0.0 110.909 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.731 ' HB2' ' HB3' ' A' ' 46' ' ' GLN . 78.8 Cg_exo -56.64 131.27 44.61 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 123.319 2.68 . . . . 0.0 112.723 176.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.418 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -146.93 155.13 42.04 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 119.154 -1.018 . . . . 0.0 111.641 174.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.43 ' HD3' ' CD2' ' A' ' 44' ' ' PHE . 0.0 OUTLIER -141.26 151.54 43.78 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.772 176.012 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.816 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 37.4 t -145.76 92.76 2.25 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.92 173.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 3.9 p -107.13 166.13 10.85 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 119.812 -0.755 . . . . 0.0 110.956 178.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.547 ' HB2' ' HD3' ' A' ' 41' ' ' ARG . 47.3 t -109.46 105.01 14.18 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.533 -173.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 172.13 151.82 0.07 Allowed 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.72 -1.215 . . . . 0.0 107.72 -179.335 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.694 ' HB3' HD22 ' A' ' 82' ' ' LEU . 62.0 m-20 -57.79 138.97 55.07 Favored 'General case' 0 CA--C 1.512 -0.492 0 C-N-CA 119.429 -0.908 . . . . 0.0 109.764 176.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.694 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 63.85 17.18 10.35 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.065 172.2 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 4.8 t -78.53 -6.7 56.19 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.058 0.456 . . . . 0.0 111.21 -174.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.561 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 29.5 p-10 -103.58 37.69 1.97 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.401 0.62 . . . . 0.0 110.36 178.108 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.81 167.61 13.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.239 179.036 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -66.63 132.67 48.67 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.245 178.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.06 -36.9 40.16 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 179.043 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 . . . . . 0 N--CA 1.471 0.606 0 O-C-N 124.375 1.047 . . . . 0.0 112.535 176.881 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.611 ' O ' ' HB3' ' A' ' 37' ' ' GLU . 26.0 ptm . . . . . 0 N--CA 1.483 1.186 0 CA-C-O 120.63 0.252 . . . . 0.0 110.371 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.456 ' HB1' ' O ' ' A' ' 35' ' ' CYS . . . -77.95 152.57 33.11 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.717 -175.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.8 tp -115.89 142.53 46.65 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 179.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.536 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 28.8 mtmm -110.37 106.13 15.37 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.807 -173.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.458 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 17.2 m -106.23 156.01 18.9 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 175.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.618 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 16.2 m-85 -67.58 115.32 7.04 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.72 175.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.9 m -96.09 133.45 40.33 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.076 -0.712 . . . . 0.0 109.076 171.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.418 ' HE ' ' HA ' ' A' ' 28' ' ' ASP . 22.9 ttt180 -91.63 111.23 22.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.991 0.424 . . . . 0.0 111.627 -175.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -90.87 90.64 8.0 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.329 174.696 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 73.27 -81.93 0.68 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.281 -0.961 . . . . 0.0 111.099 -174.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.418 ' HA ' ' HE ' ' A' ' 25' ' ' ARG . 10.4 t70 -123.84 -41.54 2.23 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 174.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -52.48 140.86 21.46 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.375 -179.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -111.39 111.38 22.38 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 179.195 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -106.8 143.97 34.13 Favored 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 120.329 -0.549 . . . . 0.0 111.464 -169.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.52 HG13 HD11 ' A' ' 82' ' ' LEU . 85.1 t -75.32 106.49 5.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.834 174.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.415 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 32.6 p -122.08 139.22 53.98 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.324 -0.55 . . . . 0.0 110.845 178.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.536 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.8 t -89.12 112.24 23.18 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.18 177.864 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.511 ' HB3' ' OE1' ' A' ' 39' ' ' GLN . 44.9 m -101.45 161.71 13.43 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.833 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -65.67 158.16 28.11 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.563 -0.455 . . . . 0.0 111.251 -175.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.611 ' HB3' ' O ' ' A' ' 18' ' ' MET . 3.4 pt-20 -66.9 -17.45 64.91 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.297 0.57 . . . . 0.0 110.768 177.576 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.565 ' HG2' HG22 ' A' ' 57' ' ' THR . 10.7 tt0 -45.18 -48.01 12.43 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.574 -1.194 . . . . 0.0 108.884 163.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.6 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 41.3 mt-30 -98.06 73.17 2.22 Favored 'General case' 0 N--CA 1.442 -0.846 0 CA-C-N 114.423 -1.262 . . . . 0.0 109.686 -176.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.16 18.56 3.05 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.518 -177.044 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.649 HH21 HG13 ' A' ' 58' ' ' VAL . 1.6 tpp85 -136.38 168.8 18.76 Favored 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 175.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.709 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 21.7 m -129.92 137.51 50.41 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 -178.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.603 ' O ' ' HA ' ' A' ' 53' ' ' GLN . 0.0 OUTLIER -98.83 123.36 43.03 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.529 0.204 . . . . 0.0 110.507 -176.501 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.655 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 50.7 t80 -131.24 105.27 7.55 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.062 171.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.583 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 42.1 t -98.0 138.12 23.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 120.391 -0.524 . . . . 0.0 109.818 177.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.749 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 2.1 mm100 -79.75 139.15 37.39 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 119.666 -0.813 . . . . 0.0 109.303 175.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.727 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.9 mm? -134.14 149.06 70.42 Favored Pre-proline 0 C--N 1.314 -0.942 0 CA-C-N 115.905 -0.589 . . . . 0.0 109.631 178.119 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 47' ' ' LEU . 5.1 Cg_exo -79.9 13.23 2.2 Favored 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.93 2.42 . . . . 0.0 112.134 174.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -138.63 -43.75 0.49 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.079 0.466 . . . . 0.0 110.71 -176.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.727 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 38.8 m -147.72 -156.71 0.74 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 -178.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -139.56 135.88 33.85 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 119.954 -0.698 . . . . 0.0 110.279 176.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.655 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 73.7 mt -89.92 126.62 42.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.546 177.602 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.603 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 17.9 mt-30 -139.74 130.77 26.34 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 175.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -172.52 163.97 5.5 Favored 'General case' 0 C--N 1.33 -0.279 0 O-C-N 123.473 0.483 . . . . 0.0 110.509 -177.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.458 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 73.5 m -87.91 135.85 33.22 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.052 0.453 . . . . 0.0 111.109 -179.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.549 ' HE3' HD12 ' A' ' 43' ' ' LEU . 68.2 mmtt -138.23 157.28 46.59 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.6 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 5.3 p -70.96 152.18 43.88 Favored 'General case' 0 C--N 1.321 -0.673 0 C-N-CA 118.969 -1.092 . . . . 0.0 108.061 173.122 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.649 HG13 HH21 ' A' ' 41' ' ' ARG . 55.4 t -48.67 -51.92 10.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-O 120.648 0.261 . . . . 0.0 110.745 -179.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.558 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 17.6 tt0 -63.26 -55.69 22.75 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.19 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.772 ' O ' HG13 ' A' ' 64' ' ' VAL . 29.3 tt0 -58.24 -37.31 74.65 Favored 'General case' 0 C--O 1.209 -1.052 0 CA-C-N 116.541 -0.299 . . . . 0.0 110.961 -174.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.707 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.7 t -70.94 -32.97 70.03 Favored 'General case' 0 C--N 1.318 -0.779 0 C-N-CA 120.556 -0.458 . . . . 0.0 110.38 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.91 -39.35 87.36 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.197 -0.601 . . . . 0.0 109.93 172.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 20.1 mm-40 -58.68 -52.66 64.73 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.492 176.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.772 HG13 ' O ' ' A' ' 60' ' ' GLN . 7.4 m -69.77 -26.43 30.47 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.705 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.107 -178.63 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.67 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -57.11 -50.47 72.7 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 175.698 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -73.82 -34.68 64.67 Favored 'General case' 0 N--CA 1.446 -0.635 0 C-N-CA 120.215 -0.594 . . . . 0.0 111.98 -174.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.629 ' HG2' ' O ' ' A' ' 64' ' ' VAL . 12.1 pt-20 -59.43 -42.74 92.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 120.018 -0.673 . . . . 0.0 110.17 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.507 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 34.4 m -79.68 -38.51 19.35 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.13 0 CA-C-O 120.738 0.304 . . . . 0.0 111.663 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 54.8 m -74.03 -19.92 60.47 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.83 0.347 . . . . 0.0 111.341 -175.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.23 -23.47 59.17 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.999 0.428 . . . . 0.0 110.181 173.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 67' ' ' GLU . 6.1 mt -83.83 -21.86 8.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 121.355 0.598 . . . . 0.0 109.623 177.295 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.453 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 115.43 9.33 13.09 Favored Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.13 -1.033 . . . . 0.0 112.224 -178.136 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -101.51 107.11 49.79 Favored Pre-proline 0 N--CA 1.45 -0.43 0 CA-C-O 120.739 0.304 . . . . 0.0 110.966 179.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.749 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 52.2 Cg_exo -60.54 137.45 73.88 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 123.116 2.544 . . . . 0.0 112.682 175.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.67 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -138.3 160.13 40.26 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.715 0.293 . . . . 0.0 110.327 174.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.3 mmtp -136.25 114.86 11.92 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.032 -178.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.709 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 39.0 m -114.13 98.48 6.98 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 119.989 -0.684 . . . . 0.0 109.946 173.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 7.9 p -111.13 167.69 10.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.692 -0.231 . . . . 0.0 110.727 -178.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 37.7 m -109.63 106.04 15.56 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.544 -0.462 . . . . 0.0 110.839 -176.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.47 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 23.2 tt0 178.1 153.71 0.32 Allowed 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.733 ' HB3' HD22 ' A' ' 82' ' ' LEU . 49.7 m-20 -65.27 139.32 58.6 Favored 'General case' 0 CA--C 1.507 -0.708 0 C-N-CA 117.919 -1.512 . . . . 0.0 108.738 172.806 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.733 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 61.37 23.72 13.93 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.084 174.556 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . 0.47 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 5.7 t -69.98 -34.26 73.13 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.619 -171.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.581 ' OD1' ' HB3' ' A' ' 42' ' ' CYS . 0.4 OUTLIER -74.95 109.51 8.48 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 118.756 -1.177 . . . . 0.0 109.402 174.623 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.442 ' HG2' ' O ' ' A' ' 83' ' ' CYS . 10.2 ptt180 -155.49 153.6 30.52 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.125 -171.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 2.1 m -64.67 114.49 4.46 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.213 177.266 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -85.01 -17.9 36.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.228 0.537 . . . . 0.0 110.606 -177.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.575 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.873 -179.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 90.0 mtp . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 110.397 -0.223 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.622 ' HA ' ' O ' ' A' ' 35' ' ' CYS . . . 71.45 114.03 0.05 Allowed 'General case' 0 N--CA 1.465 0.325 0 O-C-N 124.338 1.024 . . . . 0.0 112.697 175.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 27.2 tp -109.53 146.33 34.81 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 176.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.667 ' HG2' ' HB ' ' A' ' 34' ' ' THR . 27.6 mtmm -114.61 114.9 26.32 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.244 0.545 . . . . 0.0 112.072 -174.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 17.2 m -129.41 168.58 16.1 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.044 175.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -75.27 132.27 40.93 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.259 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 61.8 m -129.55 135.29 48.41 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 175.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 51.5 ttt180 -84.31 110.44 18.58 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.268 -0.573 . . . . 0.0 110.909 -176.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -91.16 86.5 6.21 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.934 177.267 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 81.02 -81.89 1.58 Allowed Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.213 -0.994 . . . . 0.0 111.315 -174.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -127.24 -51.59 1.41 Allowed 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 176.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -56.91 148.65 20.45 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.212 -0.904 . . . . 0.0 111.214 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.682 ' HD2' ' OE1' ' A' ' 53' ' ' GLN . 77.6 mtm180 -126.04 114.2 18.12 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 120.181 -0.607 . . . . 0.0 110.65 -178.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.8 t -120.09 176.11 5.6 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.852 -178.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 76.9 t -90.08 116.75 32.04 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.498 179.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.489 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 64.4 p -106.76 143.37 34.96 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 120.128 -0.629 . . . . 0.0 110.69 175.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.667 ' HB ' ' HG2' ' A' ' 21' ' ' LYS . 1.5 t -98.43 112.32 24.38 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.479 175.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.622 ' O ' ' HA ' ' A' ' 19' ' ' ALA . 57.9 m -110.54 164.97 12.18 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.241 -172.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.2 -175.98 4.41 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.874 0.694 . . . . 0.0 112.874 -170.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -67.05 -32.6 73.91 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 115.44 -0.8 . . . . 0.0 113.009 -167.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.622 ' CD ' ' H ' ' A' ' 38' ' ' GLU . 1.1 mp0 -55.11 -44.16 74.73 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-O 122.159 0.98 . . . . 0.0 108.619 177.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.721 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 2.2 mm-40 -90.98 49.19 1.61 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 113.694 -1.594 . . . . 0.0 110.411 -172.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.74 3.65 11.3 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.204 0.526 . . . . 0.0 110.906 178.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.621 ' HB3' ' SG ' ' A' ' 77' ' ' CYS . 19.4 mmt85 -120.07 -179.44 3.93 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.704 0.764 . . . . 0.0 109.367 169.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.596 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 35.9 m -144.41 156.1 44.06 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.344 -172.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -114.77 135.62 53.98 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 120.922 0.392 . . . . 0.0 110.247 -177.799 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.572 ' HB3' ' HG3' ' A' ' 76' ' ' LYS . 70.3 t80 -141.73 119.97 12.22 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.36 -0.836 . . . . 0.0 108.984 170.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.624 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 25.3 t -119.43 140.58 42.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.426 -178.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 1.05 HE21 ' HA ' ' A' ' 46' ' ' GLN . 0.0 OUTLIER -84.48 133.33 34.48 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.122 0.487 . . . . 0.0 110.694 176.302 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.687 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.5 mm? -130.24 146.05 59.95 Favored Pre-proline 0 C--N 1.318 -0.799 0 CA-C-N 115.471 -0.786 . . . . 0.0 108.894 176.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -76.15 15.08 1.01 Allowed 'Trans proline' 0 CA--C 1.528 0.212 0 C-N-CA 122.797 2.331 . . . . 0.0 112.193 177.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 89.5 m-85 -143.45 -39.42 0.31 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.633 -176.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.687 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 49.0 m -149.11 -156.83 0.76 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 -179.288 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.416 ' CD ' HH12 ' A' ' 30' ' ' ARG . 22.3 mt-10 -138.65 149.56 45.31 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.091 -0.337 . . . . 0.0 110.091 177.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.686 HG12 HD21 ' A' ' 47' ' ' LEU . 27.9 mm -104.74 129.27 57.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.193 174.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.682 ' OE1' ' HD2' ' A' ' 30' ' ' ARG . 50.9 mt-30 -142.86 131.85 22.99 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.58 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -168.2 160.26 11.51 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 123.556 0.535 . . . . 0.0 111.107 -178.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 64.7 m -78.32 132.63 37.52 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 170.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.406 ' HD3' ' HA ' ' A' ' 56' ' ' LYS . 8.7 tppt? -137.95 135.33 35.94 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 -178.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.721 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 6.1 p -59.09 156.45 11.96 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 119.509 -0.876 . . . . 0.0 109.827 -178.307 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.617 HG22 ' HG2' ' A' ' 41' ' ' ARG . 37.3 t -54.81 -46.63 75.0 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.091 0.472 . . . . 0.0 111.296 -175.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.64 ' HG3' ' N ' ' A' ' 60' ' ' GLN . 8.5 pt20 -65.82 -45.36 82.61 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 120.52 -0.472 . . . . 0.0 110.881 -179.543 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.64 ' N ' ' HG3' ' A' ' 59' ' ' GLN . 70.9 mt-30 -72.87 -26.71 61.55 Favored 'General case' 0 C--O 1.2 -1.528 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.884 -175.404 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.565 ' HA ' HG22 ' A' ' 64' ' ' VAL . 9.1 p -69.43 -33.05 72.39 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 179.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.45 -40.75 73.54 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.097 0.475 . . . . 0.0 109.997 172.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -61.21 -52.01 66.61 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.174 178.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.63 ' HA ' ' HG2' ' A' ' 67' ' ' GLU . 30.6 m -67.77 -29.39 44.95 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.375 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.637 -178.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.523 HD12 ' HB3' ' A' ' 75' ' ' ALA . 18.4 tp -57.81 -50.79 72.08 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.804 176.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -75.25 -32.38 61.07 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 112.774 0.657 . . . . 0.0 112.774 -176.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.63 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -61.1 -46.91 88.7 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.304 -0.558 . . . . 0.0 110.615 -175.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.585 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 27.6 m -79.76 -31.32 13.72 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.194 0 C-N-CA 120.74 -0.384 . . . . 0.0 111.299 -179.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 96.3 m -68.41 -29.06 67.65 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.79 -0.364 . . . . 0.0 110.559 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.76 -22.78 63.32 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.541 175.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 67' ' ' GLU . 20.1 mt -85.1 -20.61 8.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-O 121.337 0.589 . . . . 0.0 109.729 177.654 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 111.2 11.97 16.77 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 120.187 -1.006 . . . . 0.0 112.453 -179.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 55.1 m-85 -106.47 113.39 63.19 Favored Pre-proline 0 N--CA 1.448 -0.559 0 CA-C-O 120.612 0.244 . . . . 0.0 111.212 -179.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.661 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 90.6 Cg_exo -52.36 129.78 33.09 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 123.577 2.851 . . . . 0.0 113.088 177.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.523 ' HB3' HD12 ' A' ' 65' ' ' LEU . . . -132.4 161.21 34.2 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.236 -0.585 . . . . 0.0 111.0 174.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.572 ' HG3' ' HB3' ' A' ' 44' ' ' PHE . 14.9 ptmt -145.2 124.33 12.88 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 121.017 0.437 . . . . 0.0 111.409 175.025 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.621 ' SG ' ' HB3' ' A' ' 41' ' ' ARG . 0.6 OUTLIER -100.44 96.66 7.56 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.602 -0.727 . . . . 0.0 109.122 168.714 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 42.7 t -106.81 152.45 23.85 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.579 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.465 ' HB2' ' CD ' ' A' ' 41' ' ' ARG . 41.9 t -115.22 100.28 8.02 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.334 -178.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.506 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 42.8 tt0 169.68 155.1 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 107.807 -1.183 . . . . 0.0 107.807 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.687 ' HB3' HD22 ' A' ' 82' ' ' LEU . 69.5 m-20 -63.31 135.2 56.88 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 119.038 -1.065 . . . . 0.0 110.001 177.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.687 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 66.72 6.8 4.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.439 -0.8 . . . . 0.0 112.032 170.843 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . 0.506 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 42.6 t -75.88 -13.15 60.26 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 120.336 -0.545 . . . . 0.0 111.387 -175.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.421 ' HB3' ' HB2' ' A' ' 42' ' ' CYS . 19.3 p-10 -88.02 16.81 5.55 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.111 -0.635 . . . . 0.0 110.599 178.672 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.411 ' HG2' ' H ' ' A' ' 86' ' ' SER . 26.0 ttp180 -71.16 161.48 31.04 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 176.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.53 ' HA ' ' CZ ' ' A' ' 44' ' ' PHE . 2.1 p -64.38 139.98 58.82 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.767 0.317 . . . . 0.0 110.977 177.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -63.17 -56.39 17.1 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.174 -178.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 . . . . . 0 C--N 1.323 -0.572 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.22 -178.824 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 26.9 ttt . . . . . 0 N--CA 1.479 0.979 0 N-CA-C 110.425 -0.213 . . . . 0.0 110.425 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -74.5 101.45 4.16 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.924 175.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 26.1 tp -93.5 155.3 17.41 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 177.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.548 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 33.1 mtmm -108.58 106.88 17.16 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 119.63 -0.828 . . . . 0.0 111.632 -179.577 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.581 ' HA ' HD21 ' A' ' 84' ' ' ASN . 8.1 m -110.05 166.26 11.08 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.016 177.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -80.75 132.35 35.52 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 119.929 -0.708 . . . . 0.0 110.415 178.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.1 p -101.97 130.9 48.61 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 171.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 8.2 tpt85 -83.29 109.43 17.25 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.446 -0.502 . . . . 0.0 109.741 -176.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 60.0 m-80 -118.82 90.38 3.32 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.266 -0.424 . . . . 0.0 109.89 -179.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 68.84 -118.54 9.01 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 119.949 -1.119 . . . . 0.0 111.587 -176.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -89.8 -18.76 25.67 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.592 0.234 . . . . 0.0 110.631 179.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -91.57 157.08 17.2 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.442 0.639 . . . . 0.0 111.941 -177.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.477 HH11 ' HD3' ' A' ' 30' ' ' ARG . 1.1 ptt-85 -125.26 113.05 17.12 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 169.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.9 m -97.14 133.48 41.73 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.615 -168.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 95.5 t -72.72 106.84 3.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 173.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 21' ' ' LYS . 12.1 p -122.3 138.36 54.53 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 120.557 -0.457 . . . . 0.0 111.513 -177.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.548 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 1.9 t -77.66 115.92 17.79 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 173.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 3.2 m -89.17 178.21 6.42 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.709 -170.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -69.5 161.04 30.31 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.072 0.463 . . . . 0.0 112.181 -174.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.9 mm-40 -56.45 -33.32 65.79 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.265 -0.88 . . . . 0.0 112.791 -177.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -74.25 -29.57 61.75 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.133 0.492 . . . . 0.0 111.093 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.521 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 22.7 mt-30 -83.96 90.4 7.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.457 0.646 . . . . 0.0 110.114 -172.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.496 ' OG1' HG23 ' A' ' 58' ' ' VAL . 0.8 OUTLIER -102.48 14.5 31.8 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.52 -176.658 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.635 ' HD3' HG22 ' A' ' 58' ' ' VAL . 1.6 tpt180 -135.11 172.44 13.0 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 121.168 0.509 . . . . 0.0 109.724 175.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.599 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 70.1 m -131.0 131.64 44.49 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.511 -0.768 . . . . 0.0 108.943 179.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.525 ' HB3' ' HG2' ' A' ' 54' ' ' GLU . 0.7 OUTLIER -96.33 123.71 40.07 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.059 -177.151 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.529 ' HD2' ' HG3' ' A' ' 76' ' ' LYS . 71.9 t80 -131.64 109.37 10.16 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.992 -0.549 . . . . 0.0 109.853 170.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.651 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 39.9 t -99.42 134.22 39.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 172.044 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 1.049 ' HB3' ' HB2' ' A' ' 74' ' ' PRO . 1.9 tp-100 -93.4 114.78 27.28 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.856 -175.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' A' ' 50' ' ' SER . 3.6 mm? -107.8 156.71 37.59 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.909 -179.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_exo -70.9 14.93 0.32 Allowed 'Trans proline' 0 CA--C 1.535 0.562 0 C-N-CA 123.23 2.62 . . . . 0.0 114.019 -176.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -171.02 -30.94 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.879 -178.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.543 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 23.8 p -124.31 -168.4 1.79 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.828 179.015 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HG3' ' OG ' ' A' ' 86' ' ' SER . 0.1 OUTLIER -150.48 149.73 30.37 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 119.584 -0.846 . . . . 0.0 111.285 178.118 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.651 ' HB ' ' HB ' ' A' ' 45' ' ' VAL . 25.9 mm -98.78 129.49 49.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.548 -0.751 . . . . 0.0 109.777 175.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.423 ' OE1' ' HD3' ' A' ' 30' ' ' ARG . 48.5 mt-30 -140.31 130.25 24.69 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 119.811 -0.756 . . . . 0.0 110.565 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.525 ' HG2' ' HB3' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -163.4 163.86 24.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.733 -179.189 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.571 ' O ' ' HD2' ' A' ' 56' ' ' LYS . 3.3 m -94.86 126.43 40.18 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.474 -0.935 . . . . 0.0 108.474 168.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.571 ' HD2' ' O ' ' A' ' 55' ' ' CYS . 14.0 mptt -128.05 170.86 12.43 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 119.926 -0.71 . . . . 0.0 109.144 175.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 30.9 p -80.68 159.63 25.23 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 118.471 -1.292 . . . . 0.0 107.96 174.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.635 HG22 ' HD3' ' A' ' 41' ' ' ARG . 83.4 t -55.3 -43.75 72.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 119.862 -0.735 . . . . 0.0 110.53 -179.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -66.54 -56.74 9.41 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 120.459 -0.496 . . . . 0.0 111.053 -178.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.697 ' O ' HG13 ' A' ' 64' ' ' VAL . 74.5 mt-30 -56.44 -44.38 80.38 Favored 'General case' 0 C--O 1.207 -1.178 0 O-C-N 123.456 0.473 . . . . 0.0 110.21 -177.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.732 ' HA ' HG22 ' A' ' 64' ' ' VAL . 0.5 OUTLIER -66.35 -31.6 72.48 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 120.368 -0.533 . . . . 0.0 110.852 -178.108 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -69.78 -41.18 75.45 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.189 -0.604 . . . . 0.0 110.141 173.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.489 ' OE1' ' HA ' ' A' ' 60' ' ' GLN . 45.3 mt-10 -56.32 -53.33 58.53 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.981 0.896 . . . . 0.0 110.655 175.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.732 HG22 ' HA ' ' A' ' 61' ' ' CYS . 5.7 m -72.73 -26.36 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.735 0 CA-C-N 114.532 -1.213 . . . . 0.0 111.081 -178.251 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.585 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 19.8 tp -56.85 -47.71 79.74 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 176.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.544 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 38.7 tt0 -73.98 -37.63 64.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.799 -0.637 . . . . 0.0 112.462 -176.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.633 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.7 pt-20 -58.3 -43.74 88.24 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 120.255 -0.578 . . . . 0.0 110.611 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.53 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 29.9 m -79.66 -31.75 14.08 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 C-N-CA 120.599 -0.44 . . . . 0.0 112.06 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.544 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 21.0 p -73.87 -26.27 60.47 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.105 -178.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.87 -20.21 63.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.183 0.515 . . . . 0.0 110.493 176.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 67' ' ' GLU . 22.6 mt -82.07 -19.6 10.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.605 176.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 108.65 1.84 32.56 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.18 -1.01 . . . . 0.0 112.398 179.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.417 ' HA ' ' HD3' ' A' ' 74' ' ' PRO . 49.5 m-85 -87.43 134.53 35.97 Favored Pre-proline 0 N--CA 1.45 -0.469 0 CA-C-O 120.787 0.327 . . . . 0.0 111.385 -178.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 1.049 ' HB2' ' HB3' ' A' ' 46' ' ' GLN . 54.4 Cg_exo -59.55 130.82 37.16 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 123.394 2.729 . . . . 0.0 111.897 175.163 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -147.03 151.23 36.59 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.2 -0.6 . . . . 0.0 111.508 178.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.529 ' HG3' ' HD2' ' A' ' 44' ' ' PHE . 1.1 ptmt -151.01 119.57 6.48 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.549 179.312 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.599 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 65.7 m -113.57 97.97 6.77 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.358 -0.537 . . . . 0.0 109.893 168.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 3.5 p -108.46 157.42 18.45 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.069 177.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.453 ' HB2' ' HD2' ' A' ' 41' ' ' ARG . 14.5 t -108.42 100.95 10.17 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.354 -175.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 79' ' ' CYS . 3.0 mm-40 178.9 151.01 0.3 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 179.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.653 ' HB3' HD22 ' A' ' 82' ' ' LEU . 70.0 m-20 -63.02 135.9 57.52 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 118.819 -1.152 . . . . 0.0 109.772 178.722 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.653 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 65.51 10.08 6.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.583 171.636 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . . . . . . . . . 42.7 t -69.65 -20.69 63.58 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.726 0.774 . . . . 0.0 110.313 -179.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.581 HD21 ' HA ' ' A' ' 22' ' ' CYS . 6.0 p30 -82.22 20.34 1.06 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.366 178.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 22.2 ttp180 -57.54 138.06 55.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.49 -0.777 . . . . 0.0 111.302 178.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.492 ' OG ' ' HG3' ' A' ' 51' ' ' GLU . 3.0 m -80.95 107.17 13.54 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.068 176.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -90.66 -27.54 18.96 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.483 -0.487 . . . . 0.0 110.903 178.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 19.3 mm-40 . . . . . 0 C--N 1.325 -0.483 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.282 179.08 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.479 1.015 0 N-CA-C 110.378 -0.231 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 63.22 92.12 0.07 Allowed 'General case' 0 N--CA 1.464 0.275 0 O-C-N 123.92 0.763 . . . . 0.0 110.739 -173.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 25.7 tp -90.64 156.04 18.41 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 -176.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.518 ' HB3' HG12 ' A' ' 32' ' ' VAL . 23.0 mtpp -115.33 101.17 8.68 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 119.219 -0.992 . . . . 0.0 111.867 178.63 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.402 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 8.4 m -100.71 158.38 15.99 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 173.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -76.37 142.21 41.24 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.35 -0.54 . . . . 0.0 109.779 174.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 88.9 m -133.64 129.57 37.06 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 173.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.623 ' NH1' ' HA ' ' A' ' 28' ' ' ASP . 16.5 mtm180 -91.66 114.38 26.89 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 119.576 -0.85 . . . . 0.0 112.223 -173.698 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.4 t30 -79.29 86.39 5.04 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.341 172.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 71.48 -108.86 2.62 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 119.173 -1.489 . . . . 0.0 109.909 -168.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.623 ' HA ' ' NH1' ' A' ' 25' ' ' ARG . 10.4 m-20 -109.07 -7.18 15.38 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.289 -0.564 . . . . 0.0 110.433 172.446 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -69.63 152.86 44.23 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.511 173.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.5 mtt-85 -126.16 113.36 16.92 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 119.376 -0.93 . . . . 0.0 111.073 -175.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.2 m -115.29 139.24 50.14 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.065 -178.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.518 HG12 ' HB3' ' A' ' 21' ' ' LYS . 6.3 t -88.6 104.59 14.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 C-N-CA 119.789 -0.764 . . . . 0.0 109.846 177.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.2 p -87.61 150.24 23.79 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.858 -173.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.7 t -90.15 112.25 23.68 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 171.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -102.1 140.87 35.8 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.894 0.378 . . . . 0.0 110.499 -173.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -72.44 172.23 10.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.258 -171.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -56.19 -38.53 71.08 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.107 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.445 ' HG3' ' H ' ' A' ' 39' ' ' GLN . 3.2 pt-20 -52.07 -46.13 65.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.793 175.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.656 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 38.2 mt-30 -103.07 72.54 1.18 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.237 -177.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.09 15.57 11.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.302 -179.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.696 ' HG2' ' SG ' ' A' ' 61' ' ' CYS . 1.7 tpt180 -119.68 171.13 8.6 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.299 -0.56 . . . . 0.0 109.494 173.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.73 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 56.3 m -130.42 131.0 45.02 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.504 -179.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.541 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.7 OUTLIER -94.95 130.73 41.47 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.835 0.35 . . . . 0.0 110.507 -176.596 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.623 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 54.4 t80 -143.69 119.23 10.36 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.468 174.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.404 HG23 ' CD2' ' A' ' 43' ' ' LEU . 57.5 t -122.49 138.8 51.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 110.118 -0.327 . . . . 0.0 110.118 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.848 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 7.1 mm100 -75.58 142.0 42.8 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 120.71 -0.396 . . . . 0.0 110.663 178.421 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.639 HD21 HG13 ' A' ' 52' ' ' ILE . 3.4 mm? -130.55 158.57 74.22 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 169.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -76.27 13.82 1.26 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.761 2.308 . . . . 0.0 112.39 176.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -140.43 -54.48 0.51 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.467 0.651 . . . . 0.0 109.69 -179.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.608 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 6.7 p -137.83 -151.5 0.39 Allowed 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.675 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.549 ' HA ' HD23 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -147.14 161.01 41.74 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.297 176.347 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.639 HG13 HD21 ' A' ' 47' ' ' LEU . 67.3 mt -92.92 133.96 32.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.524 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -135.1 130.51 35.62 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 120.345 -0.542 . . . . 0.0 109.544 176.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -169.99 162.24 9.07 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.06 177.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.402 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 4.4 m -86.81 140.8 29.33 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 170.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.541 ' HE3' HD12 ' A' ' 43' ' ' LEU . 5.0 tppt? -143.72 153.3 42.3 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.136 -0.626 . . . . 0.0 109.647 -178.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.656 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 29.3 p -69.45 142.82 53.72 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 176.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.684 HG22 ' HD3' ' A' ' 41' ' ' ARG . 39.9 t -54.96 -35.97 36.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-O 121.079 0.466 . . . . 0.0 110.794 -176.348 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.458 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 13.2 tt0 -69.1 -56.55 7.37 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.548 179.463 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.821 ' HA ' HE21 ' A' ' 60' ' ' GLN . 0.0 OUTLIER -67.55 -29.32 68.67 Favored 'General case' 0 C--O 1.209 -1.053 0 C-N-CA 120.309 -0.556 . . . . 0.0 110.615 -175.543 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.696 ' SG ' ' HG2' ' A' ' 41' ' ' ARG . 2.5 p -67.25 -32.93 74.29 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.57 -0.452 . . . . 0.0 110.148 178.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.13 -44.79 75.32 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 173.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 49.6 mm-40 -53.74 -53.14 56.44 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.769 177.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.641 HG22 ' HA ' ' A' ' 61' ' ' CYS . 16.1 m -73.31 -26.84 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.626 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.315 -177.3 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.643 ' HB2' ' O ' ' A' ' 61' ' ' CYS . 4.3 tp -62.67 -50.9 69.34 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.609 ' HA ' ' OG1' ' A' ' 69' ' ' THR . 49.1 mt-10 -76.05 -29.61 58.09 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -176.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.625 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 11.3 pt-20 -61.94 -45.17 94.87 Favored 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.095 179.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.569 ' N ' ' HG3' ' A' ' 67' ' ' GLU . 34.4 m -80.29 -31.06 12.86 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.609 ' OG1' ' HA ' ' A' ' 66' ' ' GLU . 15.7 p -71.15 -28.35 64.2 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.857 -179.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.76 -21.26 63.45 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.453 175.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 67' ' ' GLU . 28.4 mt -84.71 -26.37 6.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.794 176.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.428 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 121.33 -1.91 11.42 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.111 -1.042 . . . . 0.0 112.507 -179.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -88.19 112.77 51.7 Favored Pre-proline 0 N--CA 1.451 -0.38 0 CA-C-O 120.516 0.198 . . . . 0.0 111.099 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.848 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 32.4 Cg_exo -62.91 130.96 30.97 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 122.997 2.464 . . . . 0.0 112.059 176.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -145.19 155.19 43.12 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.35 -178.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -148.03 131.67 16.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.575 177.348 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.73 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 24.4 p -119.29 102.24 8.56 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.537 0.684 . . . . 0.0 109.723 165.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 2.5 p -107.49 163.46 13.04 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.298 178.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 7.1 p -108.55 101.33 10.5 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.53 -0.468 . . . . 0.0 110.405 -175.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.543 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 24.3 tt0 177.84 146.44 0.13 Allowed 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 -177.254 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.65 ' HB3' HD22 ' A' ' 82' ' ' LEU . 17.6 m-20 -60.47 138.15 58.05 Favored 'General case' 0 CA--C 1.506 -0.723 0 C-N-CA 119.471 -0.892 . . . . 0.0 109.793 177.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.65 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 63.13 18.58 11.06 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.664 173.613 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . 0.543 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 12.1 t -75.03 -23.95 58.23 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.096 0.474 . . . . 0.0 111.299 -173.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.566 ' HB2' ' HB2' ' A' ' 44' ' ' PHE . 29.6 p-10 -85.07 31.41 0.55 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.589 0.709 . . . . 0.0 109.951 177.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 85' ' ' ARG . 9.5 ptt-85 -70.19 162.2 28.82 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.708 -1.133 . . . . 0.0 109.714 173.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.492 ' HA ' ' CE1' ' A' ' 44' ' ' PHE . 32.2 t -90.42 113.81 25.81 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.879 0.371 . . . . 0.0 110.486 179.498 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -100.95 9.19 42.56 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.618 176.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 . . . . . 0 C--N 1.326 -0.451 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.697 -177.001 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' MET . . . . . 0.53 ' O ' ' HB3' ' A' ' 37' ' ' GLU . 16.8 ptm . . . . . 0 N--CA 1.484 1.265 0 CA-C-O 121.228 0.537 . . . . 0.0 111.228 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.551 ' HB1' ' O ' ' A' ' 35' ' ' CYS . . . -81.58 160.12 23.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.62 -174.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.0 tp -121.12 143.9 48.85 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -178.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.556 ' HG2' ' HA ' ' A' ' 34' ' ' THR . 30.8 mtmm -106.44 113.32 26.77 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.911 -0.315 . . . . 0.0 111.181 -177.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.605 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 34.7 m -116.47 138.11 51.64 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.226 -0.59 . . . . 0.0 109.729 178.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.661 ' CE2' ' HB3' ' A' ' 82' ' ' LEU . 11.8 m-85 -57.23 105.6 0.25 Allowed 'General case' 0 N--CA 1.465 0.309 0 O-C-N 123.118 0.261 . . . . 0.0 111.333 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 24.1 m -91.37 129.03 37.41 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 175.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.43 ' HD2' ' HA ' ' A' ' 28' ' ' ASP . 12.9 ttp180 -90.49 110.57 21.68 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 119.768 -0.773 . . . . 0.0 111.196 -175.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -93.56 96.79 10.08 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.094 176.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 76.34 -79.25 1.22 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 119.467 -1.349 . . . . 0.0 110.219 -171.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.43 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 14.0 t70 -146.4 -21.83 0.43 Allowed 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 168.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -55.77 132.78 50.15 Favored 'General case' 0 CA--C 1.516 -0.34 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 171.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -114.48 111.26 21.13 Favored 'General case' 0 C--N 1.313 -1.022 0 C-N-CA 119.16 -1.016 . . . . 0.0 109.131 -178.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.8 m -99.41 147.17 25.52 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.282 -170.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.528 HG13 HD11 ' A' ' 82' ' ' LEU . 58.0 t -78.07 105.67 7.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 172.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 12.5 p -125.09 140.21 53.09 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 120.07 -0.652 . . . . 0.0 111.172 179.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.556 ' HA ' ' HG2' ' A' ' 21' ' ' LYS . 2.2 t -88.39 111.67 22.02 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.637 176.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . 0.551 ' O ' ' HB1' ' A' ' 19' ' ' ALA . 81.7 m -95.57 161.3 14.11 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.685 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.72 153.9 27.0 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.838 -0.345 . . . . 0.0 111.234 -175.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.53 ' HB3' ' O ' ' A' ' 18' ' ' MET . 2.7 pt-20 -66.84 -19.95 65.84 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 121.365 0.602 . . . . 0.0 110.914 178.006 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.593 ' HG2' HG22 ' A' ' 57' ' ' THR . 8.4 tt0 -46.72 -44.82 19.1 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.588 -1.187 . . . . 0.0 109.178 164.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.671 ' HA ' ' HA ' ' A' ' 57' ' ' THR . 2.1 mt-30 -99.14 70.73 1.79 Allowed 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.541 -1.208 . . . . 0.0 109.567 -176.298 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.74 14.87 4.27 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.472 -0.786 . . . . 0.0 112.211 -173.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.668 ' CG ' ' HA ' ' A' ' 58' ' ' VAL . 13.6 mmt85 -131.77 177.4 7.55 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.374 0.606 . . . . 0.0 109.993 172.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.67 ' O ' ' HA ' ' A' ' 77' ' ' CYS . 8.6 m -133.56 139.56 46.65 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.085 -0.961 . . . . 0.0 108.68 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.568 HD12 ' HE3' ' A' ' 56' ' ' LYS . 0.0 OUTLIER -99.33 122.99 43.24 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.717 0.294 . . . . 0.0 110.341 -177.035 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.663 ' HA ' ' O ' ' A' ' 52' ' ' ILE . 56.3 t80 -131.7 107.28 8.69 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.953 171.229 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.563 ' HB ' ' HB ' ' A' ' 52' ' ' ILE . 43.9 t -102.62 138.65 26.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 C-N-CA 120.411 -0.516 . . . . 0.0 109.681 177.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.772 ' HG2' ' HB2' ' A' ' 74' ' ' PRO . 3.7 mm100 -77.9 139.27 39.22 Favored 'General case' 0 CA--C 1.519 -0.236 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 176.009 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.666 ' HB2' ' O ' ' A' ' 50' ' ' SER . 4.1 mm? -135.03 153.0 78.2 Favored Pre-proline 0 C--N 1.317 -0.846 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.896 178.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -87.77 8.75 4.07 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.463 2.109 . . . . 0.0 112.221 174.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -133.92 -24.8 1.67 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.967 0.413 . . . . 0.0 110.95 -179.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.666 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 68.0 m -162.31 -157.83 0.49 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 -175.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.402 ' HB3' ' HE1' ' A' ' 44' ' ' PHE . 49.5 mt-10 -140.81 135.92 31.92 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.328 -0.619 . . . . 0.0 109.328 172.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.663 ' O ' ' HA ' ' A' ' 44' ' ' PHE . 59.6 mt -88.96 127.05 41.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.621 178.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.474 ' HA ' ' O ' ' A' ' 43' ' ' LEU . 24.2 mt-30 -139.35 130.46 26.55 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 123.499 0.499 . . . . 0.0 109.917 177.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -173.4 172.32 3.76 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.671 0.607 . . . . 0.0 110.198 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.605 ' SG ' ' HB2' ' A' ' 22' ' ' CYS . 34.7 m -98.82 138.24 36.25 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.893 -0.323 . . . . 0.0 110.683 179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.568 ' HE3' HD12 ' A' ' 43' ' ' LEU . 66.0 mmtt -137.66 156.05 48.46 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.671 ' HA ' ' HA ' ' A' ' 39' ' ' GLN . 7.8 p -69.77 152.74 44.26 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 172.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.668 ' HA ' ' CG ' ' A' ' 41' ' ' ARG . 40.3 t -49.7 -55.33 5.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.799 0.333 . . . . 0.0 110.513 -176.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.581 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 39.0 tt0 -61.82 -55.14 33.02 Favored 'General case' 0 C--O 1.217 -0.624 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.371 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.787 ' O ' HG13 ' A' ' 64' ' ' VAL . 3.8 tt0 -54.46 -38.84 66.83 Favored 'General case' 0 C--O 1.206 -1.197 0 O-C-N 123.11 0.256 . . . . 0.0 111.202 -175.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.655 ' HA ' HG22 ' A' ' 64' ' ' VAL . 2.4 t -69.68 -32.8 71.62 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 120.069 -0.652 . . . . 0.0 110.382 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.8 -39.35 87.73 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.038 171.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 59' ' ' GLN . 14.5 mm-40 -57.79 -52.54 65.05 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-O 121.96 0.886 . . . . 0.0 110.217 176.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.787 HG13 ' O ' ' A' ' 60' ' ' GLN . 4.7 m -69.83 -26.41 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.759 0 CA-C-N 114.591 -1.186 . . . . 0.0 111.053 -178.669 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.697 HD13 ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -55.75 -49.36 73.32 Favored 'General case' 0 N--CA 1.449 -0.5 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 174.787 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -73.26 -36.39 66.36 Favored 'General case' 0 C--N 1.323 -0.579 0 C-N-CA 120.535 -0.466 . . . . 0.0 112.102 -174.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.645 ' HG2' ' HA ' ' A' ' 64' ' ' VAL . 12.3 pt-20 -59.41 -43.35 93.05 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 120.267 -0.573 . . . . 0.0 110.292 -179.205 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.517 HG22 ' O ' ' A' ' 64' ' ' VAL . 34.6 m -79.37 -34.95 16.57 Favored 'Isoleucine or valine' 0 C--O 1.231 0.096 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.488 -179.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 95.7 m -74.67 -20.54 59.83 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.971 0.415 . . . . 0.0 110.882 -176.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.3 -23.34 57.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.021 0.439 . . . . 0.0 110.015 173.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 67' ' ' GLU . 14.3 mt -82.8 -25.86 8.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.723 176.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.46 ' O ' ' HD3' ' A' ' 74' ' ' PRO . . . 115.52 7.67 15.66 Favored Glycine 0 N--CA 1.448 -0.532 0 C-N-CA 120.279 -0.962 . . . . 0.0 112.017 -178.256 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -101.03 106.21 43.22 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-O 120.701 0.286 . . . . 0.0 111.063 -179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.772 ' HB2' ' HG2' ' A' ' 46' ' ' GLN . 74.8 Cg_exo -57.2 130.63 40.47 Favored 'Trans proline' 0 N--CA 1.471 0.173 0 C-N-CA 123.383 2.722 . . . . 0.0 113.043 177.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.697 ' HB3' HD13 ' A' ' 65' ' ' LEU . . . -126.16 159.32 33.23 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.33 -0.548 . . . . 0.0 111.034 175.107 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.2 mmtp -135.46 120.98 19.31 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.836 -178.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.67 ' HA ' ' O ' ' A' ' 42' ' ' CYS . 70.1 m -123.27 92.45 3.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.178 0.513 . . . . 0.0 110.721 177.642 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' CYS . . . . . . . . . . . . . 5.7 p -110.29 159.87 17.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.763 -176.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 41.8 t -109.71 102.79 11.57 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.373 -0.531 . . . . 0.0 110.04 -178.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.544 ' HB3' ' HB2' ' A' ' 83' ' ' CYS . 9.9 tt0 -175.02 146.99 0.9 Allowed 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.181 -1.415 . . . . 0.0 107.181 -178.279 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.734 ' HB3' HD22 ' A' ' 82' ' ' LEU . 58.2 m-20 -63.78 135.18 56.43 Favored 'General case' 0 CA--C 1.504 -0.818 0 C-N-CA 117.878 -1.529 . . . . 0.0 109.313 177.031 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.734 HD22 ' HB3' ' A' ' 81' ' ' ASP . 0.2 OUTLIER 64.76 20.37 12.11 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.166 174.116 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' CYS . . . . . 0.544 ' HB2' ' HB3' ' A' ' 80' ' ' GLU . 8.7 t -65.24 -45.78 83.24 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.397 -173.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.506 HD22 ' N ' ' A' ' 84' ' ' ASN . 0.0 OUTLIER -70.79 110.37 5.53 Favored 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 119.517 -0.873 . . . . 0.0 109.443 174.738 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 83' ' ' CYS . 4.8 ptt180 -151.36 171.29 17.72 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.65 -172.145 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 17.6 m -55.96 121.84 10.21 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 123.885 0.74 . . . . 0.0 111.297 -179.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -118.26 -56.91 2.12 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.059 179.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.303 -178.615 . . . . . . . . 1 1 . 1 stop_ save_