data_2l4w_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 2l4w _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 ' 53' ' ' TYR . . . . . . . . . . . . . 23.1 t80 . . . . . 0 N--CA 1.455 -0.18 0 CA-C-O 120.753 0.311 . . . . 10.0 110.703 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.6 m -85.41 119.03 25.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.219 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -88.64 113.34 24.11 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.022 -0.733 . . . . 10.0 109.022 179.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -153.73 158.57 41.17 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.018 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.85 139.08 44.81 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.817 -0.809 . . . . 10.0 108.817 178.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.2 p -126.23 161.82 49.8 Favored Pre-proline 0 C--N 1.319 -0.725 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.353 -177.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -75.53 12.33 1.38 Allowed 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 121.93 1.754 . . . . 10.0 112.326 179.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 16.2 ptt? -111.27 -17.17 13.23 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.426 0.528 . . . . 10.0 112.426 -179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.17 -61.67 1.87 Allowed 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.17 -0.612 . . . . 10.0 110.669 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.18 -53.59 2.49 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.731 -0.747 . . . . 10.0 112.019 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.421 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 61.8 p -126.78 166.44 17.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.727 0.298 . . . . 10.0 111.058 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 62.6 tp -56.23 -45.35 79.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.815 -0.63 . . . . 10.0 111.168 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -56.48 -54.57 44.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.646 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.89 -35.99 78.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.586 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 50.5 ttp -64.03 -50.5 68.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.367 -0.378 . . . . 10.0 110.218 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 71.3 mt -64.76 -34.75 79.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.248 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -60.0 -50.02 75.4 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.163 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -66.43 -40.69 89.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.235 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 31.3 m0 -57.64 -54.3 48.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.152 0.501 . . . . 10.0 110.829 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.92 -42.4 81.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.699 -0.682 . . . . 10.0 111.944 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.42 -40.56 78.6 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.564 0.579 . . . . 10.0 112.564 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -60.5 -39.33 87.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.905 0.383 . . . . 10.0 111.415 -179.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.7 m -97.78 11.98 35.4 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.36 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 m120 56.06 39.96 30.35 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.532 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 5.2 mtm -102.88 164.09 11.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.783 -0.644 . . . . 10.0 109.488 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 -96.82 157.86 15.7 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.565 -0.288 . . . . 10.0 110.953 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 34.0 tp -128.74 138.06 51.91 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.194 0.521 . . . . 10.0 110.649 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.24 96.16 4.98 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.121 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.502 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 16.4 t80 -95.45 98.83 10.84 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.708 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -101.77 37.87 1.74 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.858 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.502 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 44.2 mt -106.01 142.15 24.24 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -61.04 -30.31 89.33 Favored 'Trans proline' 0 CA--C 1.529 0.23 0 C-N-CA 122.764 2.31 . . . . 10.0 113.313 -179.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.2 m -145.69 166.85 24.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.893 0.378 . . . . 10.0 111.494 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.38 124.97 39.68 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.214 -0.662 . . . . 10.0 109.214 179.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -110.27 156.7 20.33 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.554 0.216 . . . . 10.0 110.714 -178.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.421 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.8 OUTLIER -79.99 177.02 9.22 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.727 179.574 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.98 134.54 41.45 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.7 pt -65.87 -28.8 44.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 112.517 0.562 . . . . 10.0 112.517 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 138.03 -62.72 0.57 Allowed Glycine 0 CA--C 1.52 0.36 0 C-N-CA 120.296 -0.954 . . . . 10.0 113.618 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.86 7.99 1.47 Allowed 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.534 2.156 . . . . 10.0 113.151 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.9 t -69.41 -45.63 78.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.939 0.4 . . . . 10.0 110.658 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -13.75 60.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.593 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.68 1.8 47.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.031 0.443 . . . . 10.0 110.875 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 46.6 mt -107.62 107.2 22.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.181 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.4 97.61 4.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.048 0.451 . . . . 10.0 111.128 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.2 t -130.74 155.95 45.78 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.711 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.12 -6.26 55.6 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.235 0.541 . . . . 10.0 110.816 179.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 19.4 t -98.46 116.24 30.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.287 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.15 -31.63 54.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.186 0.517 . . . . 10.0 110.059 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -68.12 -43.47 78.33 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.798 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.6 tp60 -67.77 -41.21 83.63 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.286 -0.416 . . . . 10.0 110.343 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.96 -49.15 72.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.413 179.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.16 -36.95 85.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.461 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 98.9 m -63.37 -43.81 96.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.824 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -70.78 -41.36 71.81 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.454 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.0 mp -61.92 -51.17 69.22 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.91 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.7 p -58.31 -25.52 61.96 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.172 0.434 . . . . 10.0 112.172 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.36 -43.65 66.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.029 0.443 . . . . 10.0 111.149 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 10.5 p -87.56 -24.5 6.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.203 0.525 . . . . 10.0 111.291 -179.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -79.79 -24.28 41.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.795 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -51.28 -36.43 42.27 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.438 -0.346 . . . . 10.0 111.643 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.65 -27.09 68.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.959 0.409 . . . . 10.0 111.664 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -91.97 -11.98 34.61 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.715 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 130' ' ' PRO . . . 93.45 27.46 13.13 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.622 -0.799 . . . . 10.0 112.107 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 57.8 t -124.53 125.67 70.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.798 0.332 . . . . 10.0 111.076 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.4 m -122.67 113.87 19.82 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.188 178.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 16.4 m -105.39 142.33 18.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.801 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 41.6 m -152.46 166.27 32.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.015 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.467 HG23 ' CD2' ' A' ' 126' ' ' LEU . 3.5 t -117.73 128.4 74.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 110.111 -0.329 . . . . 10.0 110.111 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.6 m -147.6 120.86 8.94 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.728 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 61.68 43.13 10.11 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 123.636 0.585 . . . . 10.0 111.559 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 19.1 m120 62.33 26.61 15.91 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.727 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -130.31 132.8 46.04 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.61 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.467 ' CD2' HG23 ' A' ' 121' ' ' VAL . 97.4 mt -88.61 122.72 32.36 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 108.62 -0.882 . . . . 10.0 108.62 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -112.79 122.76 48.59 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.331 0.586 . . . . 10.0 111.234 -178.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.2 t -108.17 119.21 57.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.269 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -128.45 138.49 33.16 Favored Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 110.032 -0.358 . . . . 10.0 110.032 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.406 ' HA ' ' O ' ' A' ' 116' ' ' GLY . 69.4 Cg_endo -77.96 135.02 13.66 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 121.98 1.786 . . . . 10.0 111.855 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 3.2 m . . . . . 0 C--N 1.319 -0.727 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.347 179.521 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 29.0 t80 . . . . . 0 C--O 1.234 0.241 0 CA-C-O 120.924 0.392 . . . . 10.0 110.313 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 30.4 m -75.36 121.29 22.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.831 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -86.47 116.54 24.68 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.408 -0.814 . . . . 10.0 109.088 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -145.85 147.74 32.13 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.187 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.513 ' HB1' ' SD ' ' A' ' 67' ' ' MET . . . -74.77 112.14 10.68 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.733 -0.469 . . . . 10.0 109.733 178.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.403 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 26.2 p -107.55 157.26 36.21 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.799 -179.143 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.403 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 37.3 Cg_endo -65.99 -11.21 30.03 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.348 2.032 . . . . 10.0 111.255 178.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 51.3 mtt -77.74 -29.42 51.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.64 -0.709 . . . . 10.0 109.891 179.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -75.88 -51.67 12.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.221 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 81.2 -63.14 4.37 Favored Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.478 -0.783 . . . . 10.0 113.64 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 43.8 p -113.1 169.33 9.01 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.881 0.372 . . . . 10.0 111.67 -178.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 66.9 tp -63.46 -47.42 81.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.64 -0.709 . . . . 10.0 111.227 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 34.1 ttmt -56.11 -55.99 26.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.222 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.0 m -61.37 -32.45 72.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.845 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.513 ' SD ' ' HB1' ' A' ' 57' ' ' ALA . 55.9 ttp -68.99 -51.19 41.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.938 0.399 . . . . 10.0 110.35 179.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.1 mt -62.35 -35.66 79.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.703 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -61.44 -40.94 96.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.558 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -68.66 -40.55 80.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.278 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 43.7 m0 -64.13 -50.01 69.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.447 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.474 ' HB3' HD11 ' A' ' 126' ' ' LEU . . . -60.48 -37.14 80.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.199 179.376 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.45 -34.71 77.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.567 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.06 -41.32 95.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.331 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.76 7.69 45.59 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.33 0.492 . . . . 10.0 112.33 -177.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 60.72 53.22 4.04 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.59 0.71 . . . . 10.0 109.856 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.478 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 22.0 mtm -124.43 171.22 10.12 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.831 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -106.24 171.11 7.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.468 -0.333 . . . . 10.0 110.585 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.3 tp -133.27 133.53 42.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.149 0.5 . . . . 10.0 111.578 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -119.24 95.9 4.99 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.467 -0.788 . . . . 10.0 109.506 178.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.451 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 6.7 t80 -88.98 98.52 11.8 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.697 -0.683 . . . . 10.0 109.394 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 64.3 m-80 -101.81 37.09 1.9 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.283 0.563 . . . . 10.0 110.898 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.409 HD13 ' CZ ' ' A' ' 81' ' ' TYR . 33.7 mt -101.21 145.44 30.44 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.816 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -62.35 -40.29 41.06 Favored 'Trans proline' 0 N--CA 1.464 -0.232 0 C-N-CA 122.617 2.211 . . . . 10.0 111.531 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -138.72 141.85 38.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.727 -0.669 . . . . 10.0 110.083 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.451 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 15.1 t70 -78.56 131.31 36.72 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.741 -0.466 . . . . 10.0 109.741 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -100.58 148.19 25.09 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.111 0.482 . . . . 10.0 111.532 -178.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.9 m -81.84 147.52 29.31 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.494 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.31 123.81 14.02 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 121.097 0.475 . . . . 10.0 111.372 179.345 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.2 pt -80.99 -164.28 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.508 -0.769 . . . . 10.0 110.733 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -77.18 -68.84 1.46 Allowed Glycine 0 CA--C 1.522 0.511 0 C-N-CA 120.836 -0.697 . . . . 10.0 113.304 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -56.96 -14.55 14.55 Favored 'Trans proline' 0 N--CA 1.477 0.517 0 C-N-CA 123.592 2.861 . . . . 10.0 115.267 -178.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.6 p -68.93 -40.49 81.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.303 0.573 . . . . 10.0 110.406 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 2.1 m -67.82 -12.52 60.78 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.556 -0.747 . . . . 10.0 111.379 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.06 1.84 56.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.298 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 54.4 mt -96.69 111.39 26.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.254 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.7 m -130.11 100.67 5.5 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.675 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 15.4 t -129.72 155.46 45.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.785 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.64 10.09 38.0 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.085 0.402 . . . . 10.0 112.085 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.6 t -125.55 127.49 46.47 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.679 0.276 . . . . 10.0 110.71 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 6.0 p -66.4 -28.59 43.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.252 0.548 . . . . 10.0 110.249 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -70.72 -44.83 66.08 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.565 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -66.63 -38.62 87.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.871 -0.604 . . . . 10.0 109.902 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.6 -50.42 72.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.864 179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.48 -29.93 71.13 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.265 0.555 . . . . 10.0 110.551 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 36.9 m -69.03 -50.85 44.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.67 -0.695 . . . . 10.0 110.972 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -67.73 -36.96 81.53 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.055 -0.52 . . . . 10.0 111.652 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 26.7 mt -59.51 -50.01 75.57 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.704 0.288 . . . . 10.0 110.814 179.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.6 m -60.52 -27.76 67.87 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.356 -0.384 . . . . 10.0 111.937 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.89 -41.67 77.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.825 0.345 . . . . 10.0 111.144 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.8 p -87.48 -35.55 8.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.037 0.446 . . . . 10.0 111.585 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.425 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 4.0 m-30 -71.49 -22.19 61.83 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -178.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -55.39 -22.61 20.55 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.614 0.245 . . . . 10.0 111.334 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.07 -31.04 71.69 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.958 0.409 . . . . 10.0 110.615 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -94.46 -24.11 17.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.314 0.578 . . . . 10.0 109.964 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 106.77 34.37 3.06 Favored Glycine 0 N--CA 1.444 -0.77 0 CA-C-N 115.613 -0.721 . . . . 10.0 112.484 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.425 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 75.8 t -124.44 135.96 62.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.743 0.306 . . . . 10.0 110.298 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.1 m -136.1 132.22 35.82 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.108 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 7.5 m -120.73 149.29 23.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.275 0.56 . . . . 10.0 111.87 -178.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 58.3 m -155.21 154.45 32.26 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.668 179.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 1.7 p -110.83 119.55 59.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.981 0.419 . . . . 10.0 109.896 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.0 m -137.14 128.47 28.14 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.221 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 58.49 43.6 19.21 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 123.692 0.62 . . . . 10.0 111.447 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.478 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 9.8 m-20 58.27 39.28 25.8 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.902 0.858 . . . . 10.0 110.193 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 69.5 tttt -145.3 128.94 17.14 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.892 -1.049 . . . . 10.0 109.239 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.474 HD11 ' HB3' ' A' ' 72' ' ' ALA . 20.7 mt -88.01 121.73 30.76 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 108.265 -1.013 . . . . 10.0 108.265 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.38 123.93 51.23 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.163 0.506 . . . . 10.0 111.428 -178.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.414 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 2.9 t -102.11 120.82 52.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.223 179.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -129.91 133.33 24.88 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.112 -179.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.23 131.9 9.99 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.113 1.875 . . . . 10.0 111.993 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 4.5 m . . . . . 0 C--N 1.318 -0.803 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.18 179.929 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 32.9 t80 . . . . . 0 N--CA 1.453 -0.316 0 CA-C-O 121.017 0.437 . . . . 10.0 110.815 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.1 m -82.63 120.85 26.08 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.682 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -86.81 113.14 22.38 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.11 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -152.07 151.39 31.04 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.476 -0.783 . . . . 10.0 109.721 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -85.33 125.84 33.26 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.889 -0.412 . . . . 10.0 109.889 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.7 p -105.31 149.56 37.88 Favored Pre-proline 0 C--N 1.321 -0.646 0 C-N-CA 120.885 -0.326 . . . . 10.0 110.704 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -64.69 -12.29 33.15 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.643 2.228 . . . . 10.0 111.951 179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 40.1 mtt -85.25 -14.15 47.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.456 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -78.77 -48.64 14.47 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.259 -0.645 . . . . 10.0 109.259 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.58 -64.18 4.34 Favored Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.324 -0.853 . . . . 10.0 113.612 178.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 28.0 p -113.3 168.4 9.76 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 112.212 0.449 . . . . 10.0 112.212 -178.057 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 47.2 tp -66.01 -43.21 88.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.723 -0.671 . . . . 10.0 111.797 -179.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -55.25 -54.43 43.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.978 0.418 . . . . 10.0 110.42 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.1 m -64.75 -38.99 92.85 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.712 -0.676 . . . . 10.0 111.52 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -61.89 -48.4 80.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.976 0.417 . . . . 10.0 111.164 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 57.6 mt -68.12 -31.35 70.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.319 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -62.24 -42.17 99.08 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.728 -0.471 . . . . 10.0 109.728 179.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.475 ' O ' ' HB2' ' A' ' 74' ' ' ASP . 17.1 mmm-85 -60.6 -42.57 97.04 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.214 178.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 37.1 m0 -60.13 -55.29 35.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.59 -0.732 . . . . 10.0 111.07 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.49 -47.37 84.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.907 -179.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.46 -35.75 80.29 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -178.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 70' ' ' ARG . 0.4 OUTLIER -73.4 -23.97 60.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.756 0.312 . . . . 10.0 111.805 -179.211 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.4 t -108.63 7.15 26.45 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.854 -0.339 . . . . 10.0 111.555 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 65.2 t30 62.18 38.84 13.33 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.606 0.717 . . . . 10.0 110.374 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 68.3 mtp -111.08 173.6 6.26 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.219 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 88.6 mm-40 -108.15 158.72 17.18 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.531 -0.304 . . . . 10.0 110.252 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.7 tp -133.07 136.91 46.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.984 0.421 . . . . 10.0 110.891 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.57 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 3.9 m -124.12 97.64 5.43 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.709 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.531 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 4.6 t80 -86.06 97.41 10.28 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.742 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -104.65 29.35 6.25 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.943 0.401 . . . . 10.0 111.03 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.531 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 57.4 mt -89.12 146.87 37.23 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.45 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -57.64 -35.85 98.7 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.637 2.225 . . . . 10.0 111.856 179.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.0 m -151.31 155.98 39.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.904 -0.589 . . . . 10.0 109.924 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.4 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 37.7 t0 -77.84 130.83 37.14 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.603 -0.518 . . . . 10.0 109.603 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -104.73 140.04 38.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.03 0.443 . . . . 10.0 111.349 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 2.9 m -81.27 149.04 29.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.34 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.28 112.81 1.18 Allowed 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.872 0.368 . . . . 10.0 110.817 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 11.0 pt -65.19 -36.72 78.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.862 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 149.36 -71.5 0.3 Allowed Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.38 -0.914 . . . . 10.0 113.335 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -50.78 -17.74 3.47 Favored 'Trans proline' 0 N--CA 1.48 0.694 0 C-N-CA 123.775 2.984 . . . . 10.0 113.832 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -60.91 -37.26 76.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.118 0.485 . . . . 10.0 110.882 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.0 -9.08 57.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.494 -179.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -92.11 -0.93 57.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.164 0.507 . . . . 10.0 110.561 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 56.7 mt -100.34 116.39 43.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.962 -0.563 . . . . 10.0 109.525 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -142.49 95.48 2.8 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.736 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 11.9 t -130.91 154.32 48.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.449 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.02 -13.9 43.1 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.223 -0.444 . . . . 10.0 111.117 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.0 m -91.65 116.1 28.6 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.358 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.6 p -60.82 -36.48 71.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.351 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -67.56 -38.06 83.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.125 0.488 . . . . 10.0 109.893 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -67.35 -42.63 83.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.885 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.62 -47.73 81.37 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.348 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.31 -34.05 76.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.482 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 81.8 m -68.58 -50.91 48.13 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.078 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -64.04 -40.77 97.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.3 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.1 mp -63.56 -49.28 74.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.581 -0.281 . . . . 10.0 110.513 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.4 m -61.38 -29.19 69.76 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.499 0.185 . . . . 10.0 111.499 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.15 -42.39 98.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.906 0.384 . . . . 10.0 110.785 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.6 p -88.61 -37.67 10.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.38 0.61 . . . . 10.0 111.245 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.536 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.5 m-30 -72.65 -23.13 60.86 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 113.994 1.109 . . . . 10.0 113.994 -177.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.29 -36.93 33.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.568 0.223 . . . . 10.0 111.216 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.95 -32.23 70.38 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.948 0.404 . . . . 10.0 110.534 179.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -79.92 -9.85 59.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.439 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . 0.414 ' O ' ' HA ' ' A' ' 130' ' ' PRO . . . 89.28 26.77 24.87 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.827 -0.624 . . . . 10.0 112.33 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.536 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 76.3 t -125.28 129.67 73.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.986 0.422 . . . . 10.0 111.053 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 8.0 t -127.46 113.07 15.7 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.288 -0.634 . . . . 10.0 109.288 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 2.6 m -102.28 135.72 37.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.168 0.509 . . . . 10.0 110.564 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -147.43 141.1 25.6 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.857 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 2.4 p -106.09 124.18 61.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-O 121.249 0.547 . . . . 10.0 109.68 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 64.5 m -142.47 123.12 14.18 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.72 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.4 51.33 5.39 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.811 -0.631 . . . . 10.0 111.48 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.6 m-20 57.41 28.87 16.04 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.815 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.57 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 50.5 tttt -136.29 131.82 34.91 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.321 -0.4 . . . . 10.0 109.991 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 37.7 mt -88.08 120.96 29.93 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.824 -0.806 . . . . 10.0 108.824 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -107.32 115.42 30.13 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.381 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 2.2 t -100.64 116.57 44.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 107.834 -1.173 . . . . 10.0 107.834 177.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -122.47 131.51 24.38 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 116.484 -0.325 . . . . 10.0 110.916 -177.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . 0.414 ' HA ' ' O ' ' A' ' 116' ' ' GLY . 73.8 Cg_endo -79.07 131.85 10.13 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.122 1.881 . . . . 10.0 111.496 178.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 8.5 m . . . . . 0 C--N 1.317 -0.847 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.424 -179.919 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 16.4 t80 . . . . . 0 N--CA 1.452 -0.351 0 CA-C-O 120.831 0.348 . . . . 10.0 111.08 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.0 m -81.0 106.22 12.84 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.819 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -77.46 100.11 5.89 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.24 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.44 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 3.0 tt0 -141.86 142.35 33.11 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.98 -1.009 . . . . 10.0 110.223 -178.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.444 ' HB2' ' HA ' ' A' ' 94' ' ' SER . . . -74.96 122.09 22.94 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.149 -0.685 . . . . 10.0 109.149 178.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 22.1 p -94.33 141.37 23.45 Favored Pre-proline 0 C--N 1.318 -0.802 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.723 -179.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -70.26 0.72 5.61 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 122.63 2.22 . . . . 10.0 112.104 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 60.9 mtt -104.71 -6.3 20.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.737 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.527 ' OD1' ' HB ' ' A' ' 66' ' ' THR . 10.9 t70 -72.47 -69.57 0.4 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.831 0.348 . . . . 10.0 110.827 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . 0.465 ' O ' HG21 ' A' ' 88' ' ' THR . . . 113.09 -42.35 1.98 Allowed Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.485 -0.865 . . . . 10.0 114.008 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.444 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 72.0 p -135.99 168.64 18.97 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 118.454 1.127 . . . . 10.0 113.664 -177.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 60.2 tp -69.67 -48.29 60.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.048 -0.978 . . . . 10.0 111.121 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.54 ' HD3' ' CD1' ' A' ' 81' ' ' TYR . 25.6 tptp -58.37 -50.16 74.64 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.82 -0.627 . . . . 10.0 111.293 -178.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.527 ' HB ' ' OD1' ' A' ' 61' ' ' ASP . 62.8 m -60.48 -40.77 92.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.705 0.288 . . . . 10.0 110.906 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 47.7 ttp -61.55 -48.04 82.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.951 0.405 . . . . 10.0 110.213 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 79.6 mt -63.87 -37.53 87.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.496 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -62.04 -44.03 97.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.561 178.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.83 -43.89 97.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.392 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 44.4 m0 -63.76 -50.79 67.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.461 -0.79 . . . . 10.0 111.078 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.41 -47.86 80.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.561 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.25 -41.38 88.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.693 0.282 . . . . 10.0 111.427 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -64.96 -37.57 88.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.951 0.405 . . . . 10.0 111.366 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 7.4 p -91.04 5.59 48.28 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.642 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 63.1 t30 60.47 32.73 20.59 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.629 0.728 . . . . 10.0 110.219 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.441 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 17.4 mtm -107.08 168.57 9.11 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.42 -179.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -98.46 165.87 11.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.488 -0.324 . . . . 10.0 110.206 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 24.4 tp -133.86 131.23 38.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.123 0.487 . . . . 10.0 111.335 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -116.6 97.1 5.82 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.509 179.138 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.588 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 25.2 t80 -92.07 98.05 11.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.641 -0.708 . . . . 10.0 110.421 -179.034 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -101.23 20.95 14.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.907 0.384 . . . . 10.0 111.122 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.588 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 31.4 mt -80.94 143.21 53.07 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.036 179.532 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -57.3 -45.4 35.15 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.674 2.249 . . . . 10.0 112.448 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.1 m -135.93 168.26 19.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.982 0.42 . . . . 10.0 110.884 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.425 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 0.4 OUTLIER -79.57 135.03 36.5 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.593 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -115.62 162.89 16.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.878 0.37 . . . . 10.0 111.153 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.465 HG21 ' O ' ' A' ' 62' ' ' GLY . 1.2 p -108.37 172.61 6.74 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.658 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.48 114.51 14.11 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.4 pt -62.41 -37.37 78.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.685 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 155.24 -71.73 0.26 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.551 -0.833 . . . . 10.0 112.805 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.33 -2.13 1.21 Allowed 'Trans proline' 0 N--CA 1.481 0.782 0 C-N-CA 123.649 2.899 . . . . 10.0 113.922 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.3 t -65.8 -44.12 93.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.892 0.377 . . . . 10.0 110.451 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.444 ' HA ' ' HB2' ' A' ' 57' ' ' ALA . 0.7 OUTLIER -65.17 -8.96 19.45 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.028 -0.533 . . . . 10.0 112.053 179.421 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.67 -10.95 54.95 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.063 0.459 . . . . 10.0 110.496 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.44 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 23.8 mt -90.16 107.56 18.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -136.21 91.96 2.73 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.029 0.443 . . . . 10.0 111.088 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.0 t -132.33 155.76 47.81 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.58 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -90.75 -5.63 55.45 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.285 0.564 . . . . 10.0 110.567 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.6 t -95.67 115.58 27.63 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 13.9 p -64.1 -30.07 49.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.896 0.379 . . . . 10.0 110.405 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -68.71 -43.17 76.57 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.678 178.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -65.3 -42.62 92.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.989 178.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.66 -50.48 73.02 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.846 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.61 -35.2 77.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.235 0.54 . . . . 10.0 110.357 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 99.4 m -66.01 -49.72 66.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.74 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -63.32 -40.57 97.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.487 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 83.5 mt -61.33 -49.86 75.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.568 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.2 m -59.29 -27.7 66.09 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.48 -42.57 78.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.972 0.415 . . . . 10.0 111.232 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -87.98 -29.6 5.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.971 0.415 . . . . 10.0 111.874 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.52 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.6 m-30 -81.07 -22.69 39.04 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 114.0 1.111 . . . . 10.0 114.0 -177.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.27 -30.23 11.37 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 111.74 0.274 . . . . 10.0 111.74 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.76 -39.6 73.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.056 0.455 . . . . 10.0 110.739 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 -74.91 -24.09 58.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.112 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . 0.421 ' HA2' HG23 ' A' ' 131' ' ' VAL . . . 103.86 35.11 3.57 Favored Glycine 0 N--CA 1.445 -0.739 0 CA-C-N 115.515 -0.766 . . . . 10.0 112.381 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.52 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 94.8 t -131.35 129.54 62.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.08 0.467 . . . . 10.0 111.116 -179.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.1 m -130.0 118.84 22.21 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.455 ' CG1' HG11 ' A' ' 128' ' ' VAL . 9.2 m -112.44 136.83 47.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.224 0.535 . . . . 10.0 112.04 -177.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 73.1 m -145.0 140.12 27.94 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.798 -0.637 . . . . 10.0 109.723 179.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 2.5 p -102.05 128.83 54.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.856 -0.424 . . . . 10.0 109.856 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.1 m -151.12 130.88 13.18 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.223 -0.444 . . . . 10.0 111.06 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 59.33 45.63 13.71 Favored 'General case' 0 C--O 1.235 0.298 0 O-C-N 123.684 0.615 . . . . 10.0 111.842 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.441 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 92.4 m-20 59.7 33.85 21.97 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.505 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.94 131.44 27.02 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.26 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 18.6 mt -89.53 120.97 31.3 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 107.587 -1.264 . . . . 10.0 107.587 177.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.86 119.91 40.95 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.306 0.574 . . . . 10.0 111.179 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.455 HG11 ' CG1' ' A' ' 119' ' ' VAL . 3.2 t -106.42 118.57 54.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-N 115.246 -0.888 . . . . 10.0 108.827 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -131.17 138.3 32.59 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-O 120.768 0.318 . . . . 10.0 110.782 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.49 138.71 13.95 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.2 1.933 . . . . 10.0 111.68 178.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.421 HG23 ' HA2' ' A' ' 116' ' ' GLY . 0.2 OUTLIER . . . . . 0 C--N 1.321 -0.665 0 N-CA-C 110.041 -0.355 . . . . 10.0 110.041 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 29.1 t80 . . . . . 0 N--CA 1.453 -0.324 0 CA-C-O 120.766 0.317 . . . . 10.0 110.762 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.9 m -75.1 110.93 9.83 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 121.194 0.521 . . . . 10.0 110.233 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -89.31 98.87 12.01 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.188 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -134.56 147.14 50.2 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.006 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.77 121.0 21.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.74 0.305 . . . . 10.0 110.418 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.408 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 81.3 p -107.1 158.47 32.89 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.354 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.408 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 50.6 Cg_endo -68.54 -4.14 12.46 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.286 1.991 . . . . 10.0 112.036 179.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 61.6 mtt -92.28 -18.66 23.08 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.825 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -73.12 -55.64 6.2 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.419 0.628 . . . . 10.0 109.686 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 88.71 -64.21 3.46 Favored Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.595 -0.73 . . . . 10.0 113.347 178.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.49 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 15.7 p -117.57 165.59 13.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.04 0.447 . . . . 10.0 112.088 -178.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 55.0 tp -57.89 -42.32 84.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.118 -0.946 . . . . 10.0 110.565 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 69' ' ' GLU . 58.0 tttt -60.89 -57.84 10.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.847 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.18 -38.38 73.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.165 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 51.7 ttp -63.52 -51.67 64.51 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.628 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 98.6 mt -64.2 -36.96 85.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.091 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 51.9 mt-10 -63.5 -38.86 92.76 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.206 0.526 . . . . 10.0 110.087 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? -71.65 -32.13 67.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.216 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 38.6 m0 -70.98 -55.12 9.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.754 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.05 -28.5 69.64 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.711 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.13 -35.57 81.2 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.024 0.379 . . . . 10.0 112.024 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -68.79 -37.81 79.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.86 0.362 . . . . 10.0 111.195 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.426 ' HB2' ' HG3' ' A' ' 77' ' ' MET . 0.1 OUTLIER -95.29 6.77 48.13 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.471 -179.284 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 63.9 t30 55.58 46.7 22.36 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.591 0.71 . . . . 10.0 110.577 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.426 ' HG3' ' HB2' ' A' ' 75' ' ' SER . 22.1 mtm -111.1 165.67 11.7 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.324 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -98.81 154.47 17.98 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.32 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.9 tp -124.72 131.42 53.46 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.312 0.577 . . . . 10.0 110.5 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 61.8 m -113.03 96.21 5.82 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.104 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.497 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 15.9 t80 -91.31 98.47 11.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.695 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -101.37 30.76 4.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.98 0.419 . . . . 10.0 111.175 -179.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.497 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 43.8 mt -97.43 146.96 32.28 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.048 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -56.43 -41.63 74.13 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.943 2.429 . . . . 10.0 112.633 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 30.4 m -143.45 167.6 21.8 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.697 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.467 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 12.5 p-10 -83.9 129.04 34.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.012 -0.54 . . . . 10.0 109.636 179.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -105.27 136.98 43.79 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.775 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.49 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 1.3 p -76.09 155.4 34.77 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.999 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.74 116.43 3.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.511 -0.313 . . . . 10.0 110.179 178.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.2 pt -63.06 -33.88 63.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.711 -179.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 142.73 -67.48 0.46 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.471 -0.871 . . . . 10.0 113.157 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.71 -2.93 1.22 Allowed 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.838 3.025 . . . . 10.0 114.137 -179.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.7 -36.74 75.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.299 0.571 . . . . 10.0 110.274 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 22.8 m -72.64 -9.04 58.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.825 -0.625 . . . . 10.0 111.559 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.22 -1.35 56.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.499 0.666 . . . . 10.0 109.917 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 19.6 mt -106.07 105.56 18.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.261 -0.881 . . . . 10.0 109.931 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -124.95 89.59 3.09 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.148 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.9 t -121.98 153.78 38.08 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.969 0.414 . . . . 10.0 111.089 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -92.94 -7.22 46.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.722 179.321 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.1 m -103.78 116.66 32.71 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.022 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.1 p -60.59 -32.5 51.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.712 -0.222 . . . . 10.0 111.352 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -67.1 -40.79 86.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.857 0.36 . . . . 10.0 110.176 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -65.06 -41.2 95.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.11 -0.495 . . . . 10.0 109.939 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.42 -51.45 66.83 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.581 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.51 -32.47 73.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.197 0.522 . . . . 10.0 110.813 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 88.3 m -66.83 -49.21 66.49 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.575 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -69.73 -37.23 76.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.947 -0.57 . . . . 10.0 111.353 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.4 mp -61.47 -49.41 76.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.962 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.479 ' O ' ' HB2' ' A' ' 113' ' ' ALA . 20.0 m -59.22 -30.28 68.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.556 -0.293 . . . . 10.0 111.706 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.73 -47.05 79.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.901 0.381 . . . . 10.0 111.178 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.9 p -82.26 -35.89 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.139 0.495 . . . . 10.0 111.339 -179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.418 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.3 m-30 -72.06 -23.9 61.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.934 -0.575 . . . . 10.0 112.469 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 109' ' ' SER . . . -51.27 -31.33 20.77 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.892 0.33 . . . . 10.0 111.892 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.81 -20.9 57.84 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.144 0.497 . . . . 10.0 111.268 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 6.0 mm100 -94.69 -7.98 39.13 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.416 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 90.57 24.82 27.28 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-N 115.686 -0.688 . . . . 10.0 112.364 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.418 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 56.1 t -126.43 141.89 44.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.751 0.31 . . . . 10.0 111.0 -179.258 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 29.2 m -141.61 138.88 32.89 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 9.0 m -127.92 152.93 36.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.191 0.52 . . . . 10.0 111.872 -178.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.0 m -154.01 158.82 41.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.237 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.499 HG21 ' CD2' ' A' ' 126' ' ' LEU . 5.5 t -113.42 114.86 48.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.538 -0.912 . . . . 10.0 108.538 178.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 13.7 m -132.34 116.03 16.35 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.597 -0.274 . . . . 10.0 111.124 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.45 51.68 5.12 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.848 -0.614 . . . . 10.0 111.121 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.8 m120 54.95 38.09 29.89 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.05 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -141.5 132.14 25.56 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.509 -0.769 . . . . 10.0 109.164 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.499 ' CD2' HG21 ' A' ' 121' ' ' VAL . 89.8 mt -88.96 121.61 31.49 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 109.303 -0.629 . . . . 10.0 109.303 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -108.03 115.76 30.72 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.947 -179.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.8 t -102.98 118.65 50.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 N-CA-C 108.321 -0.992 . . . . 10.0 108.321 178.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -133.78 138.4 30.82 Favored Pre-proline 0 C--N 1.317 -0.809 0 CA-C-O 120.841 0.353 . . . . 10.0 110.539 -178.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.06 146.39 25.56 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.212 1.942 . . . . 10.0 111.683 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.322 -0.617 0 N-CA-C 109.736 -0.468 . . . . 10.0 109.736 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.9 t80 . . . . . 0 N--CA 1.452 -0.371 0 CA-C-O 120.705 0.288 . . . . 10.0 110.719 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 60.4 m -72.66 113.8 10.1 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.216 0.531 . . . . 10.0 109.959 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -81.14 114.0 19.68 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.091 -0.959 . . . . 10.0 109.627 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -148.17 154.68 40.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.185 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.55 107.82 14.62 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.702 -0.481 . . . . 10.0 109.702 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.444 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 21.4 p -100.1 158.21 32.44 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.96 -178.64 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.444 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 40.5 Cg_endo -66.6 -8.43 21.0 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.904 2.403 . . . . 10.0 112.421 179.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 26.4 mmt -90.97 -7.62 51.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.035 0.445 . . . . 10.0 110.507 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -87.9 -58.78 2.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.391 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.31 -58.4 4.91 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.418 -0.896 . . . . 10.0 113.275 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.472 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 28.9 p -121.49 168.16 12.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.044 0.449 . . . . 10.0 111.801 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 59.4 tp -61.81 -37.41 84.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.251 -0.886 . . . . 10.0 110.712 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -61.7 -55.12 33.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.198 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.26 -41.96 90.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.074 0.464 . . . . 10.0 111.109 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 47.8 ttp -61.0 -53.2 60.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.811 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 87.6 mt -63.67 -36.23 83.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.029 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.426 ' OE2' HD23 ' A' ' 79' ' ' LEU . 44.2 mm-40 -59.29 -44.86 92.46 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.985 -0.376 . . . . 10.0 109.985 178.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -63.81 -45.29 90.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.36 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 42.8 m0 -57.41 -49.08 77.37 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.54 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.87 -50.01 58.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.446 -0.797 . . . . 10.0 111.761 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.29 -45.55 87.73 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.273 0.471 . . . . 10.0 112.273 -178.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -64.17 -35.68 81.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.026 0.441 . . . . 10.0 111.237 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.6 m -90.67 5.14 49.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.044 -0.525 . . . . 10.0 111.57 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 59.75 41.4 18.37 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.093 0.473 . . . . 10.0 111.218 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.467 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 24.0 mtm -117.94 173.18 6.92 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.655 -0.702 . . . . 10.0 109.913 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -105.13 161.0 14.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.626 -0.261 . . . . 10.0 110.795 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.426 HD23 ' OE2' ' A' ' 69' ' ' GLU . 20.1 tp -132.15 134.61 45.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.375 0.607 . . . . 10.0 111.22 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 19.7 m -118.57 96.14 5.15 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.054 -0.975 . . . . 10.0 110.07 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.448 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 17.8 t80 -89.96 97.78 11.39 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.128 -0.693 . . . . 10.0 109.128 179.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -107.19 48.44 0.84 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.556 0.693 . . . . 10.0 110.53 -179.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.448 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 38.5 mt -108.31 153.96 41.66 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.206 -0.906 . . . . 10.0 109.329 179.258 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -59.33 -38.19 86.21 Favored 'Trans proline' 0 CA--C 1.529 0.239 0 C-N-CA 122.568 2.179 . . . . 10.0 112.465 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.8 m -152.15 169.67 21.86 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.08 -0.341 . . . . 10.0 110.08 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.419 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 7.7 p-10 -78.4 143.51 36.74 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.816 -0.439 . . . . 10.0 109.816 178.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -121.15 138.72 54.07 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.466 -0.334 . . . . 10.0 111.017 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.472 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.7 OUTLIER -81.61 158.93 24.18 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.394 179.301 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.62 133.77 55.37 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.047 -0.353 . . . . 10.0 110.047 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.0 pt -78.35 -29.82 15.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 112.437 0.532 . . . . 10.0 112.437 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 144.34 -64.92 0.46 Allowed Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.043 -1.075 . . . . 10.0 113.74 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -68.16 6.78 0.76 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 123.227 2.618 . . . . 10.0 113.762 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.9 t -76.88 -38.23 28.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.105 0.479 . . . . 10.0 110.115 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 41.8 m -67.69 -15.72 63.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.141 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -79.71 -9.83 59.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.149 0.499 . . . . 10.0 110.329 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 28.8 mt -94.78 113.51 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.8 m -139.13 93.89 2.74 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.93 -179.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 15.3 t -131.21 155.67 46.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.481 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.88 -6.34 54.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.169 0.509 . . . . 10.0 111.101 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.4 m -100.68 114.95 29.12 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.559 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.1 p -62.37 -30.92 50.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.183 -178.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -68.17 -40.85 82.17 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -67.03 -39.38 86.98 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.359 -0.608 . . . . 10.0 109.359 178.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.18 -50.33 74.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.266 178.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.63 -33.54 74.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.15 0.5 . . . . 10.0 110.396 179.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 97.8 m -64.5 -50.61 66.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.404 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -66.03 -44.15 85.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.85 -0.613 . . . . 10.0 110.173 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -54.2 -54.24 42.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.633 -0.712 . . . . 10.0 110.953 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.7 m -62.06 -34.71 76.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.415 -0.357 . . . . 10.0 111.74 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.73 -37.1 80.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.151 0.501 . . . . 10.0 111.133 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 16.0 t -87.87 -49.29 14.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.2 0.524 . . . . 10.0 111.023 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.434 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.4 m-30 -62.25 -23.89 66.94 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.598 0.962 . . . . 10.0 113.598 -178.09 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -54.96 -22.99 16.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.743 0.306 . . . . 10.0 111.14 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.06 -37.36 75.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.133 0.492 . . . . 10.0 110.474 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 -85.62 -23.1 27.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.46 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . 0.403 ' HA2' HG22 ' A' ' 131' ' ' VAL . . . 107.54 30.73 3.96 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.63 -0.795 . . . . 10.0 113.034 179.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.434 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 86.9 t -125.09 135.5 63.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.776 0.322 . . . . 10.0 110.5 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 5.2 m -131.38 132.18 44.22 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.222 -0.444 . . . . 10.0 109.891 178.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 11.7 m -122.77 140.97 44.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.052 -178.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.0 m -145.41 163.47 34.52 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.408 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 3.3 t -118.59 127.75 75.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.551 -0.536 . . . . 10.0 109.551 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 20.3 m -145.58 119.33 9.23 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.7 -0.227 . . . . 10.0 111.061 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 58.39 48.6 12.07 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.206 0.602 . . . . 10.0 112.146 179.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.467 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 89.3 m-20 60.1 38.33 20.51 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.804 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -145.85 135.35 23.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.718 -0.674 . . . . 10.0 109.58 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 75.2 mt -92.27 123.34 35.53 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.189 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -106.38 116.9 32.73 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.297 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.9 t -105.73 119.67 55.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 179.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -134.78 140.14 34.39 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.824 -178.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -80.44 140.41 13.49 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 122.235 1.956 . . . . 10.0 111.275 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . 0.403 HG22 ' HA2' ' A' ' 116' ' ' GLY . 3.9 m . . . . . 0 C--N 1.323 -0.574 0 C-N-CA 120.96 -0.296 . . . . 10.0 110.935 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 27.2 t80 . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 110.199 -0.297 . . . . 10.0 110.199 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 13.2 m -77.24 123.11 26.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.495 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -92.15 117.4 29.82 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -158.61 165.61 34.05 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.595 -179.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.56 124.48 28.2 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.717 -0.846 . . . . 10.0 108.717 177.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.41 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 44.8 p -104.86 163.48 17.1 Favored Pre-proline 0 C--N 1.313 -0.982 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.748 -178.097 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.41 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 95.6 Cg_endo -80.53 12.26 2.63 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 121.787 1.658 . . . . 10.0 112.074 178.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 21.4 ptm -112.32 -18.35 12.52 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.76 -62.89 1.19 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.835 0.35 . . . . 10.0 111.517 -179.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.0 -49.37 1.4 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.511 -0.852 . . . . 10.0 112.129 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 32.5 p -130.74 168.92 16.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 117.028 0.414 . . . . 10.0 110.511 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 59.8 tp -57.49 -44.77 85.23 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.271 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -59.23 -53.49 57.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.835 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -33.32 71.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.482 -0.326 . . . . 10.0 111.677 -179.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 51.3 ttp -69.23 -49.96 51.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.101 0.477 . . . . 10.0 110.042 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.4 mt -65.11 -33.9 77.12 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.655 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -61.34 -39.77 91.79 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 178.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -65.89 -42.14 90.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.005 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 43.0 m0 -62.46 -51.85 65.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.174 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.0 -44.99 94.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.57 -0.741 . . . . 10.0 111.838 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.02 -47.83 84.6 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 111.796 0.295 . . . . 10.0 111.796 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.04 -20.23 62.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.912 0.387 . . . . 10.0 111.36 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.5 t -96.93 -1.81 45.0 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.317 -0.402 . . . . 10.0 110.738 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 9.8 m120 60.44 41.39 16.03 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.525 0.679 . . . . 10.0 110.172 -179.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 26.8 mtm -121.17 168.82 11.16 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.303 -0.862 . . . . 10.0 110.453 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -98.42 160.52 14.23 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.084 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 34.5 tp -129.44 134.15 47.68 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.78 0.324 . . . . 10.0 110.577 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.459 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 0.5 OUTLIER -121.14 97.37 5.49 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.027 179.157 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.563 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 20.6 t80 -84.12 98.22 9.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.556 -0.747 . . . . 10.0 109.587 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.509 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 84.8 m-20 -100.38 37.54 1.66 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.073 0.463 . . . . 10.0 110.462 -179.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.563 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 26.6 mt -103.42 150.83 38.4 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 116.062 -0.517 . . . . 10.0 109.868 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -64.65 -34.48 51.25 Favored 'Trans proline' 0 CA--C 1.531 0.326 0 C-N-CA 122.579 2.186 . . . . 10.0 112.939 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.9 m -148.05 172.68 13.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.666 0.27 . . . . 10.0 110.752 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -83.88 130.99 34.9 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.273 -0.64 . . . . 10.0 109.273 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -114.78 149.84 36.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.964 0.411 . . . . 10.0 111.309 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.96 169.46 11.2 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.219 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.62 129.7 38.21 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 178.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 pt -67.1 -28.55 43.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 112.084 0.401 . . . . 10.0 112.084 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 145.8 -70.75 0.36 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.525 -0.845 . . . . 10.0 112.905 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.92 5.14 0.68 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.237 2.625 . . . . 10.0 113.435 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 3.8 t -67.68 -39.23 81.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.034 0.445 . . . . 10.0 110.185 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 9.1 m -68.19 -11.06 58.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.375 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -88.77 -6.68 57.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.889 0.376 . . . . 10.0 110.628 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 42.1 mt -93.93 107.52 19.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 N-CA-C 109.156 -0.683 . . . . 10.0 109.156 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.0 m -141.17 104.74 4.69 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.4 t -132.42 157.2 45.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.107 -0.497 . . . . 10.0 109.785 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.78 -11.71 47.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.848 0.356 . . . . 10.0 111.613 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.6 m -98.38 118.57 35.34 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.212 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.46 -32.69 54.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.748 0.309 . . . . 10.0 111.342 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -66.93 -43.2 83.88 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -66.91 -40.31 87.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.769 179.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.08 -46.72 75.48 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.364 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.01 -36.36 84.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.166 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 39.0 m -64.85 -50.64 65.84 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.886 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -66.12 -44.43 84.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.398 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.421 ' HB3' ' CG2' ' A' ' 119' ' ' VAL . 3.2 tp -58.07 -48.1 81.17 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 120.945 0.402 . . . . 10.0 110.165 179.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 70.4 m -61.46 -31.2 71.16 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.686 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.4 -39.45 94.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.15 0.5 . . . . 10.0 110.953 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.1 t -86.91 -34.91 7.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.926 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.457 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.6 m-30 -79.75 -23.87 41.95 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 113.576 0.954 . . . . 10.0 113.576 -177.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.46 -42.23 42.56 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.059 0.392 . . . . 10.0 112.059 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.36 -21.91 62.84 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.032 0.444 . . . . 10.0 111.336 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -87.83 -12.83 43.81 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.591 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 96.46 18.71 29.83 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.954 -0.641 . . . . 10.0 112.392 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.457 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 57.6 t -123.52 137.37 56.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.881 0.372 . . . . 10.0 111.005 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.1 m -138.52 122.3 17.61 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.543 -0.539 . . . . 10.0 109.543 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.421 ' CG2' ' HB3' ' A' ' 108' ' ' LEU . 6.0 m -107.16 139.56 28.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.941 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 37.2 m -149.58 144.02 25.95 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.409 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 2.1 p -106.08 122.24 59.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 44.7 m -140.4 124.34 17.4 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.415 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 62.73 46.58 5.16 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.68 0.613 . . . . 10.0 110.839 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 20.3 m-20 54.02 40.78 31.97 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.823 0.821 . . . . 10.0 110.394 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.459 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 57.2 tttt -143.08 129.06 19.57 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.809 -1.087 . . . . 10.0 108.929 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 21.7 mt -88.45 122.22 31.69 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.448 ' CD2' ' HB2' ' A' ' 80' ' ' SER . 14.8 mt -114.25 134.18 55.11 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 120.971 0.415 . . . . 10.0 110.52 -178.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.509 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 2.5 t -111.39 119.03 58.88 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 108.293 -1.003 . . . . 10.0 108.293 178.115 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -125.63 135.88 27.57 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-O 120.776 0.322 . . . . 10.0 110.969 -178.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -79.72 134.83 11.12 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.194 1.929 . . . . 10.0 111.682 178.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.8 m . . . . . 0 C--N 1.321 -0.636 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.61 179.841 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.6 t80 . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 120.943 0.401 . . . . 10.0 111.039 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.5 m -87.1 117.73 26.02 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.414 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -83.3 123.53 29.71 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.385 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -155.53 149.76 25.8 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.047 -0.524 . . . . 10.0 109.969 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.8 130.22 34.71 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.786 0.327 . . . . 10.0 110.529 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 48.0 p -107.74 153.72 41.35 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.052 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.55 5.92 2.18 Favored 'Trans proline' 0 CA--C 1.53 0.308 0 C-N-CA 122.386 2.058 . . . . 10.0 111.819 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.3 mtt -105.97 -12.42 15.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.752 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -69.05 -52.04 32.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.019 0.437 . . . . 10.0 110.505 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 97.74 -68.46 0.75 Allowed Glycine 0 N--CA 1.444 -0.806 0 C-N-CA 120.511 -0.852 . . . . 10.0 112.816 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.417 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 67.6 p -126.83 170.34 12.3 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.084 0.469 . . . . 10.0 112.199 -178.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 54.1 tp -57.38 -43.06 83.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.898 -1.046 . . . . 10.0 110.764 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -59.94 -52.44 65.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.945 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -43.05 91.5 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.256 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 50.8 ttp -63.36 -52.33 62.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.69 -0.686 . . . . 10.0 111.117 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 74.9 mt -62.51 -36.78 83.65 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.31 -0.404 . . . . 10.0 111.24 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -60.01 -44.01 94.84 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.7 ttm180 -65.27 -41.76 93.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.467 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 42.7 m0 -61.48 -50.2 73.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.567 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -68.41 -36.6 79.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.702 -179.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.1 -41.1 87.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.518 -0.31 . . . . 10.0 111.813 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -56.28 -39.56 72.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.572 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 67.7 m -101.8 14.09 32.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.447 -0.342 . . . . 10.0 111.792 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 54.99 38.08 29.94 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.068 0.461 . . . . 10.0 111.252 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 11.8 mtm -95.88 173.15 7.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.931 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.44 ' HB2' ' HG3' ' A' ' 125' ' ' LYS . 14.0 mt-30 -103.88 156.42 17.85 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.945 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 23.8 tp -128.52 132.79 48.31 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.089 0.471 . . . . 10.0 110.186 178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.451 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 75.6 m -120.16 97.16 5.46 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.398 -0.819 . . . . 10.0 110.852 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.555 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 9.0 t80 -87.03 98.5 11.31 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.848 -0.614 . . . . 10.0 110.283 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.528 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 37.0 m-80 -99.83 21.97 11.77 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.07 0.462 . . . . 10.0 110.701 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.555 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 41.8 mt -90.27 141.5 27.66 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.672 179.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -61.88 -34.1 82.7 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.695 2.264 . . . . 10.0 112.82 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -138.95 165.63 26.59 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.872 0.368 . . . . 10.0 110.951 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.431 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 6.5 m-20 -86.44 136.62 33.04 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -119.22 140.03 50.9 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.252 -0.579 . . . . 10.0 111.496 -179.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.417 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.8 OUTLIER -79.92 158.13 26.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.06 179.405 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.45 122.63 15.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.988 0.423 . . . . 10.0 110.313 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.547 HD13 ' NE2' ' A' ' 115' ' ' GLN . 4.7 pt -62.5 -30.77 49.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.788 -0.642 . . . . 10.0 111.878 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 140.64 -65.76 0.51 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.452 -0.88 . . . . 10.0 113.152 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -60.88 -5.55 4.84 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.37 2.713 . . . . 10.0 113.604 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.6 t -64.16 -39.26 84.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.277 0.561 . . . . 10.0 109.91 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 66.0 m -71.72 -6.14 39.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.419 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.2 -8.42 39.36 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.27 0.557 . . . . 10.0 110.156 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 56.2 mt -92.74 109.49 21.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.16 -0.682 . . . . 10.0 109.16 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -131.72 95.37 3.71 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.016 -178.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.8 t -131.1 156.25 45.56 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.869 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.49 -10.52 43.35 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 121.13 0.49 . . . . 10.0 110.311 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 29.6 t -96.01 118.54 32.81 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.351 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 11.0 p -64.22 -30.23 49.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.088 0.47 . . . . 10.0 110.295 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -69.77 -44.62 69.76 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.49 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -63.18 -41.62 99.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.868 179.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.46 -49.38 76.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.607 179.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.28 -37.26 84.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.069 0.461 . . . . 10.0 110.488 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 91.1 m -64.94 -48.79 72.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.544 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -64.63 -40.76 96.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.934 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.0 mp -60.71 -53.97 50.93 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 116.153 -0.476 . . . . 10.0 109.85 179.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.8 m -55.85 -30.83 62.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.579 0.228 . . . . 10.0 111.54 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.32 -44.12 92.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.767 0.318 . . . . 10.0 111.098 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 8.7 p -90.15 -21.85 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 121.008 0.432 . . . . 10.0 111.929 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -82.41 -25.04 34.05 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.461 0.541 . . . . 10.0 112.461 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -52.68 -33.7 48.55 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.119 0.414 . . . . 10.0 112.119 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.48 -25.64 67.58 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.811 0.339 . . . . 10.0 111.383 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . 0.547 ' NE2' HD13 ' A' ' 90' ' ' ILE . 1.8 mp0 -92.07 -19.9 21.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.191 0.519 . . . . 10.0 109.682 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.82 30.27 6.17 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.496 -0.775 . . . . 10.0 112.428 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 94.4 t -125.83 140.05 49.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.899 0.381 . . . . 10.0 110.753 -179.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 9.5 m -137.03 131.8 33.34 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.16 -0.473 . . . . 10.0 109.821 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 127' ' ' LEU . 6.4 m -122.95 140.01 47.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.014 0.435 . . . . 10.0 111.165 -178.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.6 m -144.69 163.55 33.66 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.504 -0.316 . . . . 10.0 110.517 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.505 HG21 ' CD2' ' A' ' 126' ' ' LEU . 3.2 t -116.65 115.19 48.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.414 -0.588 . . . . 10.0 109.414 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 19.9 m -136.39 116.65 13.55 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.608 -0.269 . . . . 10.0 110.728 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 59.0 54.25 5.12 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.716 -0.675 . . . . 10.0 111.768 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 55.42 33.53 21.11 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.763 -0.653 . . . . 10.0 111.569 179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.451 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 19.4 tttt -138.83 130.79 27.96 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.382 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.505 ' CD2' HG21 ' A' ' 121' ' ' VAL . 91.1 mt -89.6 121.82 32.16 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.873 -0.788 . . . . 10.0 108.873 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.425 ' O ' ' HA ' ' A' ' 119' ' ' VAL . 4.0 mm? -103.01 115.68 31.07 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.872 -178.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.528 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 3.6 t -105.93 117.82 52.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 107.57 -1.27 . . . . 10.0 107.57 177.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -136.42 142.83 40.95 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-O 120.699 0.285 . . . . 10.0 111.186 -178.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -81.54 130.56 7.0 Favored 'Trans proline' 0 N--CA 1.451 -0.981 0 C-N-CA 122.269 1.979 . . . . 10.0 111.028 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 1.7 m . . . . . 0 C--N 1.316 -0.856 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.547 -179.586 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.1 t80 . . . . . 0 N--CA 1.452 -0.348 0 CA-C-O 120.724 0.297 . . . . 10.0 110.412 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.5 m -77.24 115.56 17.12 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.568 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.501 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 93.0 m-85 -85.87 115.72 23.68 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.915 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.408 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 10.7 pt20 -146.36 160.32 42.2 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.52 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -92.7 114.81 27.47 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.158 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.9 p -97.09 153.91 38.33 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 116.408 -0.36 . . . . 10.0 110.836 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -65.42 -16.43 54.18 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.399 2.066 . . . . 10.0 111.638 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 19.0 ptt? -86.2 -6.5 58.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.701 -0.681 . . . . 10.0 110.682 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -79.44 -56.99 3.92 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.187 -0.671 . . . . 10.0 109.187 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 92.86 -69.07 1.69 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.849 -0.691 . . . . 10.0 113.229 178.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 35.5 p -118.91 166.22 13.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.179 0.514 . . . . 10.0 111.993 -178.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 61.4 tp -56.64 -40.69 75.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.852 -1.067 . . . . 10.0 111.06 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -61.53 -51.98 66.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.716 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.97 -40.29 95.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.004 0.43 . . . . 10.0 111.318 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 54.4 ttp -62.2 -53.67 51.89 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.131 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.7 mt -63.82 -33.65 76.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.024 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.11 -43.24 91.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.327 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.3 ttm-85 -67.7 -44.31 78.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.481 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 40.2 m0 -56.65 -52.3 65.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.037 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.77 -45.42 82.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.555 -179.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.92 -40.54 93.56 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.736 0.303 . . . . 10.0 111.62 -179.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -60.62 -41.85 95.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.163 -0.472 . . . . 10.0 111.425 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 20.0 m -98.94 12.32 36.25 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.229 0.455 . . . . 10.0 112.229 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 57.66 41.14 25.88 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.371 0.605 . . . . 10.0 111.389 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 60.3 mtp -104.27 173.48 6.29 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.023 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -104.94 158.06 16.79 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.511 -0.313 . . . . 10.0 110.769 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 19.8 tp -129.5 136.24 49.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.412 0.625 . . . . 10.0 111.577 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.423 ' HB2' ' HG ' ' A' ' 127' ' ' LEU . 1.8 m -124.22 95.34 4.51 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.036 -0.984 . . . . 10.0 109.525 179.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.512 ' CZ ' HD13 ' A' ' 83' ' ' LEU . 12.6 t80 -91.79 97.88 11.27 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.537 -0.542 . . . . 10.0 109.537 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 38.9 m-80 -101.26 31.33 3.73 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.149 0.499 . . . . 10.0 111.065 -178.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.512 HD13 ' CZ ' ' A' ' 81' ' ' TYR . 64.2 mt -96.03 140.54 22.32 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.425 ' C ' ' HG ' ' A' ' 85' ' ' SER . 18.3 Cg_endo -58.59 -30.83 93.13 Favored 'Trans proline' 0 N--CA 1.466 -0.137 0 C-N-CA 122.778 2.319 . . . . 10.0 112.187 -179.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' SER . . . . . 0.425 ' HG ' ' C ' ' A' ' 84' ' ' PRO . 17.0 m -149.88 170.5 18.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.224 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.455 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 4.9 p-10 -87.06 147.28 25.75 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.953 -0.567 . . . . 10.0 109.699 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -124.55 141.22 52.25 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.71 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -83.9 151.15 25.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.093 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.05 120.77 8.0 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.125 178.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.436 HD11 ' NE2' ' A' ' 115' ' ' GLN . 3.2 pt -67.96 -29.62 45.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 112.567 0.58 . . . . 10.0 112.567 -179.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . 0.4 ' H ' HG21 ' A' ' 93' ' ' VAL . . . 140.35 -65.27 0.52 Allowed Glycine 0 CA--C 1.521 0.427 0 C-N-CA 120.577 -0.82 . . . . 10.0 112.789 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.59 -0.85 2.72 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.913 2.409 . . . . 10.0 112.89 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.4 HG21 ' H ' ' A' ' 91' ' ' GLY . 2.0 t -67.34 -38.21 80.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.118 0.485 . . . . 10.0 109.907 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 74.3 m -68.83 -11.69 60.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.543 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -84.16 -6.75 59.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.164 0.507 . . . . 10.0 110.064 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.408 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 34.8 mt -94.76 105.25 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-N 115.782 -0.645 . . . . 10.0 109.6 179.617 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.0 m -139.5 96.02 3.02 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.374 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.0 t -131.32 156.32 45.69 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.59 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.54 -13.41 51.89 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.085 0.469 . . . . 10.0 110.753 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.9 t -94.49 114.69 26.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.105 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.501 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 9.3 p -65.07 -30.99 52.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.993 0.425 . . . . 10.0 109.943 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -67.78 -43.27 80.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.79 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -66.79 -40.38 88.1 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.272 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.92 -50.81 67.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.751 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.93 -31.51 72.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.918 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 54.4 m -66.69 -45.42 78.89 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.156 0.503 . . . . 10.0 110.395 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -71.23 -41.33 70.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.714 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 19.2 mt -58.07 -48.66 79.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 10.0 111.391 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.536 ' O ' ' HB3' ' A' ' 113' ' ' ALA . 4.9 p -62.83 -22.79 66.9 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.038 0.384 . . . . 10.0 112.038 -179.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.77 -43.71 45.14 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.282 0.563 . . . . 10.0 110.494 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 13.6 t -78.96 -32.52 15.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 121.58 0.705 . . . . 10.0 110.707 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.447 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.1 m-85 -81.16 -21.94 39.33 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.28 -0.873 . . . . 10.0 112.574 -178.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.536 ' HB3' ' O ' ' A' ' 109' ' ' SER . . . -52.84 -27.95 20.63 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.772 0.286 . . . . 10.0 111.772 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.4 -21.36 61.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.073 0.463 . . . . 10.0 111.123 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . 0.436 ' NE2' HD11 ' A' ' 90' ' ' ILE . 2.4 mp0 -95.44 -25.99 16.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.981 -0.554 . . . . 10.0 109.691 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 107.41 34.06 2.99 Favored Glycine 0 N--CA 1.448 -0.539 0 CA-C-N 115.62 -0.718 . . . . 10.0 112.291 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.447 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 72.2 t -128.87 128.07 67.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.682 0.277 . . . . 10.0 111.104 -179.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.4 m -123.47 104.29 8.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.21 0.529 . . . . 10.0 110.179 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 5.2 m -94.23 139.7 17.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.924 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -147.11 152.49 38.56 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.045 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.424 HG11 HD22 ' A' ' 126' ' ' LEU . 2.9 t -110.12 120.69 61.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 17.5 m -136.91 115.87 12.32 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.544 -0.298 . . . . 10.0 111.103 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 63.21 48.56 3.64 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.669 -0.696 . . . . 10.0 111.523 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 16.0 t30 60.73 23.54 13.42 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.082 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 40.9 tttt -126.74 131.0 51.43 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.475 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.424 HD22 HG11 ' A' ' 121' ' ' VAL . 95.2 mt -88.09 121.62 30.71 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 108.822 -0.807 . . . . 10.0 108.822 179.315 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.423 ' HG ' ' HB2' ' A' ' 80' ' ' SER . 0.3 OUTLIER -117.46 119.52 35.31 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.201 0.524 . . . . 10.0 111.035 -179.031 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.516 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 2.8 t -102.89 119.67 51.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 CA-C-N 115.644 -0.707 . . . . 10.0 109.104 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -127.66 132.99 24.62 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-O 120.909 0.385 . . . . 10.0 110.815 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.53 132.44 12.22 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 122.7 2.266 . . . . 10.0 112.554 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 1.1 m . . . . . 0 C--N 1.32 -0.677 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.053 179.598 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 16.1 t80 . . . . . 0 N--CA 1.452 -0.344 0 CA-C-O 120.964 0.412 . . . . 10.0 111.235 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.8 m -87.72 113.79 23.73 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.093 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -80.47 108.55 14.19 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.095 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.438 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 16.6 pt20 -141.99 159.56 41.98 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.886 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.611 ' HB2' ' SD ' ' A' ' 67' ' ' MET . . . -92.92 126.97 38.26 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.03 -0.532 . . . . 10.0 109.842 178.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.2 p -118.31 158.86 45.57 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 116.115 -0.493 . . . . 10.0 109.972 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -72.04 -0.96 9.3 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 122.183 1.922 . . . . 10.0 111.495 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 68.5 mtm -90.31 -26.83 19.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.444 -0.798 . . . . 10.0 110.259 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -65.79 -50.08 66.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.964 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.43 -66.11 1.77 Allowed Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.589 -0.815 . . . . 10.0 113.153 178.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 29.9 p -125.35 173.93 8.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.143 0.497 . . . . 10.0 111.86 -178.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 46.1 tp -62.75 -41.22 99.1 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.006 -0.997 . . . . 10.0 110.491 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -61.31 -54.74 40.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.841 -179.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.92 -42.09 84.04 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.402 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.611 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 57.3 ttp -61.2 -51.5 68.73 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.488 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 86.4 mt -64.03 -38.04 89.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.116 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -60.34 -44.8 95.17 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 120.853 0.359 . . . . 10.0 110.311 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.0 mtp85 -68.98 -42.16 76.9 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.44 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 31.2 m0 -55.69 -48.54 74.92 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.43 0.633 . . . . 10.0 109.863 178.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -68.55 -51.84 38.52 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.158 -0.928 . . . . 10.0 111.613 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.27 -46.28 72.63 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.057 0.391 . . . . 10.0 112.057 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -60.75 -40.19 91.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.94 0.4 . . . . 10.0 111.571 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.4 m -93.14 9.71 34.8 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.887 -178.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 56.14 48.25 17.86 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.482 0.658 . . . . 10.0 110.45 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 81.1 mtp -116.2 173.54 6.53 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.047 -0.979 . . . . 10.0 109.88 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -108.83 160.74 15.74 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.433 -0.348 . . . . 10.0 110.228 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 19.9 tp -133.71 143.0 48.23 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.291 0.567 . . . . 10.0 110.773 -179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.475 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 31.7 m -127.91 96.06 4.38 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.042 -0.981 . . . . 10.0 109.595 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.512 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 13.8 t80 -93.02 98.16 11.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.441 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -98.64 22.07 10.45 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.075 0.464 . . . . 10.0 111.159 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.512 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 48.0 mt -88.01 143.59 33.37 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 109.565 -0.532 . . . . 10.0 109.565 179.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -61.71 -30.79 85.66 Favored 'Trans proline' 0 N--CA 1.465 -0.162 0 C-N-CA 122.633 2.222 . . . . 10.0 112.881 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.3 m -148.27 167.73 24.39 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.608 -0.269 . . . . 10.0 110.576 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.449 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 3.8 p-10 -83.47 146.16 28.55 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -129.16 149.56 50.91 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 110.241 -0.281 . . . . 10.0 110.241 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.58 169.95 11.28 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.79 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -74.19 144.28 44.84 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.813 -0.44 . . . . 10.0 109.813 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.7 pt -83.64 -36.15 12.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.337 -0.392 . . . . 10.0 111.71 -179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 155.07 -67.92 0.3 Allowed Glycine 0 N--CA 1.453 -0.19 0 C-N-CA 120.297 -0.954 . . . . 10.0 113.13 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.5 -12.13 13.11 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 123.395 2.73 . . . . 10.0 113.468 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.9 t -63.75 -39.49 85.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.028 0.442 . . . . 10.0 110.357 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 1.3 m -69.08 -7.53 36.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.843 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.99 -3.28 48.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.035 0.445 . . . . 10.0 110.604 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.438 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 52.2 mt -95.79 113.47 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.74 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.0 m -141.98 91.52 2.36 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.34 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 11.9 t -129.97 155.8 45.5 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.299 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.81 -10.77 54.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.037 0.446 . . . . 10.0 111.071 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.5 t -93.54 113.26 25.34 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.776 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.25 -28.94 45.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.054 0.454 . . . . 10.0 110.439 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 61.7 mt-30 -70.51 -39.64 73.98 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.013 -0.539 . . . . 10.0 109.81 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . 0.419 ' O ' ' HB ' ' A' ' 106' ' ' THR . 53.7 tp60 -69.99 -41.0 74.96 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.047 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.99 -50.03 73.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.51 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.47 -30.75 71.82 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.367 179.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.419 ' HB ' ' O ' ' A' ' 103' ' ' GLN . 55.5 m -64.34 -51.07 65.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.824 -0.625 . . . . 10.0 110.811 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -68.09 -39.75 82.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.153 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.426 ' O ' HG13 ' A' ' 111' ' ' VAL . 1.6 mp -60.95 -50.9 71.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.126 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 13.0 p -63.54 -31.93 73.24 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.102 -0.239 . . . . 10.0 111.247 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.23 -40.79 98.44 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.146 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.426 HG13 ' O ' ' A' ' 108' ' ' LEU . 12.0 p -89.28 -24.31 5.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 120.945 0.403 . . . . 10.0 111.942 -179.233 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -83.35 -24.26 32.15 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.575 0.954 . . . . 10.0 113.575 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.04 -32.62 15.91 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.64 -18.94 62.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.903 0.382 . . . . 10.0 111.386 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -98.03 -0.26 44.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.021 0.439 . . . . 10.0 110.182 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.85 21.25 56.25 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.975 -0.631 . . . . 10.0 112.887 179.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 92.5 t -121.49 128.64 75.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.805 0.336 . . . . 10.0 110.554 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.9 m -126.96 104.17 7.86 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.982 0.42 . . . . 10.0 110.728 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 27.7 m -94.59 148.26 5.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.012 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 18.9 m -154.62 175.89 13.09 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.887 -0.783 . . . . 10.0 108.887 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 13.9 p -142.62 125.77 14.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 121.526 0.679 . . . . 10.0 110.268 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 19.6 m -113.25 108.31 17.09 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.246 -0.888 . . . . 10.0 109.36 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 64.57 -89.61 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 O-C-N 123.755 0.66 . . . . 10.0 111.346 -179.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.9 m-20 -132.76 23.96 4.31 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.188 0.518 . . . . 10.0 109.843 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.475 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 38.6 tttt -125.72 127.91 46.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.032 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 36.0 mt -87.31 122.28 30.87 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.463 -0.939 . . . . 10.0 108.463 178.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -107.12 115.58 30.43 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.179 0.514 . . . . 10.0 111.121 -178.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.7 t -112.4 117.91 56.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 108.268 -1.012 . . . . 10.0 108.268 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -137.66 143.33 40.13 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-O 120.602 0.239 . . . . 10.0 110.456 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -81.03 142.53 13.76 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.519 2.146 . . . . 10.0 111.932 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 3.3 m . . . . . 0 C--N 1.32 -0.696 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.14 179.184 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 27.5 t80 . . . . . 0 N--CA 1.454 -0.227 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.6 m -79.83 121.02 24.88 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.86 0.362 . . . . 10.0 111.032 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -90.99 111.64 23.19 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.631 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -146.08 147.83 32.0 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.847 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.501 ' HB2' ' SD ' ' A' ' 67' ' ' MET . . . -81.7 115.25 20.86 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.362 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 73.2 p -96.61 152.23 38.43 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.24 -0.436 . . . . 10.0 109.873 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.93 -18.38 64.66 Favored 'Trans proline' 0 CA--C 1.527 0.159 0 C-N-CA 122.225 1.95 . . . . 10.0 112.041 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.0 ptt? -89.6 2.92 54.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.515 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.596 ' HA ' ' NH1' ' A' ' 70' ' ' ARG . 28.9 m-20 -82.09 -52.21 7.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.262 0.553 . . . . 10.0 109.808 178.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.08 -66.98 2.97 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.534 -0.757 . . . . 10.0 113.697 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.491 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 24.4 p -122.34 165.92 15.51 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.663 0.616 . . . . 10.0 112.663 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 33.2 tp -62.42 -42.05 99.16 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.819 -1.082 . . . . 10.0 111.143 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 51.8 tttt -57.99 -55.37 35.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.739 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.6 m -59.63 -41.22 89.96 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.155 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.501 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 57.6 ttp -63.54 -52.53 60.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.856 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 70.8 mt -62.1 -40.24 95.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.369 -0.378 . . . . 10.0 111.286 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -60.54 -43.39 97.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.312 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.596 ' NH1' ' HA ' ' A' ' 61' ' ' ASP . 97.2 mtt180 -66.85 -42.5 85.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.225 179.287 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -58.83 -54.13 50.58 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.605 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.96 -40.16 96.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.687 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.11 -40.74 94.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.771 0.32 . . . . 10.0 111.311 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.69 -21.14 64.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.408 -179.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.5 m -109.35 7.09 24.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.526 -0.306 . . . . 10.0 111.706 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 61.4 t30 56.46 48.22 17.26 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.837 0.827 . . . . 10.0 110.655 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 72.7 mtp -116.89 173.19 6.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.16 -0.927 . . . . 10.0 110.128 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -106.1 159.48 16.04 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.969 179.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.7 tp -134.8 138.77 44.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.319 0.581 . . . . 10.0 111.669 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.428 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 1.4 m -123.74 96.59 5.02 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.08 179.159 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.616 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 8.7 t80 -91.65 102.82 15.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.864 -178.828 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.482 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 37.1 m-80 -104.85 33.49 3.59 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.009 0.433 . . . . 10.0 110.908 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.519 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 55.6 mt -102.94 146.88 33.23 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.018 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.97 -34.54 94.98 Favored 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.735 2.29 . . . . 10.0 112.321 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.3 m -152.5 166.59 31.51 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.36 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.616 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 9.5 p-10 -84.92 128.75 34.76 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 178.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -100.39 136.99 39.42 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.18 -178.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.491 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.9 OUTLIER -72.59 154.99 40.5 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.518 179.181 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.11 114.84 3.34 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 179.267 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.3 pt -59.74 -32.83 50.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -178.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 149.26 -70.75 0.31 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.578 -0.82 . . . . 10.0 112.66 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.14 -4.69 3.21 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.511 2.807 . . . . 10.0 113.48 -179.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.9 t -64.97 -36.04 76.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.308 0.575 . . . . 10.0 110.236 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.22 -14.14 62.63 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.544 -0.753 . . . . 10.0 111.677 -179.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -87.67 1.56 53.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.876 0.37 . . . . 10.0 111.1 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 40.3 mt -98.51 110.28 25.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.1 t -141.12 93.99 2.65 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.543 -178.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.8 t -132.19 156.78 45.83 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.511 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -89.5 -13.69 36.91 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.052 0.453 . . . . 10.0 110.791 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.5 114.06 26.34 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.336 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.5 p -62.2 -33.83 60.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.832 0.348 . . . . 10.0 110.854 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -64.18 -39.38 93.87 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.122 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -72.53 -42.1 65.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.305 -0.407 . . . . 10.0 109.999 179.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.77 -51.09 66.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.91 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.74 -33.08 74.85 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.958 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 95.9 m -67.59 -47.12 70.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.669 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -66.26 -40.08 89.9 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.262 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.412 ' O ' ' HB2' ' A' ' 112' ' ' TYR . 30.7 mt -61.24 -49.6 76.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.934 179.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.478 ' O ' ' HB1' ' A' ' 113' ' ' ALA . 4.6 p -64.17 -22.14 66.82 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 111.765 0.283 . . . . 10.0 111.765 -179.217 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.49 -46.82 52.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.09 0.471 . . . . 10.0 110.311 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.7 t -75.78 -47.74 32.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.678 0.752 . . . . 10.0 110.334 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.434 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.6 m-30 -64.33 -21.11 66.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.928 -1.033 . . . . 10.0 113.254 -178.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.478 ' HB1' ' O ' ' A' ' 109' ' ' SER . . . -52.18 -28.55 18.64 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.806 0.298 . . . . 10.0 111.806 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.12 -23.72 54.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.148 0.499 . . . . 10.0 111.101 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 17.8 mp0 -89.75 -6.92 55.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.298 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 89.11 27.38 23.53 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.72 -0.752 . . . . 10.0 111.994 -179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.434 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 97.0 t -127.8 134.51 65.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.849 0.357 . . . . 10.0 110.605 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 14.4 m -136.16 105.15 5.91 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.267 0.556 . . . . 10.0 110.614 179.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 13.2 m -97.45 150.09 4.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.522 -0.763 . . . . 10.0 111.145 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 15.1 m -155.66 170.82 21.13 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.366 -0.605 . . . . 10.0 109.366 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 2.8 t -120.96 129.47 75.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 179.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 25.3 m -145.25 117.32 8.32 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.717 0.294 . . . . 10.0 111.268 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.56 50.68 5.59 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.551 -0.749 . . . . 10.0 111.901 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 30.5 t30 59.48 25.86 14.72 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.394 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.428 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 56.7 tttt -131.54 137.64 48.57 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 97.3 mt -87.91 122.16 31.2 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.116 -0.698 . . . . 10.0 109.116 179.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -103.91 115.76 31.05 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.317 -178.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.482 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 10.6 t -108.54 118.22 55.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 N-CA-C 108.552 -0.907 . . . . 10.0 108.552 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -137.71 139.64 27.41 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.436 -178.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -79.13 154.4 25.29 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.736 2.29 . . . . 10.0 112.098 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.32 -0.676 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.074 179.049 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.2 t80 . . . . . 0 N--CA 1.455 -0.196 0 CA-C-O 120.94 0.4 . . . . 10.0 111.329 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.7 m -84.39 117.74 23.81 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.143 178.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.434 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 93.0 m-85 -84.99 116.18 23.24 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.006 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -153.08 146.88 25.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.142 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.403 ' HB2' ' HA ' ' A' ' 94' ' ' SER . . . -81.11 136.63 35.94 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.904 -0.406 . . . . 10.0 109.904 179.169 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 80.3 p -119.52 157.91 50.52 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 116.341 -0.391 . . . . 10.0 110.354 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -68.61 -8.16 22.43 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.405 2.07 . . . . 10.0 111.802 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 60.3 mtt -84.72 -17.36 38.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.496 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -73.27 -49.21 28.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.47 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.62 -61.64 4.54 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.871 -0.68 . . . . 10.0 112.413 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 24.4 p -121.55 170.37 9.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.872 0.368 . . . . 10.0 111.085 -179.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.43 ' O ' HD23 ' A' ' 64' ' ' LEU . 1.7 tm? -67.15 -39.09 86.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.226 179.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.41 -55.14 38.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.129 179.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.9 m -65.09 -27.47 68.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.238 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 9.7 tmm? -69.78 -55.27 10.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.371 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 43.0 mt -64.53 -32.74 74.52 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.669 0.271 . . . . 10.0 111.087 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -60.5 -39.06 86.38 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.636 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 59.7 ttp85 -70.18 -41.73 73.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.434 . . . . 10.0 110.222 179.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 29.1 m0 -58.02 -48.72 79.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.473 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -68.97 -42.46 76.59 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.553 -0.749 . . . . 10.0 111.626 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.42 -40.76 79.04 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -178.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -63.13 -38.23 90.37 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.854 0.316 . . . . 10.0 111.854 -179.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 10.2 m -98.75 11.63 38.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.435 -0.348 . . . . 10.0 111.817 -178.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 60.5 t30 58.14 30.1 18.86 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.482 0.658 . . . . 10.0 110.762 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 73.1 mtp -92.9 169.67 10.27 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.698 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -106.71 151.09 25.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.043 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 41.9 tp -116.08 126.54 53.89 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.288 0.566 . . . . 10.0 111.117 179.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.417 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 0.5 OUTLIER -108.97 95.87 5.94 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 178.725 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.552 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 7.7 t80 -93.41 101.82 14.04 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.088 -179.056 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.7 m-80 -100.68 31.07 3.65 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.326 0.584 . . . . 10.0 110.452 -179.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.527 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 32.1 mt -105.57 151.24 39.75 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.606 -0.725 . . . . 10.0 109.716 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.74 -27.68 21.47 Favored 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 122.542 2.161 . . . . 10.0 112.918 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.0 m -153.75 167.24 30.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.646 0.26 . . . . 10.0 110.76 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.552 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 6.6 p-10 -93.04 146.3 23.73 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.43 -0.581 . . . . 10.0 109.43 178.441 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -124.78 157.93 34.57 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.416 -0.356 . . . . 10.0 110.237 -179.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.6 OUTLIER -81.76 163.79 22.15 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.087 179.702 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.46 119.35 15.49 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 179.373 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.4 pt -57.41 -34.92 47.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 112.439 0.533 . . . . 10.0 112.439 -179.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 152.31 -72.84 0.27 Allowed Glycine 0 CA--C 1.518 0.279 0 C-N-CA 120.06 -1.067 . . . . 10.0 113.261 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -61.54 -3.25 3.21 Favored 'Trans proline' 0 N--CA 1.478 0.588 0 C-N-CA 123.374 2.716 . . . . 10.0 113.903 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.1 t -61.62 -41.24 89.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.237 0.541 . . . . 10.0 110.64 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.403 ' HA ' ' HB2' ' A' ' 57' ' ' ALA . 0.9 OUTLIER -73.09 -7.11 49.87 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.613 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.09 2.28 56.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.927 0.394 . . . . 10.0 111.017 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 32.5 mt -104.6 113.76 42.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.558 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.4 m -138.34 99.47 3.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.004 0.431 . . . . 10.0 111.868 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.8 t -131.52 156.24 46.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.535 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.56 -13.12 43.78 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.043 0.449 . . . . 10.0 110.903 178.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 17.0 t -93.13 116.82 29.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.219 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.434 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 14.6 p -65.1 -30.38 50.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.921 0.391 . . . . 10.0 110.206 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -68.44 -42.35 79.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.954 -0.567 . . . . 10.0 109.825 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -68.75 -43.37 75.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.937 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.02 -48.34 73.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.626 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.72 -39.61 92.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.573 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 62.2 m -65.69 -48.0 73.53 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.807 -0.633 . . . . 10.0 111.0 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -65.75 -38.71 89.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.045 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 16.7 mt -62.54 -48.89 77.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.749 -0.463 . . . . 10.0 109.749 178.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.8 m -58.95 -33.01 70.13 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.854 -0.612 . . . . 10.0 111.227 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.25 -40.51 94.3 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.933 0.396 . . . . 10.0 110.999 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.85 -40.72 15.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.49 0.662 . . . . 10.0 110.852 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.417 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 8.3 m-30 -69.64 -25.46 63.93 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.249 -0.887 . . . . 10.0 112.647 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.05 -42.27 49.42 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.295 0.48 . . . . 10.0 112.295 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.37 -23.84 67.43 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -95.1 -3.79 47.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.839 0.352 . . . . 10.0 110.928 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 88.62 23.8 35.22 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.715 -0.755 . . . . 10.0 113.237 179.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.417 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 88.6 t -126.33 139.76 50.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.965 0.412 . . . . 10.0 110.578 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.0 m -142.28 140.84 32.33 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 110.068 -0.345 . . . . 10.0 110.068 178.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 11.0 m -126.5 134.23 66.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.103 0.478 . . . . 10.0 111.55 -178.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.8 m -140.1 143.71 36.41 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 179.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 3.1 p -107.75 127.58 63.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-O 121.275 0.559 . . . . 10.0 110.039 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.4 m -145.99 130.53 17.83 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.153 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.32 39.51 18.77 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.564 0.54 . . . . 10.0 111.089 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 14.4 m120 62.67 28.84 16.76 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.65 -0.705 . . . . 10.0 110.986 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.417 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 66.7 tttt -130.81 132.25 45.13 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.867 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 48.9 mt -87.88 122.11 31.11 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.298 -1.001 . . . . 10.0 108.298 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.14 115.52 27.65 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.062 0.458 . . . . 10.0 111.286 -178.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 3.2 t -97.17 119.91 45.82 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 N-CA-C 108.742 -0.836 . . . . 10.0 108.742 178.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -132.6 128.48 20.98 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 109.943 -0.392 . . . . 10.0 109.943 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.23 131.22 16.23 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.311 2.008 . . . . 10.0 112.087 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.318 -0.771 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.315 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.9 t80 . . . . . 0 C--O 1.234 0.287 0 CA-C-O 120.998 0.428 . . . . 10.0 111.467 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.4 m -86.19 122.21 29.86 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.76 -0.655 . . . . 10.0 110.4 179.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.418 ' OH ' ' HB3' ' A' ' 75' ' ' SER . 67.4 m-85 -87.68 114.12 24.0 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.741 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -146.64 145.18 29.96 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.91 -0.586 . . . . 10.0 109.994 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -79.18 123.54 27.49 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 178.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.424 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 50.6 p -111.06 158.16 36.68 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-O 120.66 0.267 . . . . 10.0 111.04 -178.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.424 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 35.6 Cg_endo -64.25 -20.19 66.57 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.431 2.087 . . . . 10.0 111.321 178.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -66.28 -35.1 79.54 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -75.11 -56.07 5.1 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.484 -0.932 . . . . 10.0 108.484 178.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.63 -56.13 3.39 Favored Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.309 -0.86 . . . . 10.0 113.536 178.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 63.5 p -108.04 166.03 11.03 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.062 0.458 . . . . 10.0 111.883 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 31.6 tp -61.92 -48.12 81.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.143 -0.935 . . . . 10.0 111.553 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -58.09 -54.55 45.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.77 -0.195 . . . . 10.0 111.133 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.3 m -58.41 -37.84 76.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.98 0.419 . . . . 10.0 111.497 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 10.1 tmm? -68.84 -52.29 31.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.002 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 26.8 mt -63.64 -34.13 77.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.519 -0.309 . . . . 10.0 111.09 -179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -62.24 -43.38 98.97 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 -64.48 -43.04 95.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.076 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 21.3 m0 -60.03 -54.48 45.53 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.719 -0.673 . . . . 10.0 110.985 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.94 -36.82 84.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.982 -0.554 . . . . 10.0 111.655 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.83 -44.05 97.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.811 0.339 . . . . 10.0 111.158 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.04 -34.56 77.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.55 -179.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.418 ' HB3' ' OH ' ' A' ' 55' ' ' TYR . 4.7 p -91.51 0.77 57.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.415 -0.357 . . . . 10.0 111.551 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 56.29 46.41 21.18 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.569 0.699 . . . . 10.0 109.705 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.509 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 21.9 mtm -115.37 168.07 10.3 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.698 -179.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -93.79 150.08 20.69 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.125 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 22.4 tp -124.06 134.66 53.35 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.92 0.39 . . . . 10.0 110.174 179.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.615 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 1.6 m -121.46 95.98 4.9 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.987 179.092 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.502 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 11.6 t80 -90.83 96.78 10.81 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.273 -0.64 . . . . 10.0 109.273 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -98.92 22.52 10.09 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.258 0.552 . . . . 10.0 110.841 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.502 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 63.5 mt -87.56 138.33 31.81 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.537 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -61.44 -35.78 81.15 Favored 'Trans proline' 0 C--O 1.235 0.332 0 C-N-CA 123.08 2.52 . . . . 10.0 113.122 -179.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.8 m -137.51 168.71 19.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.143 0.497 . . . . 10.0 111.037 -179.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -82.78 143.81 30.59 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.574 178.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -124.12 145.43 49.28 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.482 -0.326 . . . . 10.0 110.193 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 1.5 m -97.82 151.57 20.06 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.882 -179.413 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.54 112.73 1.7 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 120.875 0.369 . . . . 10.0 110.126 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -62.64 -33.8 61.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 112.68 0.622 . . . . 10.0 112.68 -178.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 151.02 -64.78 0.38 Allowed Glycine 0 CA--C 1.519 0.332 0 C-N-CA 120.172 -1.013 . . . . 10.0 113.455 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.56 -13.98 28.45 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.883 2.389 . . . . 10.0 113.16 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.4 t -64.91 -35.5 75.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.862 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.93 -11.48 60.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.427 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.12 2.95 55.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.341 -0.39 . . . . 10.0 111.392 -179.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.3 mt -98.0 108.36 21.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.533 -0.303 . . . . 10.0 110.273 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.72 100.43 5.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.755 -179.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.2 t -132.54 155.59 48.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.579 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -91.05 -1.63 57.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.846 0.355 . . . . 10.0 111.484 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.4 t -109.01 121.44 45.13 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.467 -0.333 . . . . 10.0 110.279 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.58 -30.78 51.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.83 0.348 . . . . 10.0 110.733 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -68.88 -46.28 68.8 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 179.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -65.12 -36.38 84.08 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.329 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.34 -51.12 70.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.229 178.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.81 -33.38 75.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.632 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 51.5 m -66.91 -46.32 75.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.775 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -70.99 -36.81 72.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.277 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.9 mp -62.75 -47.61 82.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.751 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.1 p -62.45 -29.84 70.81 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 116.734 -0.212 . . . . 10.0 111.281 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.04 -35.74 81.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.166 0.508 . . . . 10.0 110.791 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 45.6 t -84.94 -41.65 15.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.409 0.624 . . . . 10.0 110.264 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.507 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 12.1 m-30 -68.3 -26.75 65.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.166 -0.924 . . . . 10.0 112.273 -178.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -51.02 -44.69 61.05 Favored 'General case' 0 C--N 1.33 -0.279 0 O-C-N 123.07 0.231 . . . . 10.0 111.468 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.62 -23.4 65.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.891 0.377 . . . . 10.0 111.265 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -89.38 -12.46 40.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.786 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 96.13 22.28 20.45 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.604 -0.808 . . . . 10.0 112.809 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.507 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 90.3 t -127.61 145.41 35.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.872 0.367 . . . . 10.0 110.052 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.2 m -139.44 117.92 12.14 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.996 0.427 . . . . 10.0 110.269 178.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 28.0 m -108.48 144.98 16.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.778 -0.647 . . . . 10.0 111.46 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 48.5 m -155.47 142.46 19.12 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.885 -0.783 . . . . 10.0 108.885 178.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 2.6 p -104.44 117.39 49.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 16.6 m -132.52 118.93 19.87 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.252 -178.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.28 51.93 5.19 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 123.916 0.76 . . . . 10.0 112.402 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.509 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 78.3 m-20 60.44 33.89 20.59 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.059 -0.518 . . . . 10.0 111.594 179.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.615 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 64.2 tttt -143.69 129.28 19.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.789 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 36.7 mt -88.26 121.22 30.4 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.604 -0.888 . . . . 10.0 108.604 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -103.39 116.54 32.6 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.667 -179.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 2.8 t -111.43 118.01 56.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 N-CA-C 108.64 -0.874 . . . . 10.0 108.64 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -143.39 148.43 44.03 Favored Pre-proline 0 C--N 1.322 -0.625 0 CA-C-O 120.686 0.279 . . . . 10.0 111.144 -178.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -79.06 143.58 18.04 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.552 2.168 . . . . 10.0 110.911 178.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.712 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.202 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 30.1 t80 . . . . . 0 N--CA 1.452 -0.37 0 CA-C-O 120.741 0.305 . . . . 10.0 110.207 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 13.9 m -69.0 114.96 7.76 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.343 0.592 . . . . 10.0 110.256 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.488 ' O ' ' HA ' ' A' ' 97' ' ' SER . 52.0 m-85 -79.59 115.49 19.24 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.526 -0.761 . . . . 10.0 110.865 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -150.69 148.94 29.19 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.73 179.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.34 119.3 24.92 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.258 -0.645 . . . . 10.0 109.258 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.8 p -104.32 153.5 38.99 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.833 -179.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -64.42 -13.11 36.56 Favored 'Trans proline' 0 N--CA 1.465 -0.149 0 C-N-CA 122.67 2.246 . . . . 10.0 111.701 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 24.7 mmt -79.35 -21.96 45.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.313 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -75.31 -51.56 12.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.386 -0.598 . . . . 10.0 109.386 179.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.94 -65.25 2.95 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.918 -0.658 . . . . 10.0 112.846 178.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 30.0 p -117.22 169.73 9.23 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.018 0.437 . . . . 10.0 111.666 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 60.4 tp -62.85 -38.87 92.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.453 -0.794 . . . . 10.0 110.821 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -61.42 -52.17 65.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.474 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.24 -35.47 81.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.273 -0.422 . . . . 10.0 111.546 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.0 tmm? -68.06 -50.62 54.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.849 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 88.2 mt -63.23 -35.85 81.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.842 0.353 . . . . 10.0 110.229 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -61.53 -38.13 86.28 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 178.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 70' ' ' ARG . 3.8 tpp180 -68.17 -46.27 71.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.037 179.129 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 32.5 m0 -57.33 -50.94 71.33 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.827 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.52 -41.77 83.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.892 -0.594 . . . . 10.0 111.858 -179.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.83 -41.03 96.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.82 0.343 . . . . 10.0 111.668 -179.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -68.75 -34.07 74.96 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.316 -0.402 . . . . 10.0 111.266 -179.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.9 m -94.01 2.9 55.98 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.316 -0.402 . . . . 10.0 111.802 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 67.2 t30 57.74 55.26 5.61 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.366 0.603 . . . . 10.0 110.4 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 19.5 mtm -129.59 173.13 10.89 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.034 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -98.72 155.12 17.49 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.553 -0.294 . . . . 10.0 110.264 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.0 tp -132.2 135.57 46.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.919 0.39 . . . . 10.0 110.997 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.601 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 1.1 m -122.74 96.78 5.16 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.523 179.183 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.504 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 27.7 t80 -88.16 98.88 11.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.745 -0.662 . . . . 10.0 109.534 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -107.72 33.45 4.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.779 0.323 . . . . 10.0 111.463 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.436 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 39.4 mt -88.06 150.28 47.13 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 110.322 -0.251 . . . . 10.0 110.322 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -63.14 -29.56 74.4 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.577 2.185 . . . . 10.0 112.262 179.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.1 m -152.36 166.28 32.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.412 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.504 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 0.6 OUTLIER -87.97 140.44 29.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.507 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -120.98 144.94 48.24 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.935 0.398 . . . . 10.0 111.231 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.73 161.13 20.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.242 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.09 117.81 4.39 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.138 0.495 . . . . 10.0 110.573 179.125 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.6 pt -61.68 -35.97 70.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.407 -0.815 . . . . 10.0 112.162 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 137.87 -69.01 0.5 Allowed Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.633 -0.794 . . . . 10.0 112.285 -179.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.27 -13.12 36.25 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.718 2.278 . . . . 10.0 112.389 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.36 -32.46 53.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.631 0.729 . . . . 10.0 110.196 178.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.68 -10.58 59.84 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.834 -1.075 . . . . 10.0 111.261 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -92.32 -1.19 57.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.059 0.456 . . . . 10.0 110.715 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 56.9 mt -98.24 113.36 32.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.567 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.488 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 1.6 m -140.66 96.72 3.07 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.753 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.7 t -127.02 155.72 42.78 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.698 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.46 -5.05 52.71 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.356 -0.383 . . . . 10.0 111.972 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 62.3 m -100.27 119.38 38.31 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.906 -0.405 . . . . 10.0 109.906 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.72 -49.29 78.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.136 -0.484 . . . . 10.0 111.913 -178.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -62.07 -33.52 74.56 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.776 -0.647 . . . . 10.0 111.403 -178.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -73.36 -39.76 64.91 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.96 -48.74 79.08 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.216 179.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.11 -43.53 98.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.575 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 84.6 m -62.6 -44.75 95.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.963 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -66.15 -39.55 89.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.707 179.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 15.2 mt -61.06 -53.59 55.25 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.954 -0.387 . . . . 10.0 109.954 178.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.7 m -57.6 -31.78 66.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.589 -179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.98 -39.12 91.1 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.192 0.52 . . . . 10.0 110.789 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 6.4 t -90.61 -29.86 4.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.833 -0.622 . . . . 10.0 111.553 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -82.17 -24.04 35.2 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.465 1.283 . . . . 10.0 114.465 -177.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.76 -38.42 33.81 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.291 0.478 . . . . 10.0 112.291 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.97 -18.93 65.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.058 0.456 . . . . 10.0 111.717 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -97.71 -4.2 37.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.978 0.418 . . . . 10.0 110.209 179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.91 27.4 34.51 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.956 -0.64 . . . . 10.0 112.272 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.6 t -124.61 136.06 61.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 120.814 0.34 . . . . 10.0 110.642 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 29.4 m -140.39 123.18 16.38 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.935 0.397 . . . . 10.0 110.091 179.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 5.4 m -111.61 147.88 15.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.873 -179.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 19.1 m -150.65 155.93 40.35 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.133 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.438 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.4 t -112.17 115.75 50.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.126 -0.694 . . . . 10.0 109.126 179.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 14.5 m -136.55 117.92 14.67 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.146 -178.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 63.92 51.49 2.31 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.671 -0.695 . . . . 10.0 111.929 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 54.91 35.04 23.52 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.531 0.681 . . . . 10.0 110.813 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.601 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 75.6 tttt -140.54 133.37 29.05 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.485 -0.779 . . . . 10.0 109.827 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.438 ' CD2' HG22 ' A' ' 121' ' ' VAL . 94.0 mt -88.65 121.5 31.09 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 109.039 -0.726 . . . . 10.0 109.039 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.472 ' CD2' ' HB2' ' A' ' 80' ' ' SER . 13.2 mt -112.86 125.96 54.93 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.199 0.523 . . . . 10.0 110.809 -178.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 2.6 t -108.3 118.73 56.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 N-CA-C 108.222 -1.029 . . . . 10.0 108.222 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -127.98 138.09 32.19 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-O 120.841 0.353 . . . . 10.0 111.365 -178.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -81.62 133.24 8.15 Favored 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.133 1.888 . . . . 10.0 110.898 177.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 1.6 m . . . . . 0 C--N 1.317 -0.836 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.691 -179.657 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.8 t80 . . . . . 0 N--CA 1.456 -0.136 0 CA-C-O 120.952 0.406 . . . . 10.0 111.129 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.4 m -82.92 113.1 20.29 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.577 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.433 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 95.1 m-85 -83.29 107.54 15.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.525 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -147.6 174.07 12.11 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.818 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -100.91 127.55 47.33 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.381 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.6 p -109.71 153.9 42.74 Favored Pre-proline 0 C--N 1.323 -0.587 0 N-CA-C 109.872 -0.418 . . . . 10.0 109.872 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -66.85 -9.52 25.04 Favored 'Trans proline' 0 CA--C 1.529 0.264 0 C-N-CA 122.333 2.022 . . . . 10.0 111.626 179.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 61.8 mtm -84.6 -19.89 32.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.492 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -73.11 -57.9 3.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.151 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.05 -57.82 4.59 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.838 -0.696 . . . . 10.0 113.167 179.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.407 HG21 ' OD2' ' A' ' 86' ' ' ASP . 65.5 p -119.24 164.54 15.47 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.485 0.55 . . . . 10.0 112.485 -178.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 27.3 tp -61.35 -45.14 95.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.282 -0.872 . . . . 10.0 111.386 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.1 ttpt -59.17 -50.34 74.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.828 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.581 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 51.8 m -60.74 -43.45 97.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.948 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 57.0 ttp -60.72 -50.82 71.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.612 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 83.2 mt -63.55 -35.23 79.81 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.875 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -60.87 -43.37 98.51 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.624 -0.51 . . . . 10.0 109.624 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.581 ' HG2' ' O ' ' A' ' 66' ' ' THR . 31.6 mmt180 -64.93 -46.06 83.2 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.643 -0.708 . . . . 10.0 109.643 178.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 38.9 m0 -55.23 -50.54 69.15 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.469 -0.787 . . . . 10.0 110.793 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.404 ' HA ' ' HB2' ' A' ' 77' ' ' MET . . . -66.0 -52.14 52.04 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.338 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.93 -43.61 77.55 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.253 0.464 . . . . 10.0 112.253 -178.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -58.21 -35.83 72.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.909 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.1 m -105.38 18.75 21.75 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.24 0.459 . . . . 10.0 112.24 -178.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 65.4 t30 57.91 35.54 25.44 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.636 0.732 . . . . 10.0 111.209 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.404 ' HB2' ' HA ' ' A' ' 72' ' ' ALA . 72.6 mtp -103.19 173.88 6.11 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.839 -0.618 . . . . 10.0 110.035 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 70.7 mm-40 -114.02 157.91 21.88 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.819 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 43.6 tp -124.99 131.51 53.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.195 0.522 . . . . 10.0 110.958 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -115.59 96.37 5.6 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.562 -0.745 . . . . 10.0 109.251 178.644 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.54 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 6.6 t80 -91.45 98.57 11.77 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.097 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.455 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 42.2 m-80 -94.94 11.96 29.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.901 -179.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.499 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 45.2 mt -84.12 147.61 51.24 Favored Pre-proline 0 C--N 1.324 -0.523 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.29 -41.86 68.63 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.662 2.241 . . . . 10.0 112.634 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 2.1 m -147.11 170.49 17.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.096 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.54 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 7.0 p-10 -80.82 148.06 30.16 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -123.72 143.24 50.4 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.838 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.28 152.32 36.5 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.524 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.75 136.31 57.7 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.735 0.302 . . . . 10.0 110.245 178.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.5 pt -81.48 -27.62 10.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.534 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 138.37 -62.49 0.57 Allowed Glycine 0 CA--C 1.523 0.536 0 C-N-CA 120.217 -0.992 . . . . 10.0 113.282 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -58.61 -15.75 27.03 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 123.02 2.48 . . . . 10.0 113.098 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t -61.81 -36.64 74.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.922 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 1.1 m -71.66 -14.71 62.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.87 -0.604 . . . . 10.0 111.723 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -88.3 -1.31 57.95 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.052 0.453 . . . . 10.0 110.523 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 56.9 mt -101.65 111.77 32.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.771 -0.649 . . . . 10.0 109.371 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.0 m -139.99 97.16 3.19 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.112 0.482 . . . . 10.0 110.564 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.1 t -130.76 157.67 42.2 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.692 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.42 -18.29 30.31 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.462 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.03 113.31 25.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.619 -0.718 . . . . 10.0 110.275 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.433 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 9.8 p -61.14 -31.68 50.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.565 0.221 . . . . 10.0 111.269 -179.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -65.93 -41.1 91.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.945 0.402 . . . . 10.0 110.028 179.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -66.99 -41.96 85.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.923 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.05 -50.37 72.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.61 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.23 -36.44 79.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.582 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 63.0 m -64.18 -45.76 86.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.852 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -69.78 -39.19 76.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.862 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 112' ' ' TYR . 1.7 mp -63.34 -50.29 70.57 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.839 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.5 ' O ' ' HB3' ' A' ' 113' ' ' ALA . 11.2 p -62.73 -21.72 66.01 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.696 0.258 . . . . 10.0 111.696 -179.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.51 -48.03 51.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.891 0.376 . . . . 10.0 110.893 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.8 p -82.55 -28.48 8.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-O 121.421 0.629 . . . . 10.0 111.186 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.445 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.1 m-85 -81.28 -22.86 38.33 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.658 -0.701 . . . . 10.0 112.798 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' A' ' 109' ' ' SER . . . -49.65 -42.64 45.77 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 112.342 0.497 . . . . 10.0 112.342 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.96 -20.01 63.33 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.876 0.37 . . . . 10.0 111.377 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -87.81 -13.31 42.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.187 0.518 . . . . 10.0 109.955 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 95.61 24.93 14.5 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 115.717 -0.674 . . . . 10.0 112.48 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.445 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 96.5 t -128.27 130.9 69.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.052 0.453 . . . . 10.0 111.378 -179.184 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.6 m -127.54 111.61 13.98 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.236 -0.438 . . . . 10.0 109.979 178.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 3.3 m -102.57 142.39 16.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.077 0.465 . . . . 10.0 111.088 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 15.3 m -150.38 165.53 32.82 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.813 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 3.4 t -119.64 117.31 53.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 13.8 m -134.6 118.71 17.53 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.639 -0.255 . . . . 10.0 110.659 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 65.05 43.75 3.63 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 123.732 0.645 . . . . 10.0 111.147 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 4.6 t30 59.37 29.67 19.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.116 -0.947 . . . . 10.0 110.619 -179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -129.77 133.78 47.2 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.29 -0.868 . . . . 10.0 109.056 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 96.0 mt -87.97 122.01 31.06 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.727 -0.842 . . . . 10.0 108.727 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -113.3 116.0 29.04 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-O 121.207 0.527 . . . . 10.0 111.322 -178.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.455 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 3.2 t -99.33 117.63 44.73 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.077 0 N-CA-C 107.869 -1.159 . . . . 10.0 107.869 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -128.28 131.56 23.85 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-O 120.983 0.42 . . . . 10.0 111.096 -178.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -73.77 136.97 24.0 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.365 2.043 . . . . 10.0 110.78 178.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.316 -0.879 0 C-N-CA 120.827 -0.349 . . . . 10.0 110.202 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.9 t80 . . . . . 0 N--CA 1.455 -0.218 0 CA-C-O 121.142 0.496 . . . . 10.0 111.074 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.2 m -86.96 122.87 31.41 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.78 -0.646 . . . . 10.0 110.395 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -89.5 119.84 30.29 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.465 ' HG3' ' OG ' ' A' ' 97' ' ' SER . 1.9 tt0 -152.58 144.56 23.74 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.671 -178.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.618 ' HB3' ' SD ' ' A' ' 67' ' ' MET . . . -78.16 128.05 33.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.002 178.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.443 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 82.5 p -113.71 159.64 34.92 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 116.571 -0.286 . . . . 10.0 110.576 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.443 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 47.1 Cg_endo -69.53 -3.31 11.61 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.459 2.106 . . . . 10.0 112.122 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 45.2 mtt -88.24 -25.14 23.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.362 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -72.22 -58.61 3.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.054 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 86.95 -57.21 4.63 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.77 -0.729 . . . . 10.0 112.895 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.63 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 65.3 p -121.52 172.57 7.98 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.426 0.528 . . . . 10.0 112.426 -179.366 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 25.7 tp -64.19 -48.62 75.22 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.114 -0.948 . . . . 10.0 111.752 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -58.79 -43.99 90.62 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.012 0.434 . . . . 10.0 110.472 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.8 m -66.51 -39.78 88.84 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.485 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.618 ' SD ' ' HB3' ' A' ' 57' ' ' ALA . 54.7 ttp -66.87 -50.14 63.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.044 0.45 . . . . 10.0 111.055 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 75.1 mt -62.17 -37.71 86.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.276 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -60.49 -41.34 94.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.284 179.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -65.78 -47.63 74.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.285 179.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 43.5 m0 -58.19 -51.94 67.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.574 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.69 -42.48 99.65 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.784 -0.643 . . . . 10.0 111.515 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.4 -44.77 95.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.727 0.298 . . . . 10.0 111.755 -179.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.15 -40.27 95.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.372 -0.376 . . . . 10.0 111.417 -179.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.9 m -94.0 6.96 46.83 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.897 -178.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 46.9 t30 55.85 49.25 16.43 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.239 0.542 . . . . 10.0 111.272 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.451 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 10.8 mtm -114.68 174.0 6.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.756 -179.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 26.6 mp0 -102.15 163.1 12.42 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.68 -179.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 45.9 tp -130.88 138.82 49.99 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.179 0.514 . . . . 10.0 111.134 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -124.54 96.23 4.82 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.432 -0.804 . . . . 10.0 109.142 178.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.48 ' CZ ' HD11 ' A' ' 83' ' ' LEU . 4.7 t80 -92.31 98.34 11.44 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.427 -0.583 . . . . 10.0 109.427 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . 0.413 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 15.0 m120 -96.89 24.03 6.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.122 0.487 . . . . 10.0 110.589 -179.316 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.48 HD11 ' CZ ' ' A' ' 81' ' ' TYR . 44.4 mt -93.51 142.48 25.24 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.425 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.84 -29.84 58.59 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.898 2.399 . . . . 10.0 112.327 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.2 m -147.46 153.26 39.34 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.587 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.479 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 34.3 t0 -80.68 125.12 29.64 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -100.47 149.8 23.31 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.643 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.63 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 2.0 t -92.84 151.95 19.7 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.7 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -50.59 121.67 6.11 Favored 'General case' 0 C--N 1.337 0.042 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.868 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.0 pt -67.01 -29.57 46.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.562 . . . . 10.0 111.935 -179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 141.72 -68.45 0.46 Allowed Glycine 0 CA--C 1.52 0.344 0 C-N-CA 120.375 -0.916 . . . . 10.0 113.2 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.17 -7.28 3.58 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.639 2.893 . . . . 10.0 113.868 -179.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 5.8 t -68.07 -32.79 57.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.239 0.542 . . . . 10.0 110.452 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 1.5 m -72.62 -13.73 61.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.938 -0.573 . . . . 10.0 111.436 -179.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -89.5 -0.1 57.26 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.044 0.449 . . . . 10.0 110.562 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 51.6 mt -97.95 111.0 26.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.584 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.465 ' OG ' ' HG3' ' A' ' 56' ' ' GLN . 2.8 m -134.08 98.78 4.23 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.697 -179.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 12.8 t -129.76 155.69 45.52 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.442 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -90.24 -9.47 47.89 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.798 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.4 t -104.29 123.76 47.95 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.662 0.267 . . . . 10.0 110.908 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 13.1 p -65.99 -29.7 47.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-O 121.123 0.487 . . . . 10.0 110.104 179.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -69.93 -41.45 74.58 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.733 179.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -68.7 -39.43 80.5 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.83 -48.8 77.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.658 179.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.46 -35.38 80.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.324 0.583 . . . . 10.0 110.473 179.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 92.8 m -67.34 -47.5 70.28 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.46 -0.791 . . . . 10.0 110.802 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -69.6 -40.89 76.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.881 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.5 mp -59.04 -48.28 82.17 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.773 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 59.2 m -59.55 -31.91 69.86 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 111.86 0.318 . . . . 10.0 111.86 -179.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.4 -37.42 83.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.375 0.607 . . . . 10.0 110.833 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 2.7 t -87.47 -42.74 15.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.521 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.458 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 13.2 m-30 -64.83 -26.63 68.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.166 -0.925 . . . . 10.0 112.504 -178.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -55.37 -31.42 61.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.774 0.321 . . . . 10.0 111.389 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.74 -11.54 59.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.91 0.386 . . . . 10.0 111.198 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 -109.96 -0.28 18.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.566 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 82.36 28.13 41.26 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.95 -0.643 . . . . 10.0 112.855 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.458 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 74.1 t -127.54 143.86 39.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.952 0.406 . . . . 10.0 110.338 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.9 m -142.47 138.83 31.28 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 178.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 9.9 m -126.32 143.24 40.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.407 0.623 . . . . 10.0 111.782 -178.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.2 m -150.84 139.85 21.02 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.429 178.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 2.3 p -102.48 121.0 53.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.3 m -139.91 124.51 18.2 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.767 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.4 48.62 7.63 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 123.537 0.523 . . . . 10.0 111.476 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.451 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 23.6 m120 57.69 33.01 22.7 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.783 -0.644 . . . . 10.0 111.498 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -137.19 129.9 30.24 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.6 -0.519 . . . . 10.0 109.6 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 37.3 mt -87.54 120.73 29.14 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 107.8 -1.185 . . . . 10.0 107.8 178.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.71 118.97 37.93 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.103 0.478 . . . . 10.0 111.591 -178.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 3.0 t -104.44 118.36 51.57 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.957 0 N-CA-C 108.187 -1.042 . . . . 10.0 108.187 178.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -131.01 131.25 23.09 Favored Pre-proline 0 C--N 1.317 -0.827 0 CA-C-O 120.741 0.305 . . . . 10.0 110.96 -178.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -72.14 134.38 23.03 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.467 2.111 . . . . 10.0 111.058 179.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.315 -0.912 0 N-CA-C 109.892 -0.41 . . . . 10.0 109.892 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 21.2 t80 . . . . . 0 N--CA 1.449 -0.486 0 CA-C-O 120.75 0.309 . . . . 10.0 110.45 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.6 m -73.92 115.6 13.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.077 0.465 . . . . 10.0 110.358 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.409 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 91.4 m-85 -84.19 105.27 14.92 Favored 'General case' 0 C--N 1.313 -1.022 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -141.05 147.27 38.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.314 -179.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.537 ' HB1' ' SD ' ' A' ' 67' ' ' MET . . . -75.52 117.3 17.16 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.398 -0.593 . . . . 10.0 109.398 178.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 61.8 p -101.67 152.49 38.09 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 116.307 -0.406 . . . . 10.0 111.094 -178.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -64.98 -13.86 42.03 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.655 2.237 . . . . 10.0 112.416 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.5 ptp -86.78 -6.27 58.87 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.93 0.395 . . . . 10.0 110.447 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -84.14 -58.49 2.74 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 179.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 86.19 -60.24 4.6 Favored Glycine 0 N--CA 1.445 -0.754 0 CA-C-N 115.649 -0.705 . . . . 10.0 113.319 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 31.9 p -116.48 166.5 12.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.551 0.691 . . . . 10.0 112.705 -178.329 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.93 -46.25 82.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.368 -1.287 . . . . 10.0 111.392 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 29.9 ttmt -58.27 -56.7 18.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.922 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.1 m -56.49 -42.66 78.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.0 -0.546 . . . . 10.0 111.804 -179.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.537 ' SD ' ' HB1' ' A' ' 57' ' ' ALA . 50.2 ttp -59.77 -54.09 50.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.826 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.5 mt -64.81 -36.22 83.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.16 -0.473 . . . . 10.0 111.109 -179.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -60.18 -45.34 93.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.775 0.321 . . . . 10.0 110.323 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -66.3 -38.87 88.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.634 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 39.2 m0 -62.57 -53.74 50.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.325 0.583 . . . . 10.0 109.938 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.36 -39.88 92.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.225 -0.898 . . . . 10.0 111.637 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.69 -39.86 81.94 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.295 0.48 . . . . 10.0 112.295 -179.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -66.11 -36.16 82.43 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.87 0.322 . . . . 10.0 111.87 -178.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.401 ' HB2' ' SD ' ' A' ' 77' ' ' MET . 19.7 m -103.01 13.48 34.2 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 111.807 0.299 . . . . 10.0 111.807 -179.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 54.67 43.33 30.33 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.414 0.626 . . . . 10.0 111.29 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.462 ' HE2' ' CD2' ' A' ' 126' ' ' LEU . 64.2 mtp -102.97 160.49 14.57 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.205 -179.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -97.41 154.29 17.56 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 36.7 tp -122.01 133.89 54.81 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.483 0.659 . . . . 10.0 111.438 -179.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.427 ' CB ' HD12 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -114.76 95.39 5.21 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.145 -0.934 . . . . 10.0 109.03 179.04 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.494 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 9.8 t80 -99.94 95.79 7.12 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.987 0.422 . . . . 10.0 109.993 -179.427 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 20.8 m-20 -98.83 10.7 40.73 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.752 -179.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.494 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 40.4 mt -71.0 142.55 87.81 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.13 179.495 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.36 -39.23 92.63 Favored 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.842 2.361 . . . . 10.0 112.349 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 37.9 m -148.07 171.92 15.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.675 0.274 . . . . 10.0 110.585 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -82.32 135.57 35.18 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -113.17 128.62 56.53 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.999 -0.281 . . . . 10.0 110.279 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.0 OUTLIER -70.51 148.26 48.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.243 179.614 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.36 109.18 0.72 Allowed 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.4 pt -55.94 -37.05 46.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.417 -0.81 . . . . 10.0 112.503 -178.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 151.95 -70.62 0.3 Allowed Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.193 -1.003 . . . . 10.0 112.995 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -55.31 -16.88 14.36 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.544 2.829 . . . . 10.0 113.422 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -59.94 -35.57 61.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.905 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.4 -8.71 55.55 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.25 0.463 . . . . 10.0 112.25 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.15 -1.98 57.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.885 0.374 . . . . 10.0 111.208 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 36.9 mt -93.78 107.05 18.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 109.695 -0.483 . . . . 10.0 109.695 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -133.97 91.54 2.83 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.141 0.496 . . . . 10.0 111.792 -179.257 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.6 t -130.33 155.2 46.73 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.117 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.3 p -87.33 -18.26 30.52 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 121.003 0.43 . . . . 10.0 110.522 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.5 m -88.72 108.53 19.53 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.648 179.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.409 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 11.3 p -57.36 -33.52 43.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.632 -178.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -67.72 -39.7 84.31 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -66.61 -42.89 86.13 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.29 -50.6 66.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.344 -0.844 . . . . 10.0 110.338 178.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.45 -35.94 79.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.996 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 48.0 m -64.53 -45.11 88.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.578 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -72.07 -38.07 69.49 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.597 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 62.8 mt -60.14 -50.72 72.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.666 179.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 72.2 m -58.34 -28.87 65.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.305 -0.407 . . . . 10.0 112.054 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.42 -37.24 82.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.19 0.519 . . . . 10.0 110.545 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 11.0 t -86.06 -41.01 14.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 121.424 0.63 . . . . 10.0 110.324 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.505 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 14.2 m-30 -66.56 -26.88 67.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.857 -1.065 . . . . 10.0 113.11 -178.371 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.91 -31.21 64.67 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.787 0.292 . . . . 10.0 111.787 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.22 -14.5 60.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.853 0.359 . . . . 10.0 111.232 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -107.83 -10.65 15.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.242 -0.436 . . . . 10.0 111.088 -179.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 95.2 31.79 7.41 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.645 -0.788 . . . . 10.0 113.155 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.505 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 69.1 t -131.1 142.43 43.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.871 0.367 . . . . 10.0 110.993 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -135.46 138.02 42.77 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 178.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.453 ' HA ' ' O ' ' A' ' 127' ' ' LEU . 14.4 m -130.99 143.72 40.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.143 0.496 . . . . 10.0 111.157 -179.429 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 19.9 m -152.64 153.38 33.21 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.865 179.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.489 HG22 ' CD1' ' A' ' 126' ' ' LEU . 5.7 t -106.1 118.16 53.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 68.7 m -140.43 118.46 11.89 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.561 -0.291 . . . . 10.0 111.05 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.88 51.06 4.86 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.607 -0.724 . . . . 10.0 112.021 179.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.7 t30 58.49 28.08 16.44 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.262 179.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -136.2 135.68 39.32 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.321 -0.4 . . . . 10.0 110.301 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.489 ' CD1' HG22 ' A' ' 121' ' ' VAL . 2.5 mm? -88.84 121.71 31.48 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.916 -0.772 . . . . 10.0 108.916 178.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 119' ' ' VAL . 4.6 mm? -102.19 115.74 31.19 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.946 0.403 . . . . 10.0 110.412 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 2.7 t -112.02 118.38 57.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 N-CA-C 108.501 -0.926 . . . . 10.0 108.501 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -136.2 144.68 48.98 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-O 120.814 0.34 . . . . 10.0 111.114 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -75.8 141.63 24.63 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.254 1.969 . . . . 10.0 111.213 178.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.6 m . . . . . 0 C--N 1.323 -0.579 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.504 179.522 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.9 t80 . . . . . 0 C--O 1.235 0.306 0 CA-C-O 121.058 0.456 . . . . 10.0 111.038 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.6 m -95.46 120.87 36.46 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.593 -0.731 . . . . 10.0 110.642 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.437 ' CE2' HG22 ' A' ' 101' ' ' VAL . 36.7 m-85 -82.11 112.29 19.02 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.314 -0.624 . . . . 10.0 109.314 179.209 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -153.05 160.33 42.95 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.188 -179.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.23 137.63 40.09 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.736 -0.468 . . . . 10.0 109.736 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.406 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 40.0 p -121.9 163.19 32.86 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.426 -178.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.406 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 71.7 Cg_endo -79.64 10.39 3.1 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 121.443 1.429 . . . . 10.0 112.15 179.013 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 22.1 mmt -112.62 -12.77 13.38 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 113.518 0.933 . . . . 10.0 113.518 -178.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.47 -66.17 0.66 Allowed 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.336 -0.546 . . . . 10.0 110.54 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.92 -63.73 0.27 Allowed Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 120.995 -0.621 . . . . 10.0 111.734 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 82.1 p -128.93 175.63 8.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.729 0.299 . . . . 10.0 110.893 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 50.7 tp -57.95 -41.96 83.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.526 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -60.0 -51.11 71.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.775 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.01 -41.34 97.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.308 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 41.1 ttp -61.41 -50.87 71.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.761 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 93.6 mt -63.77 -41.34 97.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.784 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -60.06 -41.59 92.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.531 179.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.6 ttm180 -65.67 -44.62 85.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.465 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 44.9 m0 -58.69 -48.25 81.75 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.458 0.647 . . . . 10.0 110.093 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.93 -46.13 79.32 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.105 -0.952 . . . . 10.0 111.416 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -56.88 -45.32 82.63 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.359 0.503 . . . . 10.0 112.359 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -64.08 -32.1 73.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.147 0.498 . . . . 10.0 110.811 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.9 m -98.41 12.0 36.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.932 -0.577 . . . . 10.0 111.925 -178.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 56.06 43.41 27.06 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.363 0.601 . . . . 10.0 111.204 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 72.2 mtp -117.05 173.85 6.43 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.721 -179.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -114.45 166.82 11.29 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.558 -179.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.1 tp -136.62 138.65 41.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.961 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.487 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 35.5 m -121.4 96.93 5.28 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.378 -0.828 . . . . 10.0 110.475 179.471 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.487 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 8.0 t80 -89.67 108.17 19.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.033 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -103.84 12.84 33.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.971 0.415 . . . . 10.0 111.578 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.456 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 35.0 mt -87.09 144.97 37.15 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.796 -0.446 . . . . 10.0 109.796 179.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -57.69 -46.71 25.09 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.876 2.384 . . . . 10.0 112.845 -179.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.0 m -133.65 161.41 34.72 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.474 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.487 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 2.3 p30 -78.08 147.83 34.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.152 -0.476 . . . . 10.0 109.924 179.239 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -120.02 139.38 52.59 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.142 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.57 153.58 31.08 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . 0.429 ' H ' HD21 ' A' ' 89' ' ' LEU . 0.5 OUTLIER -60.33 122.38 14.38 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 179.239 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.7 pt -62.7 -29.8 47.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 113.086 0.773 . . . . 10.0 113.086 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 144.85 -64.77 0.46 Allowed Glycine 0 CA--C 1.517 0.164 0 C-N-CA 120.054 -1.07 . . . . 10.0 112.749 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -65.36 0.91 2.39 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.748 2.298 . . . . 10.0 112.847 179.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.8 t -67.8 -42.75 86.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.049 0.452 . . . . 10.0 110.365 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.59 -15.08 60.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.321 179.096 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -80.31 -7.27 58.97 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.924 0.392 . . . . 10.0 110.573 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 29.8 mt -96.37 110.85 25.37 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 116.051 -0.522 . . . . 10.0 109.879 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 11.0 m -139.73 95.54 2.93 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.447 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.0 t -131.45 155.97 46.44 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.827 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -88.9 -14.44 36.78 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.086 0.47 . . . . 10.0 110.965 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.3 m -92.84 124.74 37.05 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.513 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.437 HG22 ' CE2' ' A' ' 55' ' ' TYR . 1.2 t -62.22 -46.33 96.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.12 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -60.86 -32.87 72.28 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.467 -0.788 . . . . 10.0 110.907 -179.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -71.97 -41.04 68.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.229 -0.441 . . . . 10.0 109.884 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.34 -50.17 75.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.698 -0.683 . . . . 10.0 110.664 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.77 -37.54 87.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.159 0.504 . . . . 10.0 110.694 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 37.4 m -63.76 -49.19 73.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.806 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.34 -40.37 93.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.492 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 47.7 mt -60.57 -51.09 70.89 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.331 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.4 m -58.5 -33.25 69.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.354 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.32 -40.19 93.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.939 0.4 . . . . 10.0 111.048 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.9 t -87.78 -39.76 13.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.359 0.6 . . . . 10.0 111.105 -179.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.483 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 12.7 m-30 -66.58 -24.64 66.37 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.36 -0.836 . . . . 10.0 112.711 -178.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -51.43 -37.43 48.5 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.889 0.329 . . . . 10.0 111.889 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.66 -9.48 54.4 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.807 0.337 . . . . 10.0 111.592 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -112.35 2.33 16.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.864 0.364 . . . . 10.0 110.188 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 77.92 26.36 60.51 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 115.841 -0.618 . . . . 10.0 113.049 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.483 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 96.3 t -121.85 140.46 45.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.607 0.242 . . . . 10.0 110.734 -179.458 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.4 t -139.21 140.72 37.84 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.563 -0.532 . . . . 10.0 109.563 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 9.8 m -131.19 139.81 50.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.897 0.379 . . . . 10.0 110.657 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.1 m -142.89 156.83 44.98 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.605 -0.27 . . . . 10.0 110.382 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.542 HG21 ' CD2' ' A' ' 126' ' ' LEU . 5.3 t -109.43 114.44 46.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 108.65 -0.87 . . . . 10.0 108.65 179.053 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 15.8 m -132.83 118.2 18.68 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.668 -178.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 63.6 42.33 6.54 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.674 0.609 . . . . 10.0 110.752 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 5.4 t30 61.04 27.81 17.64 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.784 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.487 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 36.5 tttt -130.0 135.54 48.4 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.542 ' CD2' HG21 ' A' ' 121' ' ' VAL . 88.2 mt -88.55 122.63 32.22 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.704 0.288 . . . . 10.0 110.232 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -108.2 125.83 52.09 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.699 -179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 6.6 t -113.57 119.95 62.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.36 -0.607 . . . . 10.0 109.36 178.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -140.82 148.09 51.11 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.634 0.254 . . . . 10.0 110.51 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -76.89 147.2 26.88 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.378 2.052 . . . . 10.0 111.913 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.8 m . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.922 179.851 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.413 ' CD2' ' HB3' ' A' ' 74' ' ' ASP . 13.6 t80 . . . . . 0 C--O 1.234 0.239 0 CA-C-O 120.603 0.24 . . . . 10.0 110.364 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.1 m -79.14 118.49 21.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.284 0.564 . . . . 10.0 111.084 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -83.5 109.31 17.26 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.751 -0.658 . . . . 10.0 110.184 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.408 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 12.0 pt20 -147.36 154.82 41.36 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.829 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . 0.434 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -85.42 124.59 32.18 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.049 0.452 . . . . 10.0 110.0 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.408 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 73.0 p -117.01 158.91 42.94 Favored Pre-proline 0 C--N 1.317 -0.807 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.225 -179.459 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . 0.408 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 45.2 Cg_endo -68.23 -7.98 21.55 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 121.997 1.798 . . . . 10.0 111.322 179.061 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 52.3 mtm -82.85 -20.33 35.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.82 179.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -75.64 -59.39 2.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.857 -0.61 . . . . 10.0 109.461 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 91.51 -61.98 2.77 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.799 -0.715 . . . . 10.0 112.938 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 49.5 p -124.45 166.29 16.27 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.939 0.399 . . . . 10.0 111.551 -179.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 45.2 tp -56.85 -44.73 82.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.492 -0.776 . . . . 10.0 111.217 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.447 ' O ' ' HG3' ' A' ' 69' ' ' GLU . 36.9 ttmt -59.87 -53.62 55.81 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.379 -179.837 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' THR . . . . . 0.553 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 2.3 m -57.49 -43.81 84.46 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.423 -0.353 . . . . 10.0 111.069 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 52.0 ttp -57.63 -51.52 69.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.121 0.486 . . . . 10.0 110.407 179.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 77.0 mt -64.95 -36.86 85.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.131 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 22.3 mt-10 -63.86 -41.0 97.88 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 110.261 -0.274 . . . . 10.0 110.261 179.002 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.553 ' HG2' ' O ' ' A' ' 66' ' ' THR . 32.0 mmt180 -69.32 -39.26 78.33 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 179.05 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 37.6 m0 -61.93 -54.77 37.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.734 179.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -59.89 -44.11 94.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.531 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.433 ' HB1' ' O ' ' A' ' 69' ' ' GLU . . . -64.95 -36.25 83.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.734 0.302 . . . . 10.0 111.541 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 70' ' ' ARG . 0.5 OUTLIER -73.28 -12.89 61.01 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.887 0.375 . . . . 10.0 111.424 -179.304 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.5 m -120.58 12.28 11.48 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.437 -0.347 . . . . 10.0 111.312 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 62.2 t30 56.05 51.68 11.6 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.358 0.599 . . . . 10.0 110.619 179.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.408 ' HG2' ' OD1' ' A' ' 124' ' ' ASN . 71.1 mtp -124.27 171.17 10.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.984 -0.553 . . . . 10.0 111.029 -179.093 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -101.68 164.87 11.52 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.063 179.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.7 tp -141.52 142.48 33.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.344 0.593 . . . . 10.0 111.473 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.426 ' HB2' ' HG ' ' A' ' 127' ' ' LEU . 12.9 m -131.12 97.38 4.28 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.13 -0.941 . . . . 10.0 110.525 179.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.632 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 15.7 t80 -91.01 103.48 16.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.298 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -93.41 0.99 57.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.766 0.317 . . . . 10.0 111.65 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.632 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 2.1 mm? -74.33 137.13 75.01 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.316 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.56 -26.66 54.12 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.969 2.446 . . . . 10.0 112.577 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 57.2 m -141.19 161.92 36.71 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.946 0.403 . . . . 10.0 111.033 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -85.91 143.67 28.07 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.974 179.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -121.37 134.91 55.13 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.223 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.07 161.37 29.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.57 -0.286 . . . . 10.0 110.371 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.98 107.96 3.33 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.0 pt -47.99 -46.13 12.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.621 -0.718 . . . . 10.0 112.533 -178.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 165.38 -69.33 0.19 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.044 -1.074 . . . . 10.0 112.881 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -56.41 -13.4 10.16 Favored 'Trans proline' 0 N--CA 1.478 0.583 0 C-N-CA 123.661 2.907 . . . . 10.0 113.39 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.1 t -60.47 -36.31 68.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.246 0.546 . . . . 10.0 110.346 179.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.434 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.8 m -69.34 -12.0 61.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.605 -0.725 . . . . 10.0 111.51 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.48 -1.19 53.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.936 0.398 . . . . 10.0 110.921 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.408 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 53.6 mt -98.36 113.72 33.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.801 -0.444 . . . . 10.0 109.801 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.1 m -142.29 95.39 2.79 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.979 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.0 t -131.02 153.58 49.1 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.549 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.09 -8.71 58.54 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.903 0.382 . . . . 10.0 111.315 179.498 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.8 t -100.02 119.18 37.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.578 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 12.8 p -65.78 -30.85 51.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-O 121.024 0.44 . . . . 10.0 110.255 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -69.07 -41.94 76.88 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 52.9 tp60 -66.43 -40.9 89.79 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.597 178.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.61 -49.09 78.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.331 179.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.82 -35.96 79.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.169 0.509 . . . . 10.0 110.221 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 95.0 m -66.14 -49.29 67.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.965 179.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -65.8 -44.73 84.81 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.028 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 64.1 mt -59.85 -49.24 78.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.676 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.416 ' O ' ' HB2' ' A' ' 113' ' ' ALA . 49.4 m -62.38 -23.45 66.82 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.551 0.204 . . . . 10.0 111.551 -179.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.79 -41.43 78.74 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.837 0.351 . . . . 10.0 110.656 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.4 p -89.03 -32.63 5.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.408 0.623 . . . . 10.0 111.326 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.42 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.5 m-30 -77.67 -23.42 49.6 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.254 0.835 . . . . 10.0 113.254 -178.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 109' ' ' SER . . . -49.08 -49.32 42.28 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 111.78 0.289 . . . . 10.0 111.78 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.85 -22.86 67.07 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.112 0.482 . . . . 10.0 111.441 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -84.89 -15.02 45.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.264 0.554 . . . . 10.0 110.306 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 94.68 25.99 14.16 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.747 -0.739 . . . . 10.0 112.275 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . 0.42 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 95.4 t -129.54 138.39 54.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.929 0.395 . . . . 10.0 110.877 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.1 m -138.34 120.98 16.27 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.058 0.456 . . . . 10.0 110.314 178.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.47 ' CG1' HG11 ' A' ' 128' ' ' VAL . 3.9 m -104.78 137.46 33.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.171 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.96 140.47 23.38 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.191 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 1.7 p -107.96 123.2 63.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.186 0.517 . . . . 10.0 109.685 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 56.4 m -143.72 132.99 23.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.578 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 59.1 39.86 22.65 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.317 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . 0.408 ' OD1' ' HG2' ' A' ' 77' ' ' MET . 18.8 t30 63.81 24.18 13.68 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.488 -0.778 . . . . 10.0 111.048 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 41.5 tttt -128.03 133.13 49.08 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.251 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 17.2 mt -89.04 121.44 31.38 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.595 -0.891 . . . . 10.0 108.595 178.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.426 ' HG ' ' HB2' ' A' ' 80' ' ' SER . 0.3 OUTLIER -117.34 122.95 45.31 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.174 0.511 . . . . 10.0 110.876 -179.358 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . 0.552 ' CG1' HD21 ' A' ' 83' ' ' LEU . 1.8 t -111.26 121.03 63.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.632 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -134.94 146.05 57.09 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.076 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -76.54 150.77 32.09 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.316 2.011 . . . . 10.0 111.676 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.323 -0.576 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.659 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.8 t80 . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 109.931 -0.396 . . . . 10.0 109.931 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.8 m -76.95 122.81 25.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.728 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' TYR . . . . . 0.458 ' O ' ' HA ' ' A' ' 97' ' ' SER . 95.2 m-85 -89.96 121.99 32.56 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.562 -0.744 . . . . 10.0 109.979 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.408 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 19.8 pt20 -152.21 153.06 33.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.688 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.17 121.26 28.52 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 52.2 p -111.54 154.41 43.86 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-O 120.69 0.281 . . . . 10.0 111.322 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.92 -10.54 27.26 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.726 2.284 . . . . 10.0 111.83 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 21.4 mmt -82.4 -18.54 41.61 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.189 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -79.35 -52.78 7.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.694 -0.685 . . . . 10.0 109.575 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 92.82 -67.35 1.85 Allowed Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.464 -0.789 . . . . 10.0 112.855 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' THR . . . . . 0.478 HG23 ' OD2' ' A' ' 86' ' ' ASP . 28.4 p -118.58 169.39 9.83 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.79 0.329 . . . . 10.0 111.512 -179.19 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.463 HD13 ' CE2' ' A' ' 112' ' ' TYR . 41.2 tp -59.35 -36.43 75.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.679 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -61.16 -58.3 8.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.527 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.39 -33.31 75.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.161 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.435 ' HB2' ' O ' ' A' ' 63' ' ' THR . 4.4 tmm? -63.03 -54.8 32.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.733 -0.667 . . . . 10.0 111.166 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.0 mp -68.42 -31.52 70.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.317 -0.401 . . . . 10.0 111.263 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -57.84 -43.5 85.88 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.706 -0.479 . . . . 10.0 109.706 178.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -68.47 -42.35 78.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.119 179.483 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 25.4 m0 -55.85 -55.42 32.67 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.624 -0.717 . . . . 10.0 110.683 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.82 -45.54 85.79 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.072 -0.967 . . . . 10.0 111.702 -178.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.95 -40.76 90.07 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.929 0.344 . . . . 10.0 111.929 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -66.24 -27.83 68.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.012 0.434 . . . . 10.0 111.51 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.0 m -108.76 11.65 26.18 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 55.55 48.42 18.76 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.589 0.709 . . . . 10.0 110.67 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 59.1 mtp -114.65 168.09 10.18 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.164 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -99.88 158.99 15.42 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.655 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 26.8 tp -132.83 128.26 36.31 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.571 0.7 . . . . 10.0 110.935 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 69.4 m -114.96 94.75 4.89 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 114.972 -1.013 . . . . 10.0 109.427 178.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.491 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 12.5 t80 -94.45 101.46 13.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.808 -179.164 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -105.23 28.37 7.36 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.99 0.424 . . . . 10.0 111.473 -179.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.482 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 34.2 mt -96.01 145.85 30.27 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.052 179.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.4 -38.43 89.33 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 123.183 2.589 . . . . 10.0 112.547 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.4 m -150.73 171.09 17.71 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.992 0.425 . . . . 10.0 110.888 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.491 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 8.9 p-10 -83.1 131.56 35.14 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.718 -0.674 . . . . 10.0 109.839 179.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -103.79 131.74 50.7 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.747 -179.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.65 150.8 48.53 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.441 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.28 108.86 0.67 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 120.977 0.418 . . . . 10.0 110.09 178.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.2 pt -52.57 -37.93 25.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.071 -0.968 . . . . 10.0 112.91 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 141.17 -72.38 0.4 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.291 -0.957 . . . . 10.0 112.071 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -57.07 -17.05 23.3 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 123.039 2.493 . . . . 10.0 112.367 179.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 10.2 p -63.8 -32.0 55.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.512 0.672 . . . . 10.0 110.267 178.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 1.4 m -72.53 -7.42 49.93 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.153 -0.931 . . . . 10.0 111.08 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.2 -4.72 48.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.315 0.578 . . . . 10.0 110.237 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . 0.408 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 65.1 mt -92.2 112.51 25.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 CA-C-N 115.422 -0.808 . . . . 10.0 109.82 -179.368 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.458 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 1.7 m -142.61 97.9 3.2 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.605 -0.725 . . . . 10.0 109.821 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.1 t -131.38 157.16 44.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.747 0.308 . . . . 10.0 110.888 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.03 -21.79 39.88 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.786 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.2 t -90.16 119.03 30.14 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.771 0.32 . . . . 10.0 110.491 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.0 p -65.04 -31.69 55.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.85 0.357 . . . . 10.0 110.556 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -68.9 -41.24 78.51 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 109.546 -0.539 . . . . 10.0 109.546 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -66.75 -41.43 87.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.845 179.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.57 -47.09 76.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.158 178.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.11 -35.21 80.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.295 178.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 86.0 m -65.58 -48.42 72.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.228 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -65.17 -37.56 87.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.089 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' LEU . . . . . 0.496 ' O ' HG13 ' A' ' 111' ' ' VAL . 1.8 mp -63.91 -52.78 58.29 Favored 'General case' 0 C--O 1.219 -0.508 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.22 178.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.6 m -57.91 -29.61 65.24 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.967 0.358 . . . . 10.0 111.967 -179.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.2 -45.78 91.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.255 0.55 . . . . 10.0 110.51 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . 0.496 HG13 ' O ' ' A' ' 108' ' ' LEU . 11.9 p -89.55 -22.65 6.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.756 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' TYR . . . . . 0.463 ' CE2' HD13 ' A' ' 64' ' ' LEU . 3.7 m-85 -83.13 -24.08 32.74 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.143 0.794 . . . . 10.0 113.143 -178.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.63 -40.11 38.23 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.077 0.399 . . . . 10.0 112.077 -179.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.47 -19.49 63.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.103 0.478 . . . . 10.0 111.402 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -93.72 -2.57 53.63 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.398 0.618 . . . . 10.0 109.632 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.22 23.33 52.01 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 115.466 -0.788 . . . . 10.0 112.625 179.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 60.8 t -124.55 140.25 48.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.026 0.441 . . . . 10.0 111.546 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 6.6 m -139.94 122.6 16.34 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.359 -0.608 . . . . 10.0 109.359 178.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 10.8 m -114.65 149.35 16.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.143 0.497 . . . . 10.0 111.358 -178.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.0 p -152.13 170.47 19.89 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.088 -0.506 . . . . 10.0 109.872 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' VAL . . . . . 0.464 HG23 ' CD2' ' A' ' 126' ' ' LEU . 3.5 t -125.7 119.07 53.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.173 -0.677 . . . . 10.0 109.173 179.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 15.3 m -128.73 109.62 11.47 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.028 -179.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 58.99 57.69 3.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.63 -0.714 . . . . 10.0 112.06 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 19.9 t30 61.13 21.6 12.0 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.569 -0.742 . . . . 10.0 111.782 178.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 47.8 tttt -125.54 133.12 52.45 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.984 -0.376 . . . . 10.0 109.984 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.464 ' CD2' HG23 ' A' ' 121' ' ' VAL . 69.6 mt -87.95 122.23 31.31 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.511 -0.551 . . . . 10.0 109.511 179.307 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -107.93 117.24 33.6 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.533 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 11.5 t -109.05 118.06 55.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 108.515 -0.92 . . . . 10.0 108.515 178.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -134.19 141.66 40.24 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-O 120.766 0.317 . . . . 10.0 110.569 -179.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -81.31 145.21 14.97 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.313 2.009 . . . . 10.0 111.365 179.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 1.7 m . . . . . 0 C--N 1.323 -0.579 0 C-N-CA 120.942 -0.303 . . . . 10.0 110.617 179.381 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.729 0 N-CA-C 111.421 -0.671 . . . . 10.0 111.421 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.5 m -142.44 134.28 27.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.034 0.445 . . . . 10.0 111.157 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -125.64 76.11 1.54 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.732 -0.84 . . . . 10.0 108.732 178.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 17.5 ttt -68.47 110.41 4.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.584 -0.735 . . . . 10.0 110.929 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.52 105.92 5.87 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.793 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -77.57 137.54 63.23 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 109.774 -0.454 . . . . 10.0 109.774 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.11 111.66 0.81 Allowed 'Trans proline' 0 C--O 1.235 0.349 0 C-N-CA 122.835 2.356 . . . . 10.0 112.037 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -120.03 145.79 40.69 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.538 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -79.67 149.78 21.14 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.708 2.272 . . . . 10.0 112.209 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -89.14 171.63 9.67 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.951 -0.388 . . . . 10.0 109.951 179.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -125.47 153.6 43.27 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.658 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 148.08 -126.39 2.32 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.847 -0.692 . . . . 10.0 111.846 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -157.02 27.18 0.51 Allowed Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.471 -0.871 . . . . 10.0 112.59 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 34.3 ptt180 -78.06 -30.31 49.69 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.829 0.347 . . . . 10.0 110.773 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 15.5 m95 -72.9 -44.65 61.01 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.569 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.45 -21.69 60.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.17 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 -74.6 102.69 4.64 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.154 0.502 . . . . 10.0 110.35 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.2 m -106.69 146.14 13.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 115.376 -0.829 . . . . 10.0 110.648 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -111.93 125.72 54.36 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.385 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 4.9 p-80 -165.11 175.71 9.14 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.011 -0.54 . . . . 10.0 109.906 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -135.58 113.34 10.98 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.919 0.39 . . . . 10.0 111.142 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -86.53 -35.13 19.72 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.606 -0.887 . . . . 10.0 108.606 178.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -98.5 -170.19 1.91 Allowed 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 114.702 -1.135 . . . . 10.0 108.923 178.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.74 143.43 84.63 Favored Pre-proline 0 C--N 1.318 -0.784 0 C-N-CA 120.736 -0.385 . . . . 10.0 110.026 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.38 -59.64 0.73 Allowed 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.61 2.207 . . . . 10.0 112.494 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.5 m -144.92 99.77 3.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.984 0.421 . . . . 10.0 110.873 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -84.84 97.95 10.02 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.302 -0.408 . . . . 10.0 111.066 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 pt -119.96 90.86 44.73 Favored Pre-proline 0 C--N 1.32 -0.699 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.351 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -76.02 52.08 3.32 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 123.452 2.768 . . . . 10.0 112.825 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 18.6 tp -159.79 146.14 16.06 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.383 -0.826 . . . . 10.0 109.651 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -69.51 105.64 2.71 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.675 -0.491 . . . . 10.0 109.675 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.45 129.76 43.59 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.047 -179.327 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.7 m -134.07 103.46 5.8 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.245 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -75.54 130.33 38.68 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.496 -0.774 . . . . 10.0 110.703 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.6 m -85.41 119.03 25.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.219 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -88.64 113.34 24.11 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.022 -0.733 . . . . 10.0 109.022 179.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -153.73 158.57 41.17 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.018 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -73.85 139.08 44.81 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.817 -0.809 . . . . 10.0 108.817 178.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.2 p -126.23 161.82 49.8 Favored Pre-proline 0 C--N 1.319 -0.725 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.353 -177.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -75.53 12.33 1.38 Allowed 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 121.93 1.754 . . . . 10.0 112.326 179.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 16.2 ptt? -111.27 -17.17 13.23 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.426 0.528 . . . . 10.0 112.426 -179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.17 -61.67 1.87 Allowed 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.17 -0.612 . . . . 10.0 110.669 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.18 -53.59 2.49 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.731 -0.747 . . . . 10.0 112.019 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.421 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 61.8 p -126.78 166.44 17.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.727 0.298 . . . . 10.0 111.058 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 62.6 tp -56.23 -45.35 79.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.815 -0.63 . . . . 10.0 111.168 -179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -56.48 -54.57 44.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.646 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.89 -35.99 78.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.586 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 50.5 ttp -64.03 -50.5 68.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.367 -0.378 . . . . 10.0 110.218 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 71.3 mt -64.76 -34.75 79.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.248 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -60.0 -50.02 75.4 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.163 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -66.43 -40.69 89.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.235 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 31.3 m0 -57.64 -54.3 48.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.152 0.501 . . . . 10.0 110.829 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.92 -42.4 81.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.699 -0.682 . . . . 10.0 111.944 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.42 -40.56 78.6 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.564 0.579 . . . . 10.0 112.564 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -60.5 -39.33 87.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.905 0.383 . . . . 10.0 111.415 -179.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.7 m -97.78 11.98 35.4 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.36 -179.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 m120 56.06 39.96 30.35 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.532 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 5.2 mtm -102.88 164.09 11.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.783 -0.644 . . . . 10.0 109.488 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 -96.82 157.86 15.7 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.565 -0.288 . . . . 10.0 110.953 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 34.0 tp -128.74 138.06 51.91 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.194 0.521 . . . . 10.0 110.649 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.24 96.16 4.98 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.121 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.502 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 16.4 t80 -95.45 98.83 10.84 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.708 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -101.77 37.87 1.74 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.858 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.502 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 44.2 mt -106.01 142.15 24.24 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -61.04 -30.31 89.33 Favored 'Trans proline' 0 CA--C 1.529 0.23 0 C-N-CA 122.764 2.31 . . . . 10.0 113.313 -179.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.2 m -145.69 166.85 24.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.893 0.378 . . . . 10.0 111.494 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.38 124.97 39.68 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.214 -0.662 . . . . 10.0 109.214 179.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -110.27 156.7 20.33 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.554 0.216 . . . . 10.0 110.714 -178.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.421 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.8 OUTLIER -79.99 177.02 9.22 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.727 179.574 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.98 134.54 41.45 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.7 pt -65.87 -28.8 44.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 112.517 0.562 . . . . 10.0 112.517 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 138.03 -62.72 0.57 Allowed Glycine 0 CA--C 1.52 0.36 0 C-N-CA 120.296 -0.954 . . . . 10.0 113.618 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.86 7.99 1.47 Allowed 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.534 2.156 . . . . 10.0 113.151 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.9 t -69.41 -45.63 78.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.939 0.4 . . . . 10.0 110.658 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -13.75 60.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.593 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.68 1.8 47.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.031 0.443 . . . . 10.0 110.875 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 46.6 mt -107.62 107.2 22.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.181 179.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.4 97.61 4.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.048 0.451 . . . . 10.0 111.128 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.2 t -130.74 155.95 45.78 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.711 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.12 -6.26 55.6 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.235 0.541 . . . . 10.0 110.816 179.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 19.4 t -98.46 116.24 30.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.287 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.15 -31.63 54.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.186 0.517 . . . . 10.0 110.059 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -68.12 -43.47 78.33 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.798 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.6 tp60 -67.77 -41.21 83.63 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.286 -0.416 . . . . 10.0 110.343 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.96 -49.15 72.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.413 179.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.16 -36.95 85.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.461 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 98.9 m -63.37 -43.81 96.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.824 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -70.78 -41.36 71.81 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.454 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.0 mp -61.92 -51.17 69.22 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.91 179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.7 p -58.31 -25.52 61.96 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.172 0.434 . . . . 10.0 112.172 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.36 -43.65 66.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.029 0.443 . . . . 10.0 111.149 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 10.5 p -87.56 -24.5 6.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.203 0.525 . . . . 10.0 111.291 -179.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -79.79 -24.28 41.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.795 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.479 ' O ' HG22 ' A' ' 133' ' ' VAL . . . -51.28 -36.43 42.27 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.438 -0.346 . . . . 10.0 111.643 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.65 -27.09 68.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.959 0.409 . . . . 10.0 111.664 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -91.97 -11.98 34.61 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.715 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 130' ' ' PRO . . . 93.45 27.46 13.13 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.622 -0.799 . . . . 10.0 112.107 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 57.8 t -124.53 125.67 70.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.798 0.332 . . . . 10.0 111.076 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.4 m -122.67 113.87 19.82 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.188 178.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 16.4 m -105.39 142.33 18.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.801 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 41.6 m -152.46 166.27 32.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.015 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.467 HG23 ' CD2' ' A' ' 126' ' ' LEU . 3.5 t -117.73 128.4 74.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 110.111 -0.329 . . . . 10.0 110.111 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.6 m -147.6 120.86 8.94 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.728 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 61.68 43.13 10.11 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 123.636 0.585 . . . . 10.0 111.559 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 19.1 m120 62.33 26.61 15.91 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.727 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -130.31 132.8 46.04 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.61 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.467 ' CD2' HG23 ' A' ' 121' ' ' VAL . 97.4 mt -88.61 122.72 32.36 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 108.62 -0.882 . . . . 10.0 108.62 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -112.79 122.76 48.59 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.331 0.586 . . . . 10.0 111.234 -178.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.2 t -108.17 119.21 57.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.269 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -128.45 138.49 33.16 Favored Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 110.032 -0.358 . . . . 10.0 110.032 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.406 ' HA ' ' O ' ' A' ' 116' ' ' GLY . 69.4 Cg_endo -77.96 135.02 13.66 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 121.98 1.786 . . . . 10.0 111.855 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 3.2 m -108.65 145.0 30.71 Favored Pre-proline 0 C--N 1.319 -0.727 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.347 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -77.99 103.21 1.67 Allowed 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.465 2.11 . . . . 10.0 112.251 -179.496 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . 0.479 HG22 ' O ' ' A' ' 113' ' ' ALA . 2.5 m -136.71 26.33 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.591 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 7.7 m -89.75 -24.19 21.59 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.911 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 14.1 m -150.08 101.01 2.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.931 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -79.79 -18.37 73.0 Favored Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.937 -0.574 . . . . 10.0 112.789 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -118.26 43.37 2.48 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.105 0.479 . . . . 10.0 110.657 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.3 pptp? -87.06 170.09 11.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.103 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 14.7 tp . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.641 -0.695 . . . . 10.0 109.6 179.504 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.718 0 N-CA-C 111.682 -0.567 . . . . 10.0 111.682 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.5 m -58.94 113.63 2.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.696 0.284 . . . . 10.0 110.421 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 31.1 t-80 -111.56 102.46 10.8 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.025 0.44 . . . . 10.0 110.51 -179.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 34.8 tpp -96.96 91.97 5.87 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.073 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.406 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 0.2 OUTLIER -86.71 -36.42 18.69 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.807 179.857 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 24' ' ' THR . 13.1 mmtm 68.67 134.77 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.278 0 O-C-N 124.044 0.84 . . . . 10.0 111.504 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -64.17 109.33 1.12 Allowed 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 122.55 2.167 . . . . 10.0 111.866 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -129.83 142.28 44.79 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.638 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -66.19 117.58 4.8 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.639 2.226 . . . . 10.0 111.457 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -70.23 -61.14 1.89 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.371 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -153.04 175.76 12.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.064 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -92.58 41.52 2.75 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.977 -0.63 . . . . 10.0 112.087 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -86.95 -74.45 1.28 Allowed Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.723 -0.751 . . . . 10.0 112.233 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.4 tpp85 63.93 23.49 13.35 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.098 0.559 . . . . 10.0 111.606 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 50.4 m95 59.57 80.41 0.2 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.094 0.473 . . . . 10.0 110.855 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -76.33 82.55 3.09 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.377 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -105.47 81.18 1.66 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.54 -0.754 . . . . 10.0 109.062 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -145.95 119.49 2.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.384 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -146.81 116.54 7.17 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.0 p-80 -95.56 121.71 37.54 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.338 0.589 . . . . 10.0 111.241 -178.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -145.82 146.44 31.16 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.189 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -147.31 131.16 17.07 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.245 0.545 . . . . 10.0 110.301 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -136.2 166.54 23.18 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.676 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -139.6 141.85 29.67 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.87 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.73 65.11 6.7 Favored 'Trans proline' 0 N--CA 1.464 -0.234 0 C-N-CA 122.7 2.267 . . . . 10.0 112.489 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.8 m -80.81 97.4 7.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.016 0.436 . . . . 10.0 111.198 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -119.32 144.47 46.82 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.0 pt -133.62 79.71 58.54 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-O 120.957 0.408 . . . . 10.0 111.003 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -72.13 106.11 1.97 Allowed 'Trans proline' 0 N--CA 1.462 -0.372 0 C-N-CA 122.564 2.176 . . . . 10.0 111.831 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 38.1 tp -126.64 144.99 50.74 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.166 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -107.43 133.54 51.78 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.512 -0.551 . . . . 10.0 109.512 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.78 132.95 52.52 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.926 0.393 . . . . 10.0 111.183 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 10.0 m -138.6 94.48 2.85 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.652 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -68.92 126.18 28.98 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.313 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 30.4 m -75.36 121.29 22.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.831 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -86.47 116.54 24.68 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.408 -0.814 . . . . 10.0 109.088 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -145.85 147.74 32.13 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.187 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.513 ' HB1' ' SD ' ' A' ' 67' ' ' MET . . . -74.77 112.14 10.68 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.733 -0.469 . . . . 10.0 109.733 178.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.403 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 26.2 p -107.55 157.26 36.21 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.799 -179.143 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.403 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 37.3 Cg_endo -65.99 -11.21 30.03 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.348 2.032 . . . . 10.0 111.255 178.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 51.3 mtt -77.74 -29.42 51.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.64 -0.709 . . . . 10.0 109.891 179.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -75.88 -51.67 12.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.221 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 81.2 -63.14 4.37 Favored Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.478 -0.783 . . . . 10.0 113.64 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 43.8 p -113.1 169.33 9.01 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.881 0.372 . . . . 10.0 111.67 -178.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 66.9 tp -63.46 -47.42 81.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.64 -0.709 . . . . 10.0 111.227 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 34.1 ttmt -56.11 -55.99 26.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.222 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.0 m -61.37 -32.45 72.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.845 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.513 ' SD ' ' HB1' ' A' ' 57' ' ' ALA . 55.9 ttp -68.99 -51.19 41.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.938 0.399 . . . . 10.0 110.35 179.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.1 mt -62.35 -35.66 79.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.703 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -61.44 -40.94 96.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.558 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -68.66 -40.55 80.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.278 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 43.7 m0 -64.13 -50.01 69.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.447 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.474 ' HB3' HD11 ' A' ' 126' ' ' LEU . . . -60.48 -37.14 80.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.199 179.376 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.45 -34.71 77.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.567 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.06 -41.32 95.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.331 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.76 7.69 45.59 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.33 0.492 . . . . 10.0 112.33 -177.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 60.72 53.22 4.04 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.59 0.71 . . . . 10.0 109.856 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.478 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 22.0 mtm -124.43 171.22 10.12 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.831 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -106.24 171.11 7.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.468 -0.333 . . . . 10.0 110.585 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.3 tp -133.27 133.53 42.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.149 0.5 . . . . 10.0 111.578 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -119.24 95.9 4.99 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.467 -0.788 . . . . 10.0 109.506 178.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.451 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 6.7 t80 -88.98 98.52 11.8 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.697 -0.683 . . . . 10.0 109.394 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.414 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 64.3 m-80 -101.81 37.09 1.9 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.283 0.563 . . . . 10.0 110.898 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.409 HD13 ' CZ ' ' A' ' 81' ' ' TYR . 33.7 mt -101.21 145.44 30.44 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.816 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -62.35 -40.29 41.06 Favored 'Trans proline' 0 N--CA 1.464 -0.232 0 C-N-CA 122.617 2.211 . . . . 10.0 111.531 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -138.72 141.85 38.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.727 -0.669 . . . . 10.0 110.083 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.451 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 15.1 t70 -78.56 131.31 36.72 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.741 -0.466 . . . . 10.0 109.741 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -100.58 148.19 25.09 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.111 0.482 . . . . 10.0 111.532 -178.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.9 m -81.84 147.52 29.31 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.494 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.31 123.81 14.02 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 121.097 0.475 . . . . 10.0 111.372 179.345 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 24.2 pt -80.99 -164.28 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.508 -0.769 . . . . 10.0 110.733 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -77.18 -68.84 1.46 Allowed Glycine 0 CA--C 1.522 0.511 0 C-N-CA 120.836 -0.697 . . . . 10.0 113.304 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_endo -56.96 -14.55 14.55 Favored 'Trans proline' 0 N--CA 1.477 0.517 0 C-N-CA 123.592 2.861 . . . . 10.0 115.267 -178.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.6 p -68.93 -40.49 81.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.303 0.573 . . . . 10.0 110.406 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 2.1 m -67.82 -12.52 60.78 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.556 -0.747 . . . . 10.0 111.379 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.06 1.84 56.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.298 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 54.4 mt -96.69 111.39 26.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.254 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.7 m -130.11 100.67 5.5 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.675 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 15.4 t -129.72 155.46 45.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.785 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.64 10.09 38.0 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.085 0.402 . . . . 10.0 112.085 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.6 t -125.55 127.49 46.47 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.679 0.276 . . . . 10.0 110.71 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 6.0 p -66.4 -28.59 43.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.252 0.548 . . . . 10.0 110.249 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -70.72 -44.83 66.08 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.565 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -66.63 -38.62 87.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.871 -0.604 . . . . 10.0 109.902 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.6 -50.42 72.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.864 179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.48 -29.93 71.13 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.265 0.555 . . . . 10.0 110.551 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 36.9 m -69.03 -50.85 44.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.67 -0.695 . . . . 10.0 110.972 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -67.73 -36.96 81.53 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.055 -0.52 . . . . 10.0 111.652 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 26.7 mt -59.51 -50.01 75.57 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.704 0.288 . . . . 10.0 110.814 179.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.6 m -60.52 -27.76 67.87 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.356 -0.384 . . . . 10.0 111.937 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.89 -41.67 77.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.825 0.345 . . . . 10.0 111.144 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.8 p -87.48 -35.55 8.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.037 0.446 . . . . 10.0 111.585 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.425 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 4.0 m-30 -71.49 -22.19 61.83 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -178.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.438 ' O ' HG21 ' A' ' 133' ' ' VAL . . . -55.39 -22.61 20.55 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.614 0.245 . . . . 10.0 111.334 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.07 -31.04 71.69 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.958 0.409 . . . . 10.0 110.615 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -94.46 -24.11 17.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.314 0.578 . . . . 10.0 109.964 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 106.77 34.37 3.06 Favored Glycine 0 N--CA 1.444 -0.77 0 CA-C-N 115.613 -0.721 . . . . 10.0 112.484 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.425 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 75.8 t -124.44 135.96 62.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.743 0.306 . . . . 10.0 110.298 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.1 m -136.1 132.22 35.82 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.108 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 7.5 m -120.73 149.29 23.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.275 0.56 . . . . 10.0 111.87 -178.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 58.3 m -155.21 154.45 32.26 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.668 179.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 1.7 p -110.83 119.55 59.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.981 0.419 . . . . 10.0 109.896 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.0 m -137.14 128.47 28.14 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.221 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 58.49 43.6 19.21 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 123.692 0.62 . . . . 10.0 111.447 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.478 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 9.8 m-20 58.27 39.28 25.8 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.902 0.858 . . . . 10.0 110.193 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 69.5 tttt -145.3 128.94 17.14 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.892 -1.049 . . . . 10.0 109.239 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.474 HD11 ' HB3' ' A' ' 72' ' ' ALA . 20.7 mt -88.01 121.73 30.76 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 108.265 -1.013 . . . . 10.0 108.265 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.38 123.93 51.23 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.163 0.506 . . . . 10.0 111.428 -178.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.414 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 2.9 t -102.11 120.82 52.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.223 179.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -129.91 133.33 24.88 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.112 -179.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.23 131.9 9.99 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.113 1.875 . . . . 10.0 111.993 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 4.5 m -99.66 139.75 21.08 Favored Pre-proline 0 C--N 1.318 -0.803 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.18 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -80.27 94.12 1.02 Allowed 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.637 2.225 . . . . 10.0 111.377 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . 0.438 HG21 ' O ' ' A' ' 113' ' ' ALA . 6.0 m -126.49 24.55 2.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 121.249 0.547 . . . . 10.0 111.177 -179.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.52 -23.05 19.22 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.772 -179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.84 166.2 29.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.218 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -90.62 -73.34 1.27 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.873 -0.68 . . . . 10.0 112.069 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -145.42 96.7 2.87 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.943 0.401 . . . . 10.0 110.535 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 9.9 ptmt -126.48 166.59 16.95 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.478 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 31.0 tp . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.579 -0.724 . . . . 10.0 109.719 179.467 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.691 0 N-CA-C 111.957 -0.457 . . . . 10.0 111.957 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.9 m -105.33 154.39 20.34 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -64.92 135.67 55.96 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.091 -0.337 . . . . 10.0 110.091 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.5 mmt -76.48 -78.45 0.12 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.82 0.343 . . . . 10.0 110.742 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 t -156.04 144.15 19.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.157 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 37.4 mtpt -104.98 140.66 21.3 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.476 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -64.07 108.76 1.0 Allowed 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.801 2.334 . . . . 10.0 112.019 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.37 141.5 23.6 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.451 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -64.1 123.66 12.24 Favored 'Trans proline' 0 C--O 1.237 0.435 0 C-N-CA 122.509 2.14 . . . . 10.0 111.681 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.79 -178.67 7.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.773 -0.649 . . . . 10.0 111.063 -179.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -127.33 154.1 45.37 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.444 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -116.59 172.26 14.15 Favored Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.936 -0.65 . . . . 10.0 111.786 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.55 15.0 59.09 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.948 -0.644 . . . . 10.0 111.988 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 73.1 mtt180 -81.22 -14.12 57.85 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.992 0.425 . . . . 10.0 110.704 -179.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 74.0 m95 -106.91 24.07 13.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.988 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.6 mtmp? -87.95 69.78 9.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.877 0.37 . . . . 10.0 110.995 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -88.83 85.13 6.69 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.694 -0.484 . . . . 10.0 109.694 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.2 m -140.25 141.24 33.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.446 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -145.23 118.01 8.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.006 0.431 . . . . 10.0 110.552 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -84.25 59.53 5.41 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.18 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -78.32 119.37 21.57 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.581 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -97.64 117.99 33.17 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.871 -0.604 . . . . 10.0 109.991 179.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -85.35 144.11 28.25 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.879 0.371 . . . . 10.0 111.13 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -157.38 143.49 12.89 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.428 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -70.72 117.22 5.02 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.487 2.125 . . . . 10.0 112.008 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.2 m -76.43 115.16 15.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.553 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -71.13 113.03 7.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.121 0.486 . . . . 10.0 110.618 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.7 pt -129.01 87.05 55.6 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.984 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_exo -70.85 81.91 1.04 Allowed 'Trans proline' 0 N--CA 1.464 -0.262 0 C-N-CA 123.127 2.551 . . . . 10.0 111.656 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -137.28 101.94 4.67 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.652 -0.704 . . . . 10.0 109.918 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -99.5 149.4 23.26 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.646 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.8 107.49 0.71 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.134 0.492 . . . . 10.0 111.009 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 9.8 m -146.94 88.25 1.73 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.959 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -65.15 129.4 39.59 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.815 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.1 m -82.63 120.85 26.08 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.682 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -86.81 113.14 22.38 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.11 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -152.07 151.39 31.04 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.476 -0.783 . . . . 10.0 109.721 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -85.33 125.84 33.26 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.889 -0.412 . . . . 10.0 109.889 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.7 p -105.31 149.56 37.88 Favored Pre-proline 0 C--N 1.321 -0.646 0 C-N-CA 120.885 -0.326 . . . . 10.0 110.704 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -64.69 -12.29 33.15 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.643 2.228 . . . . 10.0 111.951 179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 40.1 mtt -85.25 -14.15 47.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.456 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -78.77 -48.64 14.47 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.259 -0.645 . . . . 10.0 109.259 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.58 -64.18 4.34 Favored Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.324 -0.853 . . . . 10.0 113.612 178.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 28.0 p -113.3 168.4 9.76 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 112.212 0.449 . . . . 10.0 112.212 -178.057 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 47.2 tp -66.01 -43.21 88.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.723 -0.671 . . . . 10.0 111.797 -179.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -55.25 -54.43 43.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.978 0.418 . . . . 10.0 110.42 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.1 m -64.75 -38.99 92.85 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.712 -0.676 . . . . 10.0 111.52 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 9.5 tmm? -61.89 -48.4 80.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.976 0.417 . . . . 10.0 111.164 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 57.6 mt -68.12 -31.35 70.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.319 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -62.24 -42.17 99.08 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.728 -0.471 . . . . 10.0 109.728 179.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.475 ' O ' ' HB2' ' A' ' 74' ' ' ASP . 17.1 mmm-85 -60.6 -42.57 97.04 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.214 178.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 37.1 m0 -60.13 -55.29 35.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.59 -0.732 . . . . 10.0 111.07 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.49 -47.37 84.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.907 -179.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.46 -35.75 80.29 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -178.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.475 ' HB2' ' O ' ' A' ' 70' ' ' ARG . 0.4 OUTLIER -73.4 -23.97 60.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.756 0.312 . . . . 10.0 111.805 -179.211 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.4 t -108.63 7.15 26.45 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.854 -0.339 . . . . 10.0 111.555 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 65.2 t30 62.18 38.84 13.33 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.606 0.717 . . . . 10.0 110.374 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 68.3 mtp -111.08 173.6 6.26 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.219 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 88.6 mm-40 -108.15 158.72 17.18 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.531 -0.304 . . . . 10.0 110.252 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.7 tp -133.07 136.91 46.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.984 0.421 . . . . 10.0 110.891 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.57 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 3.9 m -124.12 97.64 5.43 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.709 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.531 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 4.6 t80 -86.06 97.41 10.28 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.742 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -104.65 29.35 6.25 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.943 0.401 . . . . 10.0 111.03 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.531 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 57.4 mt -89.12 146.87 37.23 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.45 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -57.64 -35.85 98.7 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.637 2.225 . . . . 10.0 111.856 179.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.0 m -151.31 155.98 39.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.904 -0.589 . . . . 10.0 109.924 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.4 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 37.7 t0 -77.84 130.83 37.14 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.603 -0.518 . . . . 10.0 109.603 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -104.73 140.04 38.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.03 0.443 . . . . 10.0 111.349 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.429 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 2.9 m -81.27 149.04 29.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.34 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.28 112.81 1.18 Allowed 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.872 0.368 . . . . 10.0 110.817 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 11.0 pt -65.19 -36.72 78.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.862 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 149.36 -71.5 0.3 Allowed Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.38 -0.914 . . . . 10.0 113.335 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -50.78 -17.74 3.47 Favored 'Trans proline' 0 N--CA 1.48 0.694 0 C-N-CA 123.775 2.984 . . . . 10.0 113.832 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -60.91 -37.26 76.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.118 0.485 . . . . 10.0 110.882 179.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.0 -9.08 57.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.494 -179.596 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -92.11 -0.93 57.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.164 0.507 . . . . 10.0 110.561 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 56.7 mt -100.34 116.39 43.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.962 -0.563 . . . . 10.0 109.525 179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -142.49 95.48 2.8 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.736 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 11.9 t -130.91 154.32 48.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.449 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.02 -13.9 43.1 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.223 -0.444 . . . . 10.0 111.117 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.0 m -91.65 116.1 28.6 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.358 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.6 p -60.82 -36.48 71.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.351 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -67.56 -38.06 83.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.125 0.488 . . . . 10.0 109.893 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -67.35 -42.63 83.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.885 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.62 -47.73 81.37 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.348 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.31 -34.05 76.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.482 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 81.8 m -68.58 -50.91 48.13 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.078 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -64.04 -40.77 97.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.3 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.1 mp -63.56 -49.28 74.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.581 -0.281 . . . . 10.0 110.513 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.4 m -61.38 -29.19 69.76 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.499 0.185 . . . . 10.0 111.499 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.15 -42.39 98.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.906 0.384 . . . . 10.0 110.785 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.6 p -88.61 -37.67 10.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.38 0.61 . . . . 10.0 111.245 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.536 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.5 m-30 -72.65 -23.13 60.86 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 113.994 1.109 . . . . 10.0 113.994 -177.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.29 -36.93 33.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.568 0.223 . . . . 10.0 111.216 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.95 -32.23 70.38 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.948 0.404 . . . . 10.0 110.534 179.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -79.92 -9.85 59.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.439 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.414 ' O ' ' HA ' ' A' ' 130' ' ' PRO . . . 89.28 26.77 24.87 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.827 -0.624 . . . . 10.0 112.33 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.536 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 76.3 t -125.28 129.67 73.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.986 0.422 . . . . 10.0 111.053 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 8.0 t -127.46 113.07 15.7 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.288 -0.634 . . . . 10.0 109.288 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 2.6 m -102.28 135.72 37.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.168 0.509 . . . . 10.0 110.564 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -147.43 141.1 25.6 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.857 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 2.4 p -106.09 124.18 61.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-O 121.249 0.547 . . . . 10.0 109.68 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 64.5 m -142.47 123.12 14.18 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.72 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.4 51.33 5.39 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.811 -0.631 . . . . 10.0 111.48 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.6 m-20 57.41 28.87 16.04 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.815 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.57 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 50.5 tttt -136.29 131.82 34.91 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.321 -0.4 . . . . 10.0 109.991 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 37.7 mt -88.08 120.96 29.93 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.824 -0.806 . . . . 10.0 108.824 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -107.32 115.42 30.13 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.381 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 2.2 t -100.64 116.57 44.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 107.834 -1.173 . . . . 10.0 107.834 177.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -122.47 131.51 24.38 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 116.484 -0.325 . . . . 10.0 110.916 -177.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . 0.414 ' HA ' ' O ' ' A' ' 116' ' ' GLY . 73.8 Cg_endo -79.07 131.85 10.13 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.122 1.881 . . . . 10.0 111.496 178.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 8.5 m -106.0 145.14 30.33 Favored Pre-proline 0 C--N 1.317 -0.847 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.424 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -78.83 106.57 2.12 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.664 2.243 . . . . 10.0 111.807 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 1.8 m -135.27 -162.09 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.539 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 3.7 m -125.82 30.89 5.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.817 0.341 . . . . 10.0 110.574 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.5 m 61.45 34.49 18.1 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.917 -0.583 . . . . 10.0 111.809 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 88.32 48.89 3.88 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.613 -0.803 . . . . 10.0 112.728 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -140.26 122.67 16.04 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.681 0.277 . . . . 10.0 110.478 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -116.1 103.12 10.24 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.356 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 77.4 mt . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.613 -0.708 . . . . 10.0 110.118 179.638 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.788 0 N-CA-C 111.608 -0.597 . . . . 10.0 111.608 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 17.9 m -79.27 74.34 5.86 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.316 0.579 . . . . 10.0 110.921 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -115.74 141.44 48.08 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.623 -0.717 . . . . 10.0 109.517 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.3 ttt -66.21 -50.73 62.83 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.782 0.325 . . . . 10.0 110.359 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.79 89.49 2.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.267 178.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.48 ' HD2' ' O ' ' A' ' 84' ' ' PRO . 28.3 ttpp -97.31 107.79 40.69 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.848 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.13 140.92 46.33 Favored 'Trans proline' 0 C--O 1.236 0.397 0 C-N-CA 122.455 2.103 . . . . 10.0 111.993 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.432 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . . . -104.61 127.87 28.07 Favored Pre-proline 0 C--N 1.319 -0.72 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.845 -179.736 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 5.5 Cg_exo -74.98 61.32 5.63 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.852 2.368 . . . . 10.0 111.874 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -83.48 170.53 14.34 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.658 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -128.48 100.7 5.88 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.543 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -70.5 -49.77 29.46 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.054 -0.593 . . . . 10.0 112.513 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -88.33 70.35 2.65 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.649 -0.786 . . . . 10.0 112.095 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 56.3 mtm180 -78.92 -167.88 1.27 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.365 0.126 . . . . 10.0 110.689 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 64.0 m95 63.54 31.1 14.99 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.192 0.52 . . . . 10.0 110.786 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -102.01 9.82 40.12 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.811 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -86.64 94.94 9.61 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.883 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.1 m -127.56 -26.36 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.122 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.8 t30 53.01 45.7 28.28 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.56 0.695 . . . . 10.0 110.586 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 5.9 t-160 -87.27 80.42 8.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.188 -0.914 . . . . 10.0 109.966 -179.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -146.06 113.75 6.4 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.875 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.04 -42.65 9.31 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.484 -0.326 . . . . 10.0 111.024 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -166.5 170.3 12.96 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.489 -0.323 . . . . 10.0 110.152 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.61 149.71 83.56 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.765 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -58.47 -36.2 97.74 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.934 2.422 . . . . 10.0 112.137 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 m -137.11 127.17 26.01 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.944 -0.571 . . . . 10.0 109.951 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -79.71 72.48 6.41 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.738 0.78 . . . . 10.0 110.983 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 17.6 pt -131.61 153.59 81.58 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.081 -0.963 . . . . 10.0 109.906 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -75.72 74.42 4.37 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.472 2.114 . . . . 10.0 111.429 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.08 106.86 11.16 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.385 -179.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -123.14 114.33 20.18 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.791 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.48 123.9 21.3 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.959 0.409 . . . . 10.0 110.707 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -114.69 82.02 1.66 Allowed 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.272 -0.64 . . . . 10.0 109.272 179.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -82.79 131.76 35.19 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.455 -0.793 . . . . 10.0 111.08 -178.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.0 m -81.0 106.22 12.84 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.819 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -77.46 100.11 5.89 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.24 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.44 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 3.0 tt0 -141.86 142.35 33.11 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.98 -1.009 . . . . 10.0 110.223 -178.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.444 ' HB2' ' HA ' ' A' ' 94' ' ' SER . . . -74.96 122.09 22.94 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.149 -0.685 . . . . 10.0 109.149 178.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 22.1 p -94.33 141.37 23.45 Favored Pre-proline 0 C--N 1.318 -0.802 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.723 -179.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -70.26 0.72 5.61 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 122.63 2.22 . . . . 10.0 112.104 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 60.9 mtt -104.71 -6.3 20.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.737 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.527 ' OD1' ' HB ' ' A' ' 66' ' ' THR . 10.9 t70 -72.47 -69.57 0.4 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.831 0.348 . . . . 10.0 110.827 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.465 ' O ' HG21 ' A' ' 88' ' ' THR . . . 113.09 -42.35 1.98 Allowed Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.485 -0.865 . . . . 10.0 114.008 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.444 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 72.0 p -135.99 168.64 18.97 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 118.454 1.127 . . . . 10.0 113.664 -177.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 60.2 tp -69.67 -48.29 60.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.048 -0.978 . . . . 10.0 111.121 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.54 ' HD3' ' CD1' ' A' ' 81' ' ' TYR . 25.6 tptp -58.37 -50.16 74.64 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.82 -0.627 . . . . 10.0 111.293 -178.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.527 ' HB ' ' OD1' ' A' ' 61' ' ' ASP . 62.8 m -60.48 -40.77 92.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.705 0.288 . . . . 10.0 110.906 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 47.7 ttp -61.55 -48.04 82.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.951 0.405 . . . . 10.0 110.213 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 79.6 mt -63.87 -37.53 87.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.496 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -62.04 -44.03 97.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.561 178.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.83 -43.89 97.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.392 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 44.4 m0 -63.76 -50.79 67.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.461 -0.79 . . . . 10.0 111.078 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.41 -47.86 80.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.561 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.25 -41.38 88.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.693 0.282 . . . . 10.0 111.427 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -64.96 -37.57 88.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.951 0.405 . . . . 10.0 111.366 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 7.4 p -91.04 5.59 48.28 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.642 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 63.1 t30 60.47 32.73 20.59 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.629 0.728 . . . . 10.0 110.219 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.441 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 17.4 mtm -107.08 168.57 9.11 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.42 -179.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -98.46 165.87 11.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.488 -0.324 . . . . 10.0 110.206 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 24.4 tp -133.86 131.23 38.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.123 0.487 . . . . 10.0 111.335 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -116.6 97.1 5.82 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.509 179.138 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.588 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 25.2 t80 -92.07 98.05 11.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.641 -0.708 . . . . 10.0 110.421 -179.034 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -101.23 20.95 14.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.907 0.384 . . . . 10.0 111.122 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.588 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 31.4 mt -80.94 143.21 53.07 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.036 179.532 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.48 ' O ' ' HD2' ' A' ' 25' ' ' LYS . 14.1 Cg_endo -57.3 -45.4 35.15 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.674 2.249 . . . . 10.0 112.448 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.1 m -135.93 168.26 19.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.982 0.42 . . . . 10.0 110.884 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.425 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 0.4 OUTLIER -79.57 135.03 36.5 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.593 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -115.62 162.89 16.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.878 0.37 . . . . 10.0 111.153 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.465 HG21 ' O ' ' A' ' 62' ' ' GLY . 1.2 p -108.37 172.61 6.74 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.658 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.48 114.51 14.11 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.4 pt -62.41 -37.37 78.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.685 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 155.24 -71.73 0.26 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.551 -0.833 . . . . 10.0 112.805 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.33 -2.13 1.21 Allowed 'Trans proline' 0 N--CA 1.481 0.782 0 C-N-CA 123.649 2.899 . . . . 10.0 113.922 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.3 t -65.8 -44.12 93.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.892 0.377 . . . . 10.0 110.451 179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.444 ' HA ' ' HB2' ' A' ' 57' ' ' ALA . 0.7 OUTLIER -65.17 -8.96 19.45 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.028 -0.533 . . . . 10.0 112.053 179.421 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.67 -10.95 54.95 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.063 0.459 . . . . 10.0 110.496 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.44 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 23.8 mt -90.16 107.56 18.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -136.21 91.96 2.73 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.029 0.443 . . . . 10.0 111.088 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.0 t -132.33 155.76 47.81 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.58 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -90.75 -5.63 55.45 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.285 0.564 . . . . 10.0 110.567 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.6 t -95.67 115.58 27.63 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 13.9 p -64.1 -30.07 49.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.896 0.379 . . . . 10.0 110.405 -179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -68.71 -43.17 76.57 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.678 178.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -65.3 -42.62 92.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.989 178.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.66 -50.48 73.02 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.846 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.61 -35.2 77.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.235 0.54 . . . . 10.0 110.357 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 99.4 m -66.01 -49.72 66.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.74 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -63.32 -40.57 97.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.487 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 83.5 mt -61.33 -49.86 75.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.568 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.2 m -59.29 -27.7 66.09 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.48 -42.57 78.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.972 0.415 . . . . 10.0 111.232 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -87.98 -29.6 5.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.971 0.415 . . . . 10.0 111.874 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.52 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.6 m-30 -81.07 -22.69 39.04 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 114.0 1.111 . . . . 10.0 114.0 -177.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.27 -30.23 11.37 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 111.74 0.274 . . . . 10.0 111.74 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.76 -39.6 73.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.056 0.455 . . . . 10.0 110.739 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 -74.91 -24.09 58.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.112 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.421 ' HA2' HG23 ' A' ' 131' ' ' VAL . . . 103.86 35.11 3.57 Favored Glycine 0 N--CA 1.445 -0.739 0 CA-C-N 115.515 -0.766 . . . . 10.0 112.381 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.52 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 94.8 t -131.35 129.54 62.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.08 0.467 . . . . 10.0 111.116 -179.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.1 m -130.0 118.84 22.21 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.455 ' CG1' HG11 ' A' ' 128' ' ' VAL . 9.2 m -112.44 136.83 47.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.224 0.535 . . . . 10.0 112.04 -177.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 73.1 m -145.0 140.12 27.94 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.798 -0.637 . . . . 10.0 109.723 179.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 2.5 p -102.05 128.83 54.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.856 -0.424 . . . . 10.0 109.856 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.1 m -151.12 130.88 13.18 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.223 -0.444 . . . . 10.0 111.06 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 59.33 45.63 13.71 Favored 'General case' 0 C--O 1.235 0.298 0 O-C-N 123.684 0.615 . . . . 10.0 111.842 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.441 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 92.4 m-20 59.7 33.85 21.97 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.505 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.94 131.44 27.02 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.26 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 18.6 mt -89.53 120.97 31.3 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 107.587 -1.264 . . . . 10.0 107.587 177.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.86 119.91 40.95 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.306 0.574 . . . . 10.0 111.179 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.455 HG11 ' CG1' ' A' ' 119' ' ' VAL . 3.2 t -106.42 118.57 54.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-N 115.246 -0.888 . . . . 10.0 108.827 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -131.17 138.3 32.59 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-O 120.768 0.318 . . . . 10.0 110.782 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.49 138.71 13.95 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.2 1.933 . . . . 10.0 111.68 178.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.421 HG23 ' HA2' ' A' ' 116' ' ' GLY . 0.2 OUTLIER -102.83 152.42 38.47 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 110.041 -0.355 . . . . 10.0 110.041 179.285 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -67.22 106.22 1.15 Allowed 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.037 2.491 . . . . 10.0 112.658 -179.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 2.5 m -145.66 28.11 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.104 -0.498 . . . . 10.0 110.567 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 3.8 m -83.61 -10.24 58.37 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.126 -179.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.8 m -61.17 -43.48 98.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.909 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -89.23 50.81 3.66 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.928 -0.654 . . . . 10.0 111.665 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.68 -26.83 67.96 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -68.6 127.66 33.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.123 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 76.1 mt . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.444 -0.789 . . . . 10.0 110.278 -179.565 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.75 0 N-CA-C 112.197 -0.361 . . . . 10.0 112.197 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.2 t -85.55 127.55 34.48 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.868 -0.419 . . . . 10.0 109.868 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -158.89 135.48 9.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.492 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.1 mtt -115.38 150.66 36.0 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.205 -0.452 . . . . 10.0 109.888 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.0 t -84.25 132.76 34.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.131 0.491 . . . . 10.0 110.012 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.7 mttm -119.25 97.18 50.38 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.361 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_exo -71.87 93.54 0.71 Allowed 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 122.84 2.36 . . . . 10.0 111.311 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -67.7 147.34 98.64 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.434 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.48 103.45 0.46 Allowed 'Trans proline' 0 C--O 1.236 0.415 0 C-N-CA 122.599 2.2 . . . . 10.0 112.02 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -112.15 -164.58 0.93 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.967 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -97.88 34.45 1.9 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.099 0.476 . . . . 10.0 110.687 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -88.86 90.34 1.65 Allowed Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.822 -0.626 . . . . 10.0 111.681 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 97.69 51.49 1.53 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.944 -0.646 . . . . 10.0 111.949 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 42.0 ttt180 -102.49 -25.32 13.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.776 0.322 . . . . 10.0 111.057 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 41.6 m95 -84.77 70.84 10.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.111 0.481 . . . . 10.0 110.635 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -116.33 18.76 15.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.802 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -85.99 83.15 7.86 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.92 -0.4 . . . . 10.0 109.92 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -134.67 106.96 8.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.17 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -163.44 152.09 14.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.891 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -134.78 83.61 2.04 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.98 0.419 . . . . 10.0 110.829 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -90.78 83.19 5.7 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.454 0.645 . . . . 10.0 110.024 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -131.17 109.61 10.56 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.483 -0.781 . . . . 10.0 110.143 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -141.94 156.53 45.48 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.718 0.294 . . . . 10.0 110.378 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -162.44 144.81 8.44 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.559 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -67.69 94.99 0.39 Allowed 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 122.364 2.042 . . . . 10.0 111.204 179.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.1 m -113.41 100.23 8.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.845 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.7 150.78 39.19 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.192 -0.458 . . . . 10.0 109.906 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.7 pt -144.92 150.52 46.35 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.668 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.75 146.35 95.78 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.902 2.401 . . . . 10.0 112.27 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.8 tt -131.62 85.4 2.25 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.437 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -113.47 93.9 4.61 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.747 -0.834 . . . . 10.0 108.747 178.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -55.42 107.57 0.34 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.856 -0.611 . . . . 10.0 111.983 -178.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.4 m -125.78 96.74 4.87 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.57 -0.741 . . . . 10.0 109.415 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -94.94 132.67 39.52 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.762 -179.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.9 m -75.1 110.93 9.83 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 121.194 0.521 . . . . 10.0 110.233 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -89.31 98.87 12.01 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.188 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -134.56 147.14 50.2 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.006 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -74.77 121.0 21.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.74 0.305 . . . . 10.0 110.418 179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.408 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 81.3 p -107.1 158.47 32.89 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.354 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.408 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 50.6 Cg_endo -68.54 -4.14 12.46 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.286 1.991 . . . . 10.0 112.036 179.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 61.6 mtt -92.28 -18.66 23.08 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.825 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -73.12 -55.64 6.2 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.419 0.628 . . . . 10.0 109.686 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 88.71 -64.21 3.46 Favored Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.595 -0.73 . . . . 10.0 113.347 178.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.49 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 15.7 p -117.57 165.59 13.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.04 0.447 . . . . 10.0 112.088 -178.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 55.0 tp -57.89 -42.32 84.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.118 -0.946 . . . . 10.0 110.565 179.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.402 ' O ' ' HG3' ' A' ' 69' ' ' GLU . 58.0 tttt -60.89 -57.84 10.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.847 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.18 -38.38 73.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.165 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 51.7 ttp -63.52 -51.67 64.51 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.628 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 98.6 mt -64.2 -36.96 85.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.091 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 51.9 mt-10 -63.5 -38.86 92.76 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.206 0.526 . . . . 10.0 110.087 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? -71.65 -32.13 67.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.216 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 38.6 m0 -70.98 -55.12 9.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.754 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.05 -28.5 69.64 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.711 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.13 -35.57 81.2 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.024 0.379 . . . . 10.0 112.024 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -68.79 -37.81 79.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.86 0.362 . . . . 10.0 111.195 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.426 ' HB2' ' HG3' ' A' ' 77' ' ' MET . 0.1 OUTLIER -95.29 6.77 48.13 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.471 -179.284 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 63.9 t30 55.58 46.7 22.36 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.591 0.71 . . . . 10.0 110.577 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.426 ' HG3' ' HB2' ' A' ' 75' ' ' SER . 22.1 mtm -111.1 165.67 11.7 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.324 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -98.81 154.47 17.98 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.32 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.9 tp -124.72 131.42 53.46 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.312 0.577 . . . . 10.0 110.5 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 61.8 m -113.03 96.21 5.82 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.104 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.497 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 15.9 t80 -91.31 98.47 11.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.695 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -101.37 30.76 4.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.98 0.419 . . . . 10.0 111.175 -179.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.497 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 43.8 mt -97.43 146.96 32.28 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.048 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -56.43 -41.63 74.13 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.943 2.429 . . . . 10.0 112.633 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 30.4 m -143.45 167.6 21.8 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.697 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.467 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 12.5 p-10 -83.9 129.04 34.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.012 -0.54 . . . . 10.0 109.636 179.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -105.27 136.98 43.79 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.775 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.49 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 1.3 p -76.09 155.4 34.77 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.999 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.74 116.43 3.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.511 -0.313 . . . . 10.0 110.179 178.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.2 pt -63.06 -33.88 63.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.711 -179.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 142.73 -67.48 0.46 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.471 -0.871 . . . . 10.0 113.157 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.71 -2.93 1.22 Allowed 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.838 3.025 . . . . 10.0 114.137 -179.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -68.7 -36.74 75.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.299 0.571 . . . . 10.0 110.274 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 22.8 m -72.64 -9.04 58.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.825 -0.625 . . . . 10.0 111.559 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.22 -1.35 56.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.499 0.666 . . . . 10.0 109.917 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 19.6 mt -106.07 105.56 18.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.261 -0.881 . . . . 10.0 109.931 179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -124.95 89.59 3.09 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.148 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.9 t -121.98 153.78 38.08 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.969 0.414 . . . . 10.0 111.089 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -92.94 -7.22 46.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.722 179.321 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.1 m -103.78 116.66 32.71 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.022 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.1 p -60.59 -32.5 51.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.712 -0.222 . . . . 10.0 111.352 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -67.1 -40.79 86.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.857 0.36 . . . . 10.0 110.176 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -65.06 -41.2 95.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.11 -0.495 . . . . 10.0 109.939 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.42 -51.45 66.83 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.581 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.51 -32.47 73.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.197 0.522 . . . . 10.0 110.813 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 88.3 m -66.83 -49.21 66.49 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.575 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -69.73 -37.23 76.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.947 -0.57 . . . . 10.0 111.353 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.4 mp -61.47 -49.41 76.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.962 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.479 ' O ' ' HB2' ' A' ' 113' ' ' ALA . 20.0 m -59.22 -30.28 68.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.556 -0.293 . . . . 10.0 111.706 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.73 -47.05 79.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.901 0.381 . . . . 10.0 111.178 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.9 p -82.26 -35.89 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.139 0.495 . . . . 10.0 111.339 -179.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.418 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.3 m-30 -72.06 -23.9 61.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.934 -0.575 . . . . 10.0 112.469 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 109' ' ' SER . . . -51.27 -31.33 20.77 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.892 0.33 . . . . 10.0 111.892 179.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.81 -20.9 57.84 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.144 0.497 . . . . 10.0 111.268 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 6.0 mm100 -94.69 -7.98 39.13 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.416 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 90.57 24.82 27.28 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-N 115.686 -0.688 . . . . 10.0 112.364 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.418 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 56.1 t -126.43 141.89 44.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.751 0.31 . . . . 10.0 111.0 -179.258 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 29.2 m -141.61 138.88 32.89 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 9.0 m -127.92 152.93 36.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.191 0.52 . . . . 10.0 111.872 -178.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.0 m -154.01 158.82 41.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.237 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.499 HG21 ' CD2' ' A' ' 126' ' ' LEU . 5.5 t -113.42 114.86 48.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.538 -0.912 . . . . 10.0 108.538 178.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 13.7 m -132.34 116.03 16.35 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.597 -0.274 . . . . 10.0 111.124 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.45 51.68 5.12 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.848 -0.614 . . . . 10.0 111.121 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.8 m120 54.95 38.09 29.89 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.05 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -141.5 132.14 25.56 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.509 -0.769 . . . . 10.0 109.164 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.499 ' CD2' HG21 ' A' ' 121' ' ' VAL . 89.8 mt -88.96 121.61 31.49 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 109.303 -0.629 . . . . 10.0 109.303 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -108.03 115.76 30.72 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.947 -179.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.8 t -102.98 118.65 50.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 N-CA-C 108.321 -0.992 . . . . 10.0 108.321 178.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -133.78 138.4 30.82 Favored Pre-proline 0 C--N 1.317 -0.809 0 CA-C-O 120.841 0.353 . . . . 10.0 110.539 -178.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.06 146.39 25.56 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.212 1.942 . . . . 10.0 111.683 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -105.03 151.62 39.51 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 109.736 -0.468 . . . . 10.0 109.736 179.269 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -77.86 63.52 8.11 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.759 2.306 . . . . 10.0 113.329 -178.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 27.8 m -127.23 153.8 36.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.486 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 1.5 p -157.57 121.62 4.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.718 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 16.1 m -65.43 115.85 6.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.476 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 69.82 27.78 72.78 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 121.033 -0.603 . . . . 10.0 112.179 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 56.98 36.11 27.33 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.321 0.581 . . . . 10.0 110.924 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -98.45 118.02 34.19 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.804 -0.634 . . . . 10.0 110.612 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 29.8 tp . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.533 -0.746 . . . . 10.0 109.842 179.711 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.868 0 N-CA-C 112.242 -0.343 . . . . 10.0 112.242 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 11.9 m -82.5 148.7 27.97 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -156.57 167.9 29.03 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.619 -0.264 . . . . 10.0 110.345 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.7 mmt -72.73 99.16 2.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.47 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -95.93 92.67 6.61 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.107 0.479 . . . . 10.0 110.251 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -127.99 121.41 21.82 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.488 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -72.6 146.37 43.66 Favored 'Trans proline' 0 C--O 1.237 0.471 0 C-N-CA 122.748 2.298 . . . . 10.0 111.832 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 70.86 156.11 0.16 Allowed Pre-proline 0 C--O 1.235 0.306 0 O-C-N 123.724 0.64 . . . . 10.0 111.2 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -61.09 170.57 4.77 Favored 'Trans proline' 0 C--O 1.237 0.466 0 C-N-CA 122.675 2.25 . . . . 10.0 113.04 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -73.5 174.2 8.56 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.514 -0.767 . . . . 10.0 111.221 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -111.12 140.53 45.59 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.905 -0.588 . . . . 10.0 110.342 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 154.62 -27.52 0.67 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.844 -0.693 . . . . 10.0 111.907 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -136.02 32.92 2.45 Favored Glycine 0 N--CA 1.445 -0.728 0 N-CA-C 111.393 -0.683 . . . . 10.0 111.393 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 43.3 ttt180 -91.23 -8.18 49.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.113 0.483 . . . . 10.0 110.687 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -124.86 41.92 3.4 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.166 0.507 . . . . 10.0 110.894 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -93.96 88.26 5.65 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.963 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -87.34 92.93 9.25 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.811 -0.631 . . . . 10.0 109.378 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.3 m -130.61 102.59 6.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.209 0.528 . . . . 10.0 111.321 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 20.2 p-10 -161.59 179.91 7.81 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.567 -0.742 . . . . 10.0 109.678 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -67.37 145.71 54.79 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.345 -0.243 . . . . 10.0 110.345 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -75.72 -76.45 0.15 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.611 -0.268 . . . . 10.0 111.372 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -155.82 133.21 10.9 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.755 0.312 . . . . 10.0 110.97 -179.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -134.84 157.27 47.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.987 0.422 . . . . 10.0 110.63 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -112.2 149.07 40.41 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.39 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.51 114.56 2.94 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.671 2.247 . . . . 10.0 111.98 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 61.6 m -73.62 103.25 4.15 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.926 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -123.04 80.51 1.77 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.674 179.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 33.8 pt -98.46 149.02 35.32 Favored Pre-proline 0 C--N 1.32 -0.713 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.97 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.4 125.09 14.39 Favored 'Trans proline' 0 C--O 1.236 0.382 0 C-N-CA 122.676 2.251 . . . . 10.0 111.998 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 63.5 tp -116.24 105.5 12.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.331 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -78.68 123.59 27.3 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.297 -0.631 . . . . 10.0 109.297 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.22 107.21 0.72 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.025 0.44 . . . . 10.0 110.643 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.2 m -127.73 85.38 2.35 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.945 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.9 t80 -86.07 118.45 25.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.719 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 60.4 m -72.66 113.8 10.1 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.216 0.531 . . . . 10.0 109.959 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -81.14 114.0 19.68 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.091 -0.959 . . . . 10.0 109.627 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -148.17 154.68 40.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.185 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.55 107.82 14.62 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.702 -0.481 . . . . 10.0 109.702 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.444 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 21.4 p -100.1 158.21 32.44 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.96 -178.64 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.444 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 40.5 Cg_endo -66.6 -8.43 21.0 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.904 2.403 . . . . 10.0 112.421 179.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 26.4 mmt -90.97 -7.62 51.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.035 0.445 . . . . 10.0 110.507 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -87.9 -58.78 2.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.391 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.31 -58.4 4.91 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.418 -0.896 . . . . 10.0 113.275 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.472 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 28.9 p -121.49 168.16 12.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.044 0.449 . . . . 10.0 111.801 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 59.4 tp -61.81 -37.41 84.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.251 -0.886 . . . . 10.0 110.712 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -61.7 -55.12 33.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.198 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.26 -41.96 90.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.074 0.464 . . . . 10.0 111.109 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 47.8 ttp -61.0 -53.2 60.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.811 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 87.6 mt -63.67 -36.23 83.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.029 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.426 ' OE2' HD23 ' A' ' 79' ' ' LEU . 44.2 mm-40 -59.29 -44.86 92.46 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.985 -0.376 . . . . 10.0 109.985 178.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -63.81 -45.29 90.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.36 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 42.8 m0 -57.41 -49.08 77.37 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.54 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.87 -50.01 58.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.446 -0.797 . . . . 10.0 111.761 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.29 -45.55 87.73 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.273 0.471 . . . . 10.0 112.273 -178.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -64.17 -35.68 81.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.026 0.441 . . . . 10.0 111.237 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.6 m -90.67 5.14 49.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.044 -0.525 . . . . 10.0 111.57 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 59.75 41.4 18.37 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.093 0.473 . . . . 10.0 111.218 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.467 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 24.0 mtm -117.94 173.18 6.92 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.655 -0.702 . . . . 10.0 109.913 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -105.13 161.0 14.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.626 -0.261 . . . . 10.0 110.795 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.426 HD23 ' OE2' ' A' ' 69' ' ' GLU . 20.1 tp -132.15 134.61 45.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.375 0.607 . . . . 10.0 111.22 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 19.7 m -118.57 96.14 5.15 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.054 -0.975 . . . . 10.0 110.07 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.448 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 17.8 t80 -89.96 97.78 11.39 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.128 -0.693 . . . . 10.0 109.128 179.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -107.19 48.44 0.84 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.556 0.693 . . . . 10.0 110.53 -179.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.448 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 38.5 mt -108.31 153.96 41.66 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.206 -0.906 . . . . 10.0 109.329 179.258 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -59.33 -38.19 86.21 Favored 'Trans proline' 0 CA--C 1.529 0.239 0 C-N-CA 122.568 2.179 . . . . 10.0 112.465 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.8 m -152.15 169.67 21.86 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.08 -0.341 . . . . 10.0 110.08 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.419 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 7.7 p-10 -78.4 143.51 36.74 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.816 -0.439 . . . . 10.0 109.816 178.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -121.15 138.72 54.07 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.466 -0.334 . . . . 10.0 111.017 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.472 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.7 OUTLIER -81.61 158.93 24.18 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.394 179.301 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.62 133.77 55.37 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.047 -0.353 . . . . 10.0 110.047 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.0 pt -78.35 -29.82 15.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 112.437 0.532 . . . . 10.0 112.437 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 144.34 -64.92 0.46 Allowed Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.043 -1.075 . . . . 10.0 113.74 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -68.16 6.78 0.76 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 123.227 2.618 . . . . 10.0 113.762 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.9 t -76.88 -38.23 28.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.105 0.479 . . . . 10.0 110.115 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 41.8 m -67.69 -15.72 63.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.141 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -79.71 -9.83 59.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.149 0.499 . . . . 10.0 110.329 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 28.8 mt -94.78 113.51 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.8 m -139.13 93.89 2.74 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.93 -179.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 15.3 t -131.21 155.67 46.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.481 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.88 -6.34 54.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.169 0.509 . . . . 10.0 111.101 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.4 m -100.68 114.95 29.12 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.559 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.1 p -62.37 -30.92 50.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.183 -178.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -68.17 -40.85 82.17 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -67.03 -39.38 86.98 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.359 -0.608 . . . . 10.0 109.359 178.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.18 -50.33 74.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.266 178.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.63 -33.54 74.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.15 0.5 . . . . 10.0 110.396 179.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 97.8 m -64.5 -50.61 66.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.404 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -66.03 -44.15 85.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.85 -0.613 . . . . 10.0 110.173 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -54.2 -54.24 42.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.633 -0.712 . . . . 10.0 110.953 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.7 m -62.06 -34.71 76.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.415 -0.357 . . . . 10.0 111.74 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.73 -37.1 80.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.151 0.501 . . . . 10.0 111.133 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 16.0 t -87.87 -49.29 14.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.2 0.524 . . . . 10.0 111.023 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.434 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.4 m-30 -62.25 -23.89 66.94 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.598 0.962 . . . . 10.0 113.598 -178.09 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.531 ' O ' HG22 ' A' ' 133' ' ' VAL . . . -54.96 -22.99 16.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.743 0.306 . . . . 10.0 111.14 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.06 -37.36 75.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.133 0.492 . . . . 10.0 110.474 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 -85.62 -23.1 27.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.46 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.403 ' HA2' HG22 ' A' ' 131' ' ' VAL . . . 107.54 30.73 3.96 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.63 -0.795 . . . . 10.0 113.034 179.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.434 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 86.9 t -125.09 135.5 63.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.776 0.322 . . . . 10.0 110.5 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 5.2 m -131.38 132.18 44.22 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.222 -0.444 . . . . 10.0 109.891 178.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 11.7 m -122.77 140.97 44.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.052 -178.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.0 m -145.41 163.47 34.52 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.408 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 3.3 t -118.59 127.75 75.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.551 -0.536 . . . . 10.0 109.551 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 20.3 m -145.58 119.33 9.23 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.7 -0.227 . . . . 10.0 111.061 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 58.39 48.6 12.07 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.206 0.602 . . . . 10.0 112.146 179.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.467 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 89.3 m-20 60.1 38.33 20.51 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.804 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -145.85 135.35 23.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.718 -0.674 . . . . 10.0 109.58 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 75.2 mt -92.27 123.34 35.53 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.189 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -106.38 116.9 32.73 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.297 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.9 t -105.73 119.67 55.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 179.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -134.78 140.14 34.39 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.824 -178.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -80.44 140.41 13.49 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 122.235 1.956 . . . . 10.0 111.275 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.403 HG22 ' HA2' ' A' ' 116' ' ' GLY . 3.9 m -108.64 145.55 31.85 Favored Pre-proline 0 C--N 1.323 -0.574 0 C-N-CA 120.96 -0.296 . . . . 10.0 110.935 179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -78.71 89.07 1.39 Allowed 'Trans proline' 0 C--O 1.236 0.405 0 C-N-CA 122.906 2.404 . . . . 10.0 112.082 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . 0.531 HG22 ' O ' ' A' ' 113' ' ' ALA . 19.7 m -134.56 176.9 7.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.294 -179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.2 m -154.39 138.77 16.72 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.764 0.316 . . . . 10.0 110.845 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 47.1 m -89.48 -16.07 31.62 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.004 0.431 . . . . 10.0 110.475 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 155.46 -67.38 0.3 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.816 -0.707 . . . . 10.0 112.08 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -148.52 -51.44 0.17 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.892 0.377 . . . . 10.0 110.763 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 21.7 ttmm -95.74 159.01 15.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.397 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.187 0 CA-C-O 117.959 -1.02 . . . . 10.0 109.682 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.795 0 N-CA-C 111.98 -0.448 . . . . 10.0 111.98 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.5 m -84.55 94.3 8.55 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.983 0.421 . . . . 10.0 110.337 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 9.2 p80 -100.62 70.12 1.43 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.406 0.622 . . . . 10.0 110.475 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 64.8 mtt -96.23 85.26 3.93 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.703 -0.681 . . . . 10.0 110.366 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.45 130.44 41.92 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.686 -0.688 . . . . 10.0 111.24 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -126.56 90.78 49.01 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.99 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -68.67 111.06 2.47 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.233 1.955 . . . . 10.0 111.914 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -69.15 148.22 97.6 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.204 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -62.54 111.1 1.23 Allowed 'Trans proline' 0 N--CA 1.462 -0.352 0 C-N-CA 122.412 2.075 . . . . 10.0 112.026 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -76.86 -24.65 52.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.431 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -78.16 75.34 4.69 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.043 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -169.72 110.3 0.37 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 121.005 -0.617 . . . . 10.0 111.704 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.9 30.31 76.84 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 121.248 -0.501 . . . . 10.0 112.335 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.1 mpt_? -103.22 -39.25 6.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.228 0.537 . . . . 10.0 111.033 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 70.6 m95 -78.83 2.42 20.02 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.25 -178.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -92.62 -1.59 56.77 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.502 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -67.28 142.44 56.87 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.472 -0.331 . . . . 10.0 110.172 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -146.43 158.41 11.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.944 -179.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -108.12 -18.7 13.71 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.166 179.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -150.24 135.32 17.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.621 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -85.76 -32.71 21.7 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.998 0.427 . . . . 10.0 110.971 -179.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -121.95 116.01 23.57 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.287 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -118.07 154.29 32.31 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.698 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -165.5 147.51 6.39 Favored Pre-proline 0 N--CA 1.44 -0.953 0 CA-C-N 115.576 -0.738 . . . . 10.0 109.881 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -61.76 93.3 0.12 Allowed 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.883 2.388 . . . . 10.0 112.144 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.6 m -83.75 94.04 8.07 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.13 0.491 . . . . 10.0 110.836 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -107.75 94.76 5.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.303 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 pt -121.4 111.72 33.24 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.618 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -69.8 101.3 0.9 Allowed 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 122.485 2.123 . . . . 10.0 111.74 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -141.05 111.01 6.56 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.835 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -98.79 140.25 33.26 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.247 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.05 121.74 16.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.969 0.414 . . . . 10.0 110.876 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 49.5 m -154.91 104.11 2.46 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.277 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -72.93 124.63 25.82 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.199 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 13.2 m -77.24 123.11 26.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.495 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -92.15 117.4 29.82 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -158.61 165.61 34.05 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.595 -179.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -78.56 124.48 28.2 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.717 -0.846 . . . . 10.0 108.717 177.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.41 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 44.8 p -104.86 163.48 17.1 Favored Pre-proline 0 C--N 1.313 -0.982 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.748 -178.097 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.41 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 95.6 Cg_endo -80.53 12.26 2.63 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 121.787 1.658 . . . . 10.0 112.074 178.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 21.4 ptm -112.32 -18.35 12.52 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.76 -62.89 1.19 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.835 0.35 . . . . 10.0 111.517 -179.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.0 -49.37 1.4 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.511 -0.852 . . . . 10.0 112.129 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 32.5 p -130.74 168.92 16.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 117.028 0.414 . . . . 10.0 110.511 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 59.8 tp -57.49 -44.77 85.23 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.271 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -59.23 -53.49 57.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.835 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -33.32 71.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.482 -0.326 . . . . 10.0 111.677 -179.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 51.3 ttp -69.23 -49.96 51.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.101 0.477 . . . . 10.0 110.042 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.4 mt -65.11 -33.9 77.12 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.655 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -61.34 -39.77 91.79 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 178.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -65.89 -42.14 90.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.005 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 43.0 m0 -62.46 -51.85 65.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.174 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.0 -44.99 94.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.57 -0.741 . . . . 10.0 111.838 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.02 -47.83 84.6 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 111.796 0.295 . . . . 10.0 111.796 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.04 -20.23 62.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.912 0.387 . . . . 10.0 111.36 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.5 t -96.93 -1.81 45.0 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.317 -0.402 . . . . 10.0 110.738 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 9.8 m120 60.44 41.39 16.03 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.525 0.679 . . . . 10.0 110.172 -179.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 26.8 mtm -121.17 168.82 11.16 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.303 -0.862 . . . . 10.0 110.453 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -98.42 160.52 14.23 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.084 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 34.5 tp -129.44 134.15 47.68 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.78 0.324 . . . . 10.0 110.577 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.459 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 0.5 OUTLIER -121.14 97.37 5.49 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.027 179.157 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.563 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 20.6 t80 -84.12 98.22 9.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.556 -0.747 . . . . 10.0 109.587 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.509 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 84.8 m-20 -100.38 37.54 1.66 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.073 0.463 . . . . 10.0 110.462 -179.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.563 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 26.6 mt -103.42 150.83 38.4 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 116.062 -0.517 . . . . 10.0 109.868 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -64.65 -34.48 51.25 Favored 'Trans proline' 0 CA--C 1.531 0.326 0 C-N-CA 122.579 2.186 . . . . 10.0 112.939 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.9 m -148.05 172.68 13.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.666 0.27 . . . . 10.0 110.752 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -83.88 130.99 34.9 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.273 -0.64 . . . . 10.0 109.273 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -114.78 149.84 36.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.964 0.411 . . . . 10.0 111.309 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.96 169.46 11.2 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.219 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.62 129.7 38.21 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 178.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 pt -67.1 -28.55 43.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 112.084 0.401 . . . . 10.0 112.084 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 145.8 -70.75 0.36 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.525 -0.845 . . . . 10.0 112.905 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.92 5.14 0.68 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.237 2.625 . . . . 10.0 113.435 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 3.8 t -67.68 -39.23 81.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.034 0.445 . . . . 10.0 110.185 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 9.1 m -68.19 -11.06 58.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.375 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -88.77 -6.68 57.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.889 0.376 . . . . 10.0 110.628 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 42.1 mt -93.93 107.52 19.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 N-CA-C 109.156 -0.683 . . . . 10.0 109.156 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.0 m -141.17 104.74 4.69 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.4 t -132.42 157.2 45.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.107 -0.497 . . . . 10.0 109.785 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.78 -11.71 47.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.848 0.356 . . . . 10.0 111.613 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.6 m -98.38 118.57 35.34 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.212 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.46 -32.69 54.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.748 0.309 . . . . 10.0 111.342 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -66.93 -43.2 83.88 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -66.91 -40.31 87.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.769 179.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.08 -46.72 75.48 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.364 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.01 -36.36 84.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.166 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 39.0 m -64.85 -50.64 65.84 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.886 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -66.12 -44.43 84.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.398 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.421 ' HB3' ' CG2' ' A' ' 119' ' ' VAL . 3.2 tp -58.07 -48.1 81.17 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 120.945 0.402 . . . . 10.0 110.165 179.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 70.4 m -61.46 -31.2 71.16 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.686 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.4 -39.45 94.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.15 0.5 . . . . 10.0 110.953 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.1 t -86.91 -34.91 7.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.926 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.457 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.6 m-30 -79.75 -23.87 41.95 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 113.576 0.954 . . . . 10.0 113.576 -177.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.49 ' O ' HG23 ' A' ' 133' ' ' VAL . . . -49.46 -42.23 42.56 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.059 0.392 . . . . 10.0 112.059 -179.555 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.36 -21.91 62.84 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.032 0.444 . . . . 10.0 111.336 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -87.83 -12.83 43.81 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.591 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 96.46 18.71 29.83 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.954 -0.641 . . . . 10.0 112.392 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.457 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 57.6 t -123.52 137.37 56.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.881 0.372 . . . . 10.0 111.005 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.1 m -138.52 122.3 17.61 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.543 -0.539 . . . . 10.0 109.543 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.421 ' CG2' ' HB3' ' A' ' 108' ' ' LEU . 6.0 m -107.16 139.56 28.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.941 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 37.2 m -149.58 144.02 25.95 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.409 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 2.1 p -106.08 122.24 59.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 44.7 m -140.4 124.34 17.4 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.415 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 62.73 46.58 5.16 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.68 0.613 . . . . 10.0 110.839 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 20.3 m-20 54.02 40.78 31.97 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.823 0.821 . . . . 10.0 110.394 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.459 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 57.2 tttt -143.08 129.06 19.57 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.809 -1.087 . . . . 10.0 108.929 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 21.7 mt -88.45 122.22 31.69 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.448 ' CD2' ' HB2' ' A' ' 80' ' ' SER . 14.8 mt -114.25 134.18 55.11 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 120.971 0.415 . . . . 10.0 110.52 -178.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.509 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 2.5 t -111.39 119.03 58.88 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 108.293 -1.003 . . . . 10.0 108.293 178.115 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -125.63 135.88 27.57 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-O 120.776 0.322 . . . . 10.0 110.969 -178.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -79.72 134.83 11.12 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.194 1.929 . . . . 10.0 111.682 178.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.8 m -106.1 147.1 34.22 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.61 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -77.86 94.15 1.08 Allowed 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 122.693 2.262 . . . . 10.0 112.783 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 113' ' ' ALA . 4.6 m -135.49 31.52 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.107 0.48 . . . . 10.0 110.804 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 70.6 m -116.04 37.41 3.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.299 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 3.4 m -79.4 -29.84 42.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.008 0.432 . . . . 10.0 110.36 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -109.66 -48.18 0.81 Allowed Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.951 -0.642 . . . . 10.0 112.057 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -87.82 171.84 10.08 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.417 0.151 . . . . 10.0 110.604 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -161.68 132.81 5.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.767 -0.197 . . . . 10.0 110.555 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 27.7 tp . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.566 -0.73 . . . . 10.0 110.411 179.566 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.713 0 N-CA-C 111.709 -0.556 . . . . 10.0 111.709 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 7.6 m -69.95 147.8 49.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.007 0.432 . . . . 10.0 111.164 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 67.7 m80 -125.63 157.22 37.78 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.607 -179.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.3 ttt -86.99 70.37 10.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.074 0.464 . . . . 10.0 110.11 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.5 t -173.57 149.55 1.67 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.957 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 70.7 tttt -138.75 126.13 13.29 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.582 -0.281 . . . . 10.0 110.889 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.67 167.88 23.37 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.662 2.241 . . . . 10.0 111.949 179.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 68.59 156.82 0.15 Allowed Pre-proline 0 N--CA 1.465 0.318 0 O-C-N 123.794 0.684 . . . . 10.0 111.331 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -78.94 56.45 6.01 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.419 2.079 . . . . 10.0 112.416 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -71.22 -42.3 69.11 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.864 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -77.51 -4.58 46.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.891 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.43 -126.46 8.38 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.997 -0.62 . . . . 10.0 111.816 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 91.41 10.18 62.37 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.628 -0.796 . . . . 10.0 112.569 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.403 ' HD3' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -75.94 -30.43 58.7 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.768 -0.456 . . . . 10.0 109.768 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 42.6 m95 -71.5 -33.18 69.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.791 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.6 ptpt -86.1 -7.43 58.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.207 -0.451 . . . . 10.0 111.017 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 4.4 t-160 -83.54 85.79 7.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.22 0.533 . . . . 10.0 109.761 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 17.8 m -133.15 161.3 41.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.352 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -97.77 128.01 44.12 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.95 0.405 . . . . 10.0 110.048 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.8 t-80 -89.4 59.65 4.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.354 0.597 . . . . 10.0 110.143 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -137.05 115.17 11.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.993 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -82.94 97.55 8.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.405 -179.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -149.22 163.2 38.33 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.014 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.16 142.38 63.72 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.46 -0.337 . . . . 10.0 110.387 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -66.79 -33.86 32.85 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.482 2.121 . . . . 10.0 111.526 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.7 m -116.89 82.95 1.89 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.006 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -68.64 110.24 4.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.663 -0.699 . . . . 10.0 111.218 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.404 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 22.8 pt -112.44 137.62 21.66 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 115.839 -0.619 . . . . 10.0 109.949 179.045 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 47' ' ' ILE . 23.4 Cg_exo -64.9 150.23 88.41 Favored 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 122.484 2.123 . . . . 10.0 111.824 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 18.0 tp -112.75 79.43 1.23 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.328 0.585 . . . . 10.0 110.453 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -75.45 125.03 28.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.531 -0.759 . . . . 10.0 109.864 179.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.33 118.2 9.67 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.999 0.428 . . . . 10.0 111.738 -179.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 4.7 m -141.89 77.9 1.61 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.459 0.647 . . . . 10.0 109.713 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -75.36 135.24 40.84 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.104 -0.953 . . . . 10.0 111.039 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.5 m -87.1 117.73 26.02 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.414 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -83.3 123.53 29.71 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.385 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -155.53 149.76 25.8 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.047 -0.524 . . . . 10.0 109.969 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.8 130.22 34.71 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.786 0.327 . . . . 10.0 110.529 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 48.0 p -107.74 153.72 41.35 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.052 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.55 5.92 2.18 Favored 'Trans proline' 0 CA--C 1.53 0.308 0 C-N-CA 122.386 2.058 . . . . 10.0 111.819 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.3 mtt -105.97 -12.42 15.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.752 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -69.05 -52.04 32.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.019 0.437 . . . . 10.0 110.505 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 97.74 -68.46 0.75 Allowed Glycine 0 N--CA 1.444 -0.806 0 C-N-CA 120.511 -0.852 . . . . 10.0 112.816 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.417 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 67.6 p -126.83 170.34 12.3 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.084 0.469 . . . . 10.0 112.199 -178.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 54.1 tp -57.38 -43.06 83.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.898 -1.046 . . . . 10.0 110.764 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -59.94 -52.44 65.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.945 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -43.05 91.5 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.256 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 50.8 ttp -63.36 -52.33 62.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.69 -0.686 . . . . 10.0 111.117 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 74.9 mt -62.51 -36.78 83.65 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.31 -0.404 . . . . 10.0 111.24 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -60.01 -44.01 94.84 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.7 ttm180 -65.27 -41.76 93.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.467 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 42.7 m0 -61.48 -50.2 73.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.567 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -68.41 -36.6 79.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.702 -179.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.1 -41.1 87.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.518 -0.31 . . . . 10.0 111.813 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -56.28 -39.56 72.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.572 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 67.7 m -101.8 14.09 32.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.447 -0.342 . . . . 10.0 111.792 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 54.99 38.08 29.94 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.068 0.461 . . . . 10.0 111.252 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 11.8 mtm -95.88 173.15 7.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.931 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.44 ' HB2' ' HG3' ' A' ' 125' ' ' LYS . 14.0 mt-30 -103.88 156.42 17.85 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.945 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 23.8 tp -128.52 132.79 48.31 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.089 0.471 . . . . 10.0 110.186 178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.451 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 75.6 m -120.16 97.16 5.46 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.398 -0.819 . . . . 10.0 110.852 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.555 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 9.0 t80 -87.03 98.5 11.31 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.848 -0.614 . . . . 10.0 110.283 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.528 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 37.0 m-80 -99.83 21.97 11.77 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.07 0.462 . . . . 10.0 110.701 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.555 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 41.8 mt -90.27 141.5 27.66 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.672 179.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -61.88 -34.1 82.7 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.695 2.264 . . . . 10.0 112.82 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -138.95 165.63 26.59 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.872 0.368 . . . . 10.0 110.951 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.431 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 6.5 m-20 -86.44 136.62 33.04 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -119.22 140.03 50.9 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.252 -0.579 . . . . 10.0 111.496 -179.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.417 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.8 OUTLIER -79.92 158.13 26.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.06 179.405 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.45 122.63 15.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.988 0.423 . . . . 10.0 110.313 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.547 HD13 ' NE2' ' A' ' 115' ' ' GLN . 4.7 pt -62.5 -30.77 49.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.788 -0.642 . . . . 10.0 111.878 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 140.64 -65.76 0.51 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.452 -0.88 . . . . 10.0 113.152 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -60.88 -5.55 4.84 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.37 2.713 . . . . 10.0 113.604 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.6 t -64.16 -39.26 84.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.277 0.561 . . . . 10.0 109.91 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 66.0 m -71.72 -6.14 39.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.419 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.2 -8.42 39.36 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.27 0.557 . . . . 10.0 110.156 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 56.2 mt -92.74 109.49 21.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.16 -0.682 . . . . 10.0 109.16 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -131.72 95.37 3.71 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.016 -178.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.8 t -131.1 156.25 45.56 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.869 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.49 -10.52 43.35 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 121.13 0.49 . . . . 10.0 110.311 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 29.6 t -96.01 118.54 32.81 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.351 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 11.0 p -64.22 -30.23 49.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.088 0.47 . . . . 10.0 110.295 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -69.77 -44.62 69.76 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.49 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -63.18 -41.62 99.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.868 179.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.46 -49.38 76.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.607 179.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.28 -37.26 84.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.069 0.461 . . . . 10.0 110.488 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 91.1 m -64.94 -48.79 72.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.544 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -64.63 -40.76 96.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.934 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 3.0 mp -60.71 -53.97 50.93 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 116.153 -0.476 . . . . 10.0 109.85 179.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.8 m -55.85 -30.83 62.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.579 0.228 . . . . 10.0 111.54 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.32 -44.12 92.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.767 0.318 . . . . 10.0 111.098 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 8.7 p -90.15 -21.85 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 121.008 0.432 . . . . 10.0 111.929 -179.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -82.41 -25.04 34.05 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.461 0.541 . . . . 10.0 112.461 -179.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.468 ' O ' HG21 ' A' ' 133' ' ' VAL . . . -52.68 -33.7 48.55 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.119 0.414 . . . . 10.0 112.119 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.48 -25.64 67.58 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.811 0.339 . . . . 10.0 111.383 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . 0.547 ' NE2' HD13 ' A' ' 90' ' ' ILE . 1.8 mp0 -92.07 -19.9 21.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.191 0.519 . . . . 10.0 109.682 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.82 30.27 6.17 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.496 -0.775 . . . . 10.0 112.428 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 94.4 t -125.83 140.05 49.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.899 0.381 . . . . 10.0 110.753 -179.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 9.5 m -137.03 131.8 33.34 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.16 -0.473 . . . . 10.0 109.821 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 127' ' ' LEU . 6.4 m -122.95 140.01 47.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.014 0.435 . . . . 10.0 111.165 -178.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.6 m -144.69 163.55 33.66 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.504 -0.316 . . . . 10.0 110.517 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.505 HG21 ' CD2' ' A' ' 126' ' ' LEU . 3.2 t -116.65 115.19 48.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.414 -0.588 . . . . 10.0 109.414 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 19.9 m -136.39 116.65 13.55 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.608 -0.269 . . . . 10.0 110.728 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 59.0 54.25 5.12 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.716 -0.675 . . . . 10.0 111.768 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 55.42 33.53 21.11 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.763 -0.653 . . . . 10.0 111.569 179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.451 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 19.4 tttt -138.83 130.79 27.96 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.382 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.505 ' CD2' HG21 ' A' ' 121' ' ' VAL . 91.1 mt -89.6 121.82 32.16 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.873 -0.788 . . . . 10.0 108.873 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.425 ' O ' ' HA ' ' A' ' 119' ' ' VAL . 4.0 mm? -103.01 115.68 31.07 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.872 -178.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.528 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 3.6 t -105.93 117.82 52.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 107.57 -1.27 . . . . 10.0 107.57 177.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -136.42 142.83 40.95 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-O 120.699 0.285 . . . . 10.0 111.186 -178.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -81.54 130.56 7.0 Favored 'Trans proline' 0 N--CA 1.451 -0.981 0 C-N-CA 122.269 1.979 . . . . 10.0 111.028 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.457 ' HA ' ' HD3' ' A' ' 132' ' ' PRO . 1.7 m -97.68 141.5 23.09 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.547 -179.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' A' ' 131' ' ' VAL . 3.5 Cg_exo -76.87 74.02 5.11 Favored 'Trans proline' 0 N--CA 1.461 -0.408 0 C-N-CA 122.784 2.323 . . . . 10.0 110.886 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . 0.468 HG21 ' O ' ' A' ' 113' ' ' ALA . 15.6 m -109.41 166.05 5.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.299 -179.009 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -152.51 44.4 0.69 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.478 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -74.45 162.5 28.77 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.945 -1.025 . . . . 10.0 110.717 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 76.31 25.24 66.41 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.858 -0.687 . . . . 10.0 112.204 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -112.13 -35.45 5.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.034 0.445 . . . . 10.0 110.654 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -103.36 -10.18 18.85 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.448 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.098 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.534 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.696 0 N-CA-C 112.162 -0.375 . . . . 10.0 112.162 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.9 m -88.09 144.94 26.21 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.891 -0.411 . . . . 10.0 109.891 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -77.04 76.71 3.59 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.874 -0.417 . . . . 10.0 109.874 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 40.1 ttm -101.21 114.29 28.12 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.468 -179.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 13.7 t -99.29 -2.56 36.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.14 -0.482 . . . . 10.0 111.086 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? -124.79 106.11 29.44 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.229 -179.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -68.11 133.02 27.59 Favored 'Trans proline' 0 C--O 1.236 0.388 0 C-N-CA 122.566 2.177 . . . . 10.0 112.265 -179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -125.79 142.86 43.36 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.578 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -75.49 165.83 29.82 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.621 2.214 . . . . 10.0 111.838 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -72.24 148.32 45.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.622 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -79.71 -15.34 57.7 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.166 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -178.93 -133.16 1.87 Allowed Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 121.036 -0.602 . . . . 10.0 111.702 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -142.84 54.86 0.59 Allowed Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.801 -0.714 . . . . 10.0 111.572 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.0 ptt180 -67.1 -25.28 66.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.065 0.459 . . . . 10.0 110.357 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 26.2 m95 -82.35 -5.97 58.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.372 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -120.28 62.14 0.85 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.956 -0.565 . . . . 10.0 109.727 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -84.12 107.93 16.74 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.02 -179.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.2 m -142.92 118.07 4.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.539 -0.755 . . . . 10.0 109.712 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -85.77 112.09 20.76 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 116.071 -0.513 . . . . 10.0 112.101 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 18.3 p80 -147.66 -34.8 0.24 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.362 -0.835 . . . . 10.0 109.758 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -153.95 55.05 0.72 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 179.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.07 -16.22 61.04 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.205 -0.907 . . . . 10.0 111.237 -178.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -98.26 170.47 8.85 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.088 -179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -161.47 147.08 10.71 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.518 -0.765 . . . . 10.0 109.665 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -62.1 -47.57 10.08 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.449 2.099 . . . . 10.0 111.734 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.3 m -136.71 106.09 6.08 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.24 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -130.36 116.73 18.71 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.129 0.49 . . . . 10.0 110.038 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 13.3 pt -134.45 139.16 31.88 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.792 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -67.38 102.52 0.7 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.597 2.198 . . . . 10.0 112.04 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.7 mt -133.68 105.5 6.87 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.079 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -104.44 110.45 22.72 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.573 -0.528 . . . . 10.0 109.573 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.65 117.95 9.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.497 -0.774 . . . . 10.0 111.341 -179.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 37.6 m -151.76 107.33 3.34 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.224 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -80.07 126.57 31.23 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.412 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.5 m -77.24 115.56 17.12 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.568 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.501 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 93.0 m-85 -85.87 115.72 23.68 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.915 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.408 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 10.7 pt20 -146.36 160.32 42.2 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.52 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -92.7 114.81 27.47 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.158 179.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.9 p -97.09 153.91 38.33 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 116.408 -0.36 . . . . 10.0 110.836 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -65.42 -16.43 54.18 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.399 2.066 . . . . 10.0 111.638 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 19.0 ptt? -86.2 -6.5 58.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.701 -0.681 . . . . 10.0 110.682 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -79.44 -56.99 3.92 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.187 -0.671 . . . . 10.0 109.187 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 92.86 -69.07 1.69 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.849 -0.691 . . . . 10.0 113.229 178.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 35.5 p -118.91 166.22 13.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.179 0.514 . . . . 10.0 111.993 -178.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 61.4 tp -56.64 -40.69 75.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.852 -1.067 . . . . 10.0 111.06 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -61.53 -51.98 66.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.716 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.97 -40.29 95.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.004 0.43 . . . . 10.0 111.318 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 54.4 ttp -62.2 -53.67 51.89 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.131 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.7 mt -63.82 -33.65 76.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.024 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.11 -43.24 91.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.327 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.3 ttm-85 -67.7 -44.31 78.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.481 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 40.2 m0 -56.65 -52.3 65.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.037 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.77 -45.42 82.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.555 -179.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.92 -40.54 93.56 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.736 0.303 . . . . 10.0 111.62 -179.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -60.62 -41.85 95.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.163 -0.472 . . . . 10.0 111.425 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 20.0 m -98.94 12.32 36.25 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.229 0.455 . . . . 10.0 112.229 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 57.66 41.14 25.88 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.371 0.605 . . . . 10.0 111.389 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 60.3 mtp -104.27 173.48 6.29 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.023 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -104.94 158.06 16.79 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.511 -0.313 . . . . 10.0 110.769 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 19.8 tp -129.5 136.24 49.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.412 0.625 . . . . 10.0 111.577 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.423 ' HB2' ' HG ' ' A' ' 127' ' ' LEU . 1.8 m -124.22 95.34 4.51 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.036 -0.984 . . . . 10.0 109.525 179.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.512 ' CZ ' HD13 ' A' ' 83' ' ' LEU . 12.6 t80 -91.79 97.88 11.27 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.537 -0.542 . . . . 10.0 109.537 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 38.9 m-80 -101.26 31.33 3.73 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.149 0.499 . . . . 10.0 111.065 -178.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.512 HD13 ' CZ ' ' A' ' 81' ' ' TYR . 64.2 mt -96.03 140.54 22.32 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.425 ' C ' ' HG ' ' A' ' 85' ' ' SER . 18.3 Cg_endo -58.59 -30.83 93.13 Favored 'Trans proline' 0 N--CA 1.466 -0.137 0 C-N-CA 122.778 2.319 . . . . 10.0 112.187 -179.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.425 ' HG ' ' C ' ' A' ' 84' ' ' PRO . 17.0 m -149.88 170.5 18.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.224 179.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.455 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 4.9 p-10 -87.06 147.28 25.75 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.953 -0.567 . . . . 10.0 109.699 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -124.55 141.22 52.25 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.71 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -83.9 151.15 25.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.093 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.05 120.77 8.0 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.125 178.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.436 HD11 ' NE2' ' A' ' 115' ' ' GLN . 3.2 pt -67.96 -29.62 45.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 112.567 0.58 . . . . 10.0 112.567 -179.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . 0.4 ' H ' HG21 ' A' ' 93' ' ' VAL . . . 140.35 -65.27 0.52 Allowed Glycine 0 CA--C 1.521 0.427 0 C-N-CA 120.577 -0.82 . . . . 10.0 112.789 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.59 -0.85 2.72 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.913 2.409 . . . . 10.0 112.89 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.4 HG21 ' H ' ' A' ' 91' ' ' GLY . 2.0 t -67.34 -38.21 80.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.118 0.485 . . . . 10.0 109.907 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 74.3 m -68.83 -11.69 60.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.543 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -84.16 -6.75 59.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.164 0.507 . . . . 10.0 110.064 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.408 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 34.8 mt -94.76 105.25 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-N 115.782 -0.645 . . . . 10.0 109.6 179.617 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.0 m -139.5 96.02 3.02 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.374 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.0 t -131.32 156.32 45.69 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.59 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.54 -13.41 51.89 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.085 0.469 . . . . 10.0 110.753 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.9 t -94.49 114.69 26.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.105 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.501 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 9.3 p -65.07 -30.99 52.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.993 0.425 . . . . 10.0 109.943 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -67.78 -43.27 80.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.79 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -66.79 -40.38 88.1 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.272 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.92 -50.81 67.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.751 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.93 -31.51 72.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.918 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 54.4 m -66.69 -45.42 78.89 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.156 0.503 . . . . 10.0 110.395 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -71.23 -41.33 70.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.714 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 19.2 mt -58.07 -48.66 79.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 10.0 111.391 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.536 ' O ' ' HB3' ' A' ' 113' ' ' ALA . 4.9 p -62.83 -22.79 66.9 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.038 0.384 . . . . 10.0 112.038 -179.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.77 -43.71 45.14 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.282 0.563 . . . . 10.0 110.494 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 13.6 t -78.96 -32.52 15.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 121.58 0.705 . . . . 10.0 110.707 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.447 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.1 m-85 -81.16 -21.94 39.33 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.28 -0.873 . . . . 10.0 112.574 -178.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.536 ' HB3' ' O ' ' A' ' 109' ' ' SER . . . -52.84 -27.95 20.63 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.772 0.286 . . . . 10.0 111.772 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.4 -21.36 61.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.073 0.463 . . . . 10.0 111.123 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . 0.436 ' NE2' HD11 ' A' ' 90' ' ' ILE . 2.4 mp0 -95.44 -25.99 16.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.981 -0.554 . . . . 10.0 109.691 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 107.41 34.06 2.99 Favored Glycine 0 N--CA 1.448 -0.539 0 CA-C-N 115.62 -0.718 . . . . 10.0 112.291 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.447 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 72.2 t -128.87 128.07 67.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.682 0.277 . . . . 10.0 111.104 -179.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.4 m -123.47 104.29 8.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.21 0.529 . . . . 10.0 110.179 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 5.2 m -94.23 139.7 17.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.924 179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -147.11 152.49 38.56 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.045 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.424 HG11 HD22 ' A' ' 126' ' ' LEU . 2.9 t -110.12 120.69 61.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 17.5 m -136.91 115.87 12.32 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.544 -0.298 . . . . 10.0 111.103 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 63.21 48.56 3.64 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.669 -0.696 . . . . 10.0 111.523 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 16.0 t30 60.73 23.54 13.42 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.082 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 40.9 tttt -126.74 131.0 51.43 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.475 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.424 HD22 HG11 ' A' ' 121' ' ' VAL . 95.2 mt -88.09 121.62 30.71 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 108.822 -0.807 . . . . 10.0 108.822 179.315 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.423 ' HG ' ' HB2' ' A' ' 80' ' ' SER . 0.3 OUTLIER -117.46 119.52 35.31 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.201 0.524 . . . . 10.0 111.035 -179.031 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.516 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 2.8 t -102.89 119.67 51.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 CA-C-N 115.644 -0.707 . . . . 10.0 109.104 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -127.66 132.99 24.62 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-O 120.909 0.385 . . . . 10.0 110.815 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.53 132.44 12.22 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 122.7 2.266 . . . . 10.0 112.554 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 1.1 m -96.61 148.3 34.23 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.053 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -79.76 72.72 6.37 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 122.57 2.18 . . . . 10.0 112.62 -179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 27.5 m -127.34 162.91 31.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.291 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 2.2 m -89.41 107.15 18.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.777 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.54 -21.96 65.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.309 0.576 . . . . 10.0 110.729 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -152.88 -160.82 9.88 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 111.043 -0.823 . . . . 10.0 111.043 179.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -71.84 84.46 0.93 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.932 0.396 . . . . 10.0 110.456 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -137.73 156.53 47.89 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.727 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 28.1 tp . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.577 -0.725 . . . . 10.0 110.093 179.962 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.534 0 N-CA-C 111.681 -0.568 . . . . 10.0 111.681 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 m -61.19 -47.27 86.9 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.688 0.28 . . . . 10.0 111.242 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 -78.54 86.2 4.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.673 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 65.2 mtt -71.84 147.16 47.44 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.601 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.5 t -164.65 150.58 10.37 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.083 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -142.09 108.67 5.85 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-O 120.969 0.414 . . . . 10.0 110.743 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -75.02 128.7 11.68 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.555 2.17 . . . . 10.0 112.233 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -136.08 155.68 77.44 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.049 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.16 102.7 0.19 Allowed 'Trans proline' 0 C--O 1.235 0.36 0 C-N-CA 122.609 2.206 . . . . 10.0 112.147 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -99.22 -57.11 2.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.401 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -164.48 127.14 2.36 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.812 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -76.6 -76.06 0.85 Allowed Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.724 -0.75 . . . . 10.0 112.735 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 64.97 54.21 29.27 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.807 -0.711 . . . . 10.0 111.578 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -100.48 -176.98 3.36 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 51.8 m95 59.76 42.77 16.26 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.324 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -98.31 -173.12 2.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.607 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 57.68 67.93 0.91 Allowed 'General case' 0 C--O 1.233 0.204 0 O-C-N 123.897 0.748 . . . . 10.0 109.81 -179.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -144.76 118.09 2.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.676 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.7 t30 -152.33 125.28 8.52 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.918 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -128.56 16.23 6.48 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.432 0.634 . . . . 10.0 109.598 179.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -89.66 97.28 11.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.642 -0.708 . . . . 10.0 110.129 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -131.08 75.55 1.66 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.004 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -157.39 159.85 37.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.442 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -110.8 149.9 41.04 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.561 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -62.09 -53.9 1.77 Allowed 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.308 2.005 . . . . 10.0 111.036 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.4 m -111.87 94.88 5.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.876 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -79.98 -37.82 33.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.309 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -65.86 152.02 94.0 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.794 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -52.28 114.61 1.73 Allowed 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.017 2.478 . . . . 10.0 111.998 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 31.3 tp -95.34 93.57 7.34 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.907 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -84.36 124.83 31.71 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.78 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.75 105.52 0.31 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.06 0.457 . . . . 10.0 111.713 -179.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.4 m -132.49 90.43 2.78 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.636 -0.711 . . . . 10.0 109.436 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -71.15 129.61 39.38 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.497 -0.774 . . . . 10.0 111.235 -179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.8 m -87.72 113.79 23.73 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.093 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -80.47 108.55 14.19 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.095 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.438 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 16.6 pt20 -141.99 159.56 41.98 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.886 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.611 ' HB2' ' SD ' ' A' ' 67' ' ' MET . . . -92.92 126.97 38.26 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.03 -0.532 . . . . 10.0 109.842 178.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.2 p -118.31 158.86 45.57 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 116.115 -0.493 . . . . 10.0 109.972 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -72.04 -0.96 9.3 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 122.183 1.922 . . . . 10.0 111.495 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 68.5 mtm -90.31 -26.83 19.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.444 -0.798 . . . . 10.0 110.259 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -65.79 -50.08 66.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.964 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.43 -66.11 1.77 Allowed Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.589 -0.815 . . . . 10.0 113.153 178.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 29.9 p -125.35 173.93 8.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.143 0.497 . . . . 10.0 111.86 -178.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 46.1 tp -62.75 -41.22 99.1 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.006 -0.997 . . . . 10.0 110.491 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -61.31 -54.74 40.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.841 -179.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.92 -42.09 84.04 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.402 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.611 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 57.3 ttp -61.2 -51.5 68.73 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.488 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 86.4 mt -64.03 -38.04 89.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.116 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -60.34 -44.8 95.17 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 120.853 0.359 . . . . 10.0 110.311 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.0 mtp85 -68.98 -42.16 76.9 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.44 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 31.2 m0 -55.69 -48.54 74.92 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.43 0.633 . . . . 10.0 109.863 178.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -68.55 -51.84 38.52 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.158 -0.928 . . . . 10.0 111.613 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.27 -46.28 72.63 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.057 0.391 . . . . 10.0 112.057 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -60.75 -40.19 91.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.94 0.4 . . . . 10.0 111.571 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.4 m -93.14 9.71 34.8 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.887 -178.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 56.14 48.25 17.86 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.482 0.658 . . . . 10.0 110.45 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 81.1 mtp -116.2 173.54 6.53 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.047 -0.979 . . . . 10.0 109.88 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -108.83 160.74 15.74 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.433 -0.348 . . . . 10.0 110.228 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 19.9 tp -133.71 143.0 48.23 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.291 0.567 . . . . 10.0 110.773 -179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.475 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 31.7 m -127.91 96.06 4.38 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.042 -0.981 . . . . 10.0 109.595 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.512 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 13.8 t80 -93.02 98.16 11.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.441 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -98.64 22.07 10.45 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.075 0.464 . . . . 10.0 111.159 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.512 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 48.0 mt -88.01 143.59 33.37 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 109.565 -0.532 . . . . 10.0 109.565 179.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -61.71 -30.79 85.66 Favored 'Trans proline' 0 N--CA 1.465 -0.162 0 C-N-CA 122.633 2.222 . . . . 10.0 112.881 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.3 m -148.27 167.73 24.39 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.608 -0.269 . . . . 10.0 110.576 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.449 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 3.8 p-10 -83.47 146.16 28.55 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -129.16 149.56 50.91 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 110.241 -0.281 . . . . 10.0 110.241 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.58 169.95 11.28 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.79 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -74.19 144.28 44.84 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.813 -0.44 . . . . 10.0 109.813 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.7 pt -83.64 -36.15 12.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.337 -0.392 . . . . 10.0 111.71 -179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 155.07 -67.92 0.3 Allowed Glycine 0 N--CA 1.453 -0.19 0 C-N-CA 120.297 -0.954 . . . . 10.0 113.13 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.5 -12.13 13.11 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 123.395 2.73 . . . . 10.0 113.468 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.9 t -63.75 -39.49 85.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.028 0.442 . . . . 10.0 110.357 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 1.3 m -69.08 -7.53 36.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.843 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.99 -3.28 48.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.035 0.445 . . . . 10.0 110.604 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.438 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 52.2 mt -95.79 113.47 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.74 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.0 m -141.98 91.52 2.36 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.34 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 11.9 t -129.97 155.8 45.5 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.299 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.81 -10.77 54.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.037 0.446 . . . . 10.0 111.071 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.5 t -93.54 113.26 25.34 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.776 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.25 -28.94 45.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.054 0.454 . . . . 10.0 110.439 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 61.7 mt-30 -70.51 -39.64 73.98 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.013 -0.539 . . . . 10.0 109.81 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . 0.419 ' O ' ' HB ' ' A' ' 106' ' ' THR . 53.7 tp60 -69.99 -41.0 74.96 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.047 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.99 -50.03 73.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.51 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.47 -30.75 71.82 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.367 179.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.419 ' HB ' ' O ' ' A' ' 103' ' ' GLN . 55.5 m -64.34 -51.07 65.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.824 -0.625 . . . . 10.0 110.811 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -68.09 -39.75 82.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.153 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.426 ' O ' HG13 ' A' ' 111' ' ' VAL . 1.6 mp -60.95 -50.9 71.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.126 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 13.0 p -63.54 -31.93 73.24 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.102 -0.239 . . . . 10.0 111.247 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.23 -40.79 98.44 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.146 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.426 HG13 ' O ' ' A' ' 108' ' ' LEU . 12.0 p -89.28 -24.31 5.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 120.945 0.403 . . . . 10.0 111.942 -179.233 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 3.4 m-30 -83.35 -24.26 32.15 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.575 0.954 . . . . 10.0 113.575 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.04 -32.62 15.91 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.64 -18.94 62.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.903 0.382 . . . . 10.0 111.386 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -98.03 -0.26 44.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.021 0.439 . . . . 10.0 110.182 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.85 21.25 56.25 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.975 -0.631 . . . . 10.0 112.887 179.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 92.5 t -121.49 128.64 75.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.805 0.336 . . . . 10.0 110.554 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.9 m -126.96 104.17 7.86 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.982 0.42 . . . . 10.0 110.728 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 27.7 m -94.59 148.26 5.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.012 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 18.9 m -154.62 175.89 13.09 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.887 -0.783 . . . . 10.0 108.887 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 13.9 p -142.62 125.77 14.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 121.526 0.679 . . . . 10.0 110.268 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 19.6 m -113.25 108.31 17.09 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.246 -0.888 . . . . 10.0 109.36 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 64.57 -89.61 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 O-C-N 123.755 0.66 . . . . 10.0 111.346 -179.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.9 m-20 -132.76 23.96 4.31 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.188 0.518 . . . . 10.0 109.843 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.475 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 38.6 tttt -125.72 127.91 46.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.032 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 36.0 mt -87.31 122.28 30.87 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.463 -0.939 . . . . 10.0 108.463 178.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -107.12 115.58 30.43 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.179 0.514 . . . . 10.0 111.121 -178.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.7 t -112.4 117.91 56.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 108.268 -1.012 . . . . 10.0 108.268 178.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -137.66 143.33 40.13 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-O 120.602 0.239 . . . . 10.0 110.456 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -81.03 142.53 13.76 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.519 2.146 . . . . 10.0 111.932 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 3.3 m -108.63 143.27 27.19 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.14 179.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -76.61 73.21 5.3 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.708 2.272 . . . . 10.0 112.695 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 25.7 m -126.91 169.77 17.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.573 -0.739 . . . . 10.0 110.084 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 12.9 m -81.06 98.1 7.82 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.138 0.495 . . . . 10.0 111.094 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -93.18 -43.91 8.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.942 -0.572 . . . . 10.0 109.997 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 162.72 179.29 37.2 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.679 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.96 120.49 13.7 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.833 0.349 . . . . 10.0 111.412 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -102.26 -29.27 11.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.75 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 2.4 mm? . . . . . 0 C--O 1.248 0.977 0 CA-C-O 118.527 -0.749 . . . . 10.0 110.261 -179.86 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.733 0 N-CA-C 111.859 -0.496 . . . . 10.0 111.859 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.25 -29.23 70.26 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.909 0.385 . . . . 10.0 111.209 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 47.7 m80 -125.5 157.2 37.61 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.013 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -74.9 99.13 3.72 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.805 -0.443 . . . . 10.0 109.805 179.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.83 89.72 2.34 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.009 0.433 . . . . 10.0 111.306 -179.534 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 44.9 tttp -91.22 125.18 59.27 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.374 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -70.63 105.83 1.7 Allowed 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.666 2.244 . . . . 10.0 111.561 179.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.95 138.8 72.91 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.745 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -80.81 36.56 0.63 Allowed 'Trans proline' 0 N--CA 1.462 -0.356 0 C-N-CA 122.758 2.305 . . . . 10.0 111.514 179.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -86.1 93.38 8.99 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.429 -0.805 . . . . 10.0 110.309 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -151.99 76.78 1.19 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.22 0.533 . . . . 10.0 111.065 -179.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -113.13 131.11 9.85 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.793 -0.718 . . . . 10.0 111.515 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 97.3 49.66 1.83 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.486 -0.864 . . . . 10.0 111.936 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 13.4 ttt180 -64.73 -39.59 93.89 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.201 0.524 . . . . 10.0 109.666 179.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 11.3 p-90 -141.58 134.1 28.32 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.834 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.1 pttp -153.8 81.67 1.15 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.47 0.652 . . . . 10.0 110.578 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -98.6 96.67 8.11 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.321 -0.854 . . . . 10.0 109.697 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -141.92 122.79 12.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.252 -179.347 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -161.38 128.99 4.15 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.656 178.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -151.93 87.66 1.36 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.358 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -153.94 75.09 1.01 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.289 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -93.39 92.89 7.86 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.039 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -116.52 153.38 32.28 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.601 -179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.84 149.5 9.35 Favored Pre-proline 0 C--N 1.317 -0.827 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.151 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -57.89 103.43 0.14 Allowed 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.854 2.37 . . . . 10.0 111.931 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 8.1 m -75.77 103.1 5.71 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.958 -179.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -139.17 114.1 9.38 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.286 0.565 . . . . 10.0 110.84 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.0 pt -134.85 68.44 71.17 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.694 179.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -68.77 130.92 21.52 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.657 2.238 . . . . 10.0 112.027 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.81 71.58 0.77 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.94 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -115.43 117.01 29.2 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.61 125.61 24.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.646 0.26 . . . . 10.0 110.653 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.9 m -144.38 105.67 4.23 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.127 0.489 . . . . 10.0 111.063 -179.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -78.38 123.57 27.14 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 178.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.6 m -79.83 121.02 24.88 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.86 0.362 . . . . 10.0 111.032 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -90.99 111.64 23.19 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.631 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -146.08 147.83 32.0 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.847 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.501 ' HB2' ' SD ' ' A' ' 67' ' ' MET . . . -81.7 115.25 20.86 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.362 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 73.2 p -96.61 152.23 38.43 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.24 -0.436 . . . . 10.0 109.873 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.93 -18.38 64.66 Favored 'Trans proline' 0 CA--C 1.527 0.159 0 C-N-CA 122.225 1.95 . . . . 10.0 112.041 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.0 ptt? -89.6 2.92 54.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.515 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.596 ' HA ' ' NH1' ' A' ' 70' ' ' ARG . 28.9 m-20 -82.09 -52.21 7.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.262 0.553 . . . . 10.0 109.808 178.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.08 -66.98 2.97 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.534 -0.757 . . . . 10.0 113.697 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.491 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 24.4 p -122.34 165.92 15.51 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.663 0.616 . . . . 10.0 112.663 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 33.2 tp -62.42 -42.05 99.16 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.819 -1.082 . . . . 10.0 111.143 179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 51.8 tttt -57.99 -55.37 35.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.739 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.6 m -59.63 -41.22 89.96 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.155 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.501 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 57.6 ttp -63.54 -52.53 60.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.856 179.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 70.8 mt -62.1 -40.24 95.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.369 -0.378 . . . . 10.0 111.286 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -60.54 -43.39 97.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.312 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.596 ' NH1' ' HA ' ' A' ' 61' ' ' ASP . 97.2 mtt180 -66.85 -42.5 85.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.225 179.287 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -58.83 -54.13 50.58 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.605 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.96 -40.16 96.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.687 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.11 -40.74 94.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.771 0.32 . . . . 10.0 111.311 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.69 -21.14 64.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.408 -179.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.5 m -109.35 7.09 24.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.526 -0.306 . . . . 10.0 111.706 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 61.4 t30 56.46 48.22 17.26 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.837 0.827 . . . . 10.0 110.655 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 72.7 mtp -116.89 173.19 6.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.16 -0.927 . . . . 10.0 110.128 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -106.1 159.48 16.04 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.969 179.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.7 tp -134.8 138.77 44.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.319 0.581 . . . . 10.0 111.669 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.428 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 1.4 m -123.74 96.59 5.02 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.08 179.159 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.616 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 8.7 t80 -91.65 102.82 15.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.864 -178.828 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.482 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 37.1 m-80 -104.85 33.49 3.59 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.009 0.433 . . . . 10.0 110.908 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.519 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 55.6 mt -102.94 146.88 33.23 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.018 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.97 -34.54 94.98 Favored 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.735 2.29 . . . . 10.0 112.321 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.3 m -152.5 166.59 31.51 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.36 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.616 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 9.5 p-10 -84.92 128.75 34.76 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 178.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -100.39 136.99 39.42 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.18 -178.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.491 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.9 OUTLIER -72.59 154.99 40.5 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.518 179.181 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.11 114.84 3.34 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 179.267 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.3 pt -59.74 -32.83 50.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -178.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 149.26 -70.75 0.31 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.578 -0.82 . . . . 10.0 112.66 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.14 -4.69 3.21 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.511 2.807 . . . . 10.0 113.48 -179.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.9 t -64.97 -36.04 76.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.308 0.575 . . . . 10.0 110.236 179.349 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.22 -14.14 62.63 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.544 -0.753 . . . . 10.0 111.677 -179.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -87.67 1.56 53.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.876 0.37 . . . . 10.0 111.1 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 40.3 mt -98.51 110.28 25.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.1 t -141.12 93.99 2.65 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.543 -178.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.8 t -132.19 156.78 45.83 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.511 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -89.5 -13.69 36.91 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.052 0.453 . . . . 10.0 110.791 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.5 114.06 26.34 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.336 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.5 p -62.2 -33.83 60.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.832 0.348 . . . . 10.0 110.854 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -64.18 -39.38 93.87 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.122 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -72.53 -42.1 65.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.305 -0.407 . . . . 10.0 109.999 179.176 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.77 -51.09 66.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.91 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.74 -33.08 74.85 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.958 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 95.9 m -67.59 -47.12 70.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.669 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -66.26 -40.08 89.9 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.262 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.412 ' O ' ' HB2' ' A' ' 112' ' ' TYR . 30.7 mt -61.24 -49.6 76.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.934 179.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.478 ' O ' ' HB1' ' A' ' 113' ' ' ALA . 4.6 p -64.17 -22.14 66.82 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 111.765 0.283 . . . . 10.0 111.765 -179.217 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.49 -46.82 52.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.09 0.471 . . . . 10.0 110.311 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.7 t -75.78 -47.74 32.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.678 0.752 . . . . 10.0 110.334 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.434 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.6 m-30 -64.33 -21.11 66.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.928 -1.033 . . . . 10.0 113.254 -178.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.478 ' HB1' ' O ' ' A' ' 109' ' ' SER . . . -52.18 -28.55 18.64 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.806 0.298 . . . . 10.0 111.806 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.12 -23.72 54.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.148 0.499 . . . . 10.0 111.101 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 17.8 mp0 -89.75 -6.92 55.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.298 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 89.11 27.38 23.53 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.72 -0.752 . . . . 10.0 111.994 -179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.434 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 97.0 t -127.8 134.51 65.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.849 0.357 . . . . 10.0 110.605 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 14.4 m -136.16 105.15 5.91 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.267 0.556 . . . . 10.0 110.614 179.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 13.2 m -97.45 150.09 4.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.522 -0.763 . . . . 10.0 111.145 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 15.1 m -155.66 170.82 21.13 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.366 -0.605 . . . . 10.0 109.366 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 2.8 t -120.96 129.47 75.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 179.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 25.3 m -145.25 117.32 8.32 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.717 0.294 . . . . 10.0 111.268 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.56 50.68 5.59 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.551 -0.749 . . . . 10.0 111.901 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 30.5 t30 59.48 25.86 14.72 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.394 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.428 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 56.7 tttt -131.54 137.64 48.57 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 97.3 mt -87.91 122.16 31.2 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.116 -0.698 . . . . 10.0 109.116 179.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -103.91 115.76 31.05 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.317 -178.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.482 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 10.6 t -108.54 118.22 55.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 N-CA-C 108.552 -0.907 . . . . 10.0 108.552 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -137.71 139.64 27.41 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.436 -178.65 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -79.13 154.4 25.29 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.736 2.29 . . . . 10.0 112.098 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.0 m -121.99 144.61 41.62 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.074 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -82.72 85.78 1.57 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 122.821 2.347 . . . . 10.0 111.803 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . 0.432 HG21 ' O ' ' A' ' 113' ' ' ALA . 16.0 m -124.89 175.97 6.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.156 -178.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.32 164.19 31.51 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.21 179.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.4 m -76.17 -34.9 59.36 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.71 0.291 . . . . 10.0 111.277 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -75.56 102.53 1.51 Allowed Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.736 -0.745 . . . . 10.0 112.561 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -92.55 -29.5 16.15 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.007 0.432 . . . . 10.0 110.85 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.92 173.8 8.03 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.292 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 93.6 mt . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.479 -0.772 . . . . 10.0 110.127 179.387 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 111.924 -0.47 . . . . 10.0 111.924 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.8 m -82.67 122.63 28.39 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.759 0.314 . . . . 10.0 110.403 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 9.6 m170 -106.51 159.35 16.24 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.378 -0.373 . . . . 10.0 110.706 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 8.4 ptt? -123.98 168.61 12.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.49 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.18 145.87 28.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.081 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.03 142.95 14.7 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.4 -179.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -77.74 -171.27 1.14 Allowed 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.771 2.314 . . . . 10.0 112.42 -179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.89 142.88 18.36 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.571 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -59.03 119.95 7.51 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.534 2.156 . . . . 10.0 112.25 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -81.49 169.64 16.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.606 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -127.31 158.04 38.28 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.025 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 177.61 133.15 1.8 Allowed Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.275 -0.964 . . . . 10.0 112.575 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -76.57 82.22 1.07 Allowed Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 111.704 -0.558 . . . . 10.0 111.704 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.51 -2.58 18.81 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.772 0.32 . . . . 10.0 111.148 -179.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -96.04 -1.7 48.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.333 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.6 mttp -80.48 89.96 5.65 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.805 -0.443 . . . . 10.0 109.805 179.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -86.96 98.83 11.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.268 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -141.12 135.93 32.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.137 0.494 . . . . 10.0 111.029 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -85.13 -49.51 8.19 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.117 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 34.0 m-70 -149.04 163.76 36.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.179 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -93.88 70.03 3.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.203 0.525 . . . . 10.0 109.92 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -78.54 104.2 8.98 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.107 -179.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -86.04 -30.73 22.42 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.6 -0.519 . . . . 10.0 109.6 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -159.6 153.79 20.06 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.6 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.96 -30.93 92.82 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.377 2.052 . . . . 10.0 112.098 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 10.5 t -174.39 161.18 3.34 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.314 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -117.06 79.02 1.27 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.201 0.524 . . . . 10.0 110.065 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 29.0 pt -110.88 152.46 43.6 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.678 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.85 141.67 59.93 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.159 1.906 . . . . 10.0 110.601 178.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.68 110.05 21.98 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.176 0.513 . . . . 10.0 110.105 -179.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -99.33 130.17 45.59 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.523 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.99 141.84 31.8 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.954 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 16.1 m -136.54 97.26 3.52 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.203 0.525 . . . . 10.0 109.772 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -79.02 127.99 32.68 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.586 -0.734 . . . . 10.0 111.329 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.7 m -84.39 117.74 23.81 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.143 178.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.434 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 93.0 m-85 -84.99 116.18 23.24 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.006 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -153.08 146.88 25.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.142 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.403 ' HB2' ' HA ' ' A' ' 94' ' ' SER . . . -81.11 136.63 35.94 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.904 -0.406 . . . . 10.0 109.904 179.169 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 80.3 p -119.52 157.91 50.52 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 116.341 -0.391 . . . . 10.0 110.354 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -68.61 -8.16 22.43 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.405 2.07 . . . . 10.0 111.802 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 60.3 mtt -84.72 -17.36 38.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.496 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -73.27 -49.21 28.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.47 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.62 -61.64 4.54 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.871 -0.68 . . . . 10.0 112.413 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 24.4 p -121.55 170.37 9.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.872 0.368 . . . . 10.0 111.085 -179.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.43 ' O ' HD23 ' A' ' 64' ' ' LEU . 1.7 tm? -67.15 -39.09 86.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.226 179.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.41 -55.14 38.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.129 179.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.9 m -65.09 -27.47 68.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.238 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 9.7 tmm? -69.78 -55.27 10.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.371 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 43.0 mt -64.53 -32.74 74.52 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.669 0.271 . . . . 10.0 111.087 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -60.5 -39.06 86.38 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.636 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 59.7 ttp85 -70.18 -41.73 73.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.434 . . . . 10.0 110.222 179.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 29.1 m0 -58.02 -48.72 79.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.473 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -68.97 -42.46 76.59 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.553 -0.749 . . . . 10.0 111.626 -179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.42 -40.76 79.04 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -178.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -63.13 -38.23 90.37 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.854 0.316 . . . . 10.0 111.854 -179.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 10.2 m -98.75 11.63 38.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.435 -0.348 . . . . 10.0 111.817 -178.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 60.5 t30 58.14 30.1 18.86 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.482 0.658 . . . . 10.0 110.762 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 73.1 mtp -92.9 169.67 10.27 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.698 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -106.71 151.09 25.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.043 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 41.9 tp -116.08 126.54 53.89 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.288 0.566 . . . . 10.0 111.117 179.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.417 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 0.5 OUTLIER -108.97 95.87 5.94 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 178.725 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.552 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 7.7 t80 -93.41 101.82 14.04 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.088 -179.056 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.7 m-80 -100.68 31.07 3.65 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.326 0.584 . . . . 10.0 110.452 -179.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.527 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 32.1 mt -105.57 151.24 39.75 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.606 -0.725 . . . . 10.0 109.716 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.74 -27.68 21.47 Favored 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 122.542 2.161 . . . . 10.0 112.918 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.0 m -153.75 167.24 30.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.646 0.26 . . . . 10.0 110.76 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.552 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 6.6 p-10 -93.04 146.3 23.73 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.43 -0.581 . . . . 10.0 109.43 178.441 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -124.78 157.93 34.57 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.416 -0.356 . . . . 10.0 110.237 -179.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.6 OUTLIER -81.76 163.79 22.15 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.087 179.702 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.46 119.35 15.49 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 179.373 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.4 pt -57.41 -34.92 47.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 112.439 0.533 . . . . 10.0 112.439 -179.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 152.31 -72.84 0.27 Allowed Glycine 0 CA--C 1.518 0.279 0 C-N-CA 120.06 -1.067 . . . . 10.0 113.261 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -61.54 -3.25 3.21 Favored 'Trans proline' 0 N--CA 1.478 0.588 0 C-N-CA 123.374 2.716 . . . . 10.0 113.903 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.1 t -61.62 -41.24 89.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.237 0.541 . . . . 10.0 110.64 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.403 ' HA ' ' HB2' ' A' ' 57' ' ' ALA . 0.9 OUTLIER -73.09 -7.11 49.87 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.613 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.09 2.28 56.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.927 0.394 . . . . 10.0 111.017 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 32.5 mt -104.6 113.76 42.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.558 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.4 m -138.34 99.47 3.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.004 0.431 . . . . 10.0 111.868 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.8 t -131.52 156.24 46.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.535 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.56 -13.12 43.78 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.043 0.449 . . . . 10.0 110.903 178.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 17.0 t -93.13 116.82 29.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.219 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.434 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 14.6 p -65.1 -30.38 50.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.921 0.391 . . . . 10.0 110.206 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -68.44 -42.35 79.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.954 -0.567 . . . . 10.0 109.825 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -68.75 -43.37 75.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.937 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.02 -48.34 73.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.626 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.72 -39.61 92.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.573 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 62.2 m -65.69 -48.0 73.53 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.807 -0.633 . . . . 10.0 111.0 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -65.75 -38.71 89.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.045 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 16.7 mt -62.54 -48.89 77.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.749 -0.463 . . . . 10.0 109.749 178.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.8 m -58.95 -33.01 70.13 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.854 -0.612 . . . . 10.0 111.227 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.25 -40.51 94.3 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.933 0.396 . . . . 10.0 110.999 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.85 -40.72 15.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.49 0.662 . . . . 10.0 110.852 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.417 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 8.3 m-30 -69.64 -25.46 63.93 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.249 -0.887 . . . . 10.0 112.647 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.529 ' O ' HG23 ' A' ' 133' ' ' VAL . . . -50.05 -42.27 49.42 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.295 0.48 . . . . 10.0 112.295 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.37 -23.84 67.43 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -95.1 -3.79 47.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.839 0.352 . . . . 10.0 110.928 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 88.62 23.8 35.22 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.715 -0.755 . . . . 10.0 113.237 179.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.417 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 88.6 t -126.33 139.76 50.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.965 0.412 . . . . 10.0 110.578 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.0 m -142.28 140.84 32.33 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 110.068 -0.345 . . . . 10.0 110.068 178.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 11.0 m -126.5 134.23 66.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.103 0.478 . . . . 10.0 111.55 -178.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.8 m -140.1 143.71 36.41 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 179.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 3.1 p -107.75 127.58 63.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-O 121.275 0.559 . . . . 10.0 110.039 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.4 m -145.99 130.53 17.83 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.153 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.32 39.51 18.77 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.564 0.54 . . . . 10.0 111.089 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 14.4 m120 62.67 28.84 16.76 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.65 -0.705 . . . . 10.0 110.986 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.417 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 66.7 tttt -130.81 132.25 45.13 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.867 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 48.9 mt -87.88 122.11 31.11 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.298 -1.001 . . . . 10.0 108.298 179.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.14 115.52 27.65 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.062 0.458 . . . . 10.0 111.286 -178.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 3.2 t -97.17 119.91 45.82 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 N-CA-C 108.742 -0.836 . . . . 10.0 108.742 178.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -132.6 128.48 20.98 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 109.943 -0.392 . . . . 10.0 109.943 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.23 131.22 16.23 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.311 2.008 . . . . 10.0 112.087 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -89.85 149.55 42.14 Favored Pre-proline 0 C--N 1.318 -0.771 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.315 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -79.26 73.34 6.06 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 122.843 2.362 . . . . 10.0 113.263 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 113' ' ' ALA . 16.2 m -129.03 132.0 67.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 120.877 0.37 . . . . 10.0 110.7 179.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 9.0 m -164.03 159.53 20.72 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.007 -0.542 . . . . 10.0 109.789 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.75 115.39 3.95 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.224 0.328 . . . . 10.0 110.669 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 105.01 93.36 2.3 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.933 -0.651 . . . . 10.0 111.582 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -120.43 99.6 6.66 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.79 0.328 . . . . 10.0 110.528 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -81.22 78.06 8.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.383 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 1.5 mm? . . . . . 0 C--O 1.247 0.939 0 CA-C-O 118.578 -0.725 . . . . 10.0 109.968 179.61 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.79 0 N-CA-C 111.816 -0.514 . . . . 10.0 111.816 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.3 m -126.48 103.08 7.41 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.914 0.388 . . . . 10.0 110.662 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 24.1 p-80 -69.41 148.3 49.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.707 179.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.8 ptt? -157.71 153.02 25.97 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.374 -0.376 . . . . 10.0 110.532 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 4.9 m -137.46 113.68 10.01 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.643 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -121.61 82.89 41.14 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.511 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -95.61 172.99 1.14 Allowed 'Trans proline' 0 N--CA 1.452 -0.916 0 C-N-CA 123.116 2.544 . . . . 10.0 111.904 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -136.39 139.83 30.81 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-O 120.657 0.265 . . . . 10.0 110.506 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -75.47 122.91 7.26 Favored 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 122.716 2.277 . . . . 10.0 112.28 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -104.41 162.35 13.3 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.175 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -137.65 66.85 1.44 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.266 0.555 . . . . 10.0 109.97 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -71.42 116.57 6.23 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.532 -0.758 . . . . 10.0 111.662 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 115.13 15.84 7.57 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.747 -0.739 . . . . 10.0 111.724 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.54 -17.1 60.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.056 0.455 . . . . 10.0 110.533 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 74.9 m95 -99.57 6.5 45.76 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.966 179.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.0 mmtt -82.34 12.96 3.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.219 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -72.35 121.89 20.25 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.843 -0.429 . . . . 10.0 109.843 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 7.0 m -134.41 155.0 38.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.662 179.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -154.23 110.43 3.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.091 0.472 . . . . 10.0 111.076 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 35.5 m80 -121.99 98.66 6.05 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 179.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 21.4 p90 -104.96 33.14 3.76 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.033 -0.531 . . . . 10.0 111.025 -178.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -74.15 109.8 7.93 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.677 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -140.52 178.17 7.5 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.583 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.51 146.03 97.51 Favored Pre-proline 0 C--N 1.319 -0.734 0 N-CA-C 110.147 -0.316 . . . . 10.0 110.147 179.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.98 -13.97 42.67 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.825 2.35 . . . . 10.0 112.451 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 15.2 t -169.94 162.7 9.34 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.72 -0.673 . . . . 10.0 109.576 179.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -121.34 88.31 2.91 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.019 0.438 . . . . 10.0 110.432 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.6 pt -127.26 76.11 76.62 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.305 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.42 111.16 3.22 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.644 2.229 . . . . 10.0 112.494 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -130.72 100.54 5.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.178 0.513 . . . . 10.0 110.006 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -127.35 86.82 2.54 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.745 -0.661 . . . . 10.0 110.378 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -113.98 118.17 33.39 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.994 0.426 . . . . 10.0 111.334 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 12.8 m -147.85 91.05 1.89 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.099 -0.704 . . . . 10.0 109.099 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -68.39 125.97 28.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.808 -0.633 . . . . 10.0 111.467 -179.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.4 m -86.19 122.21 29.86 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.76 -0.655 . . . . 10.0 110.4 179.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.418 ' OH ' ' HB3' ' A' ' 75' ' ' SER . 67.4 m-85 -87.68 114.12 24.0 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.741 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -146.64 145.18 29.96 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.91 -0.586 . . . . 10.0 109.994 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -79.18 123.54 27.49 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 178.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.424 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 50.6 p -111.06 158.16 36.68 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-O 120.66 0.267 . . . . 10.0 111.04 -178.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.424 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 35.6 Cg_endo -64.25 -20.19 66.57 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.431 2.087 . . . . 10.0 111.321 178.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -66.28 -35.1 79.54 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -75.11 -56.07 5.1 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.484 -0.932 . . . . 10.0 108.484 178.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.63 -56.13 3.39 Favored Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.309 -0.86 . . . . 10.0 113.536 178.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 63.5 p -108.04 166.03 11.03 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.062 0.458 . . . . 10.0 111.883 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 31.6 tp -61.92 -48.12 81.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.143 -0.935 . . . . 10.0 111.553 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -58.09 -54.55 45.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.77 -0.195 . . . . 10.0 111.133 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.3 m -58.41 -37.84 76.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.98 0.419 . . . . 10.0 111.497 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 10.1 tmm? -68.84 -52.29 31.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.002 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 26.8 mt -63.64 -34.13 77.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.519 -0.309 . . . . 10.0 111.09 -179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -62.24 -43.38 98.97 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 -64.48 -43.04 95.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.076 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 21.3 m0 -60.03 -54.48 45.53 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.719 -0.673 . . . . 10.0 110.985 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.94 -36.82 84.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.982 -0.554 . . . . 10.0 111.655 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.83 -44.05 97.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.811 0.339 . . . . 10.0 111.158 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.04 -34.56 77.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.55 -179.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.418 ' HB3' ' OH ' ' A' ' 55' ' ' TYR . 4.7 p -91.51 0.77 57.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.415 -0.357 . . . . 10.0 111.551 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 56.29 46.41 21.18 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.569 0.699 . . . . 10.0 109.705 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.509 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 21.9 mtm -115.37 168.07 10.3 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.698 -179.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -93.79 150.08 20.69 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.125 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 22.4 tp -124.06 134.66 53.35 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.92 0.39 . . . . 10.0 110.174 179.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.615 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 1.6 m -121.46 95.98 4.9 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.987 179.092 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.502 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 11.6 t80 -90.83 96.78 10.81 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.273 -0.64 . . . . 10.0 109.273 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -98.92 22.52 10.09 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.258 0.552 . . . . 10.0 110.841 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.502 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 63.5 mt -87.56 138.33 31.81 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.537 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -61.44 -35.78 81.15 Favored 'Trans proline' 0 C--O 1.235 0.332 0 C-N-CA 123.08 2.52 . . . . 10.0 113.122 -179.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.8 m -137.51 168.71 19.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.143 0.497 . . . . 10.0 111.037 -179.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -82.78 143.81 30.59 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.574 178.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -124.12 145.43 49.28 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.482 -0.326 . . . . 10.0 110.193 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.461 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 1.5 m -97.82 151.57 20.06 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.882 -179.413 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.54 112.73 1.7 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 120.875 0.369 . . . . 10.0 110.126 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -62.64 -33.8 61.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 112.68 0.622 . . . . 10.0 112.68 -178.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 151.02 -64.78 0.38 Allowed Glycine 0 CA--C 1.519 0.332 0 C-N-CA 120.172 -1.013 . . . . 10.0 113.455 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.56 -13.98 28.45 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.883 2.389 . . . . 10.0 113.16 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.4 t -64.91 -35.5 75.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.862 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.93 -11.48 60.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.427 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.12 2.95 55.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.341 -0.39 . . . . 10.0 111.392 -179.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 39.3 mt -98.0 108.36 21.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.533 -0.303 . . . . 10.0 110.273 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.72 100.43 5.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.755 -179.196 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.2 t -132.54 155.59 48.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.579 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -91.05 -1.63 57.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.846 0.355 . . . . 10.0 111.484 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.4 t -109.01 121.44 45.13 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.467 -0.333 . . . . 10.0 110.279 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.58 -30.78 51.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.83 0.348 . . . . 10.0 110.733 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -68.88 -46.28 68.8 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 179.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -65.12 -36.38 84.08 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.329 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.34 -51.12 70.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.229 178.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.81 -33.38 75.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.632 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 51.5 m -66.91 -46.32 75.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.775 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -70.99 -36.81 72.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.277 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.9 mp -62.75 -47.61 82.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.751 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.1 p -62.45 -29.84 70.81 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 116.734 -0.212 . . . . 10.0 111.281 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.04 -35.74 81.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.166 0.508 . . . . 10.0 110.791 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 45.6 t -84.94 -41.65 15.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.409 0.624 . . . . 10.0 110.264 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.507 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 12.1 m-30 -68.3 -26.75 65.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.166 -0.924 . . . . 10.0 112.273 -178.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -51.02 -44.69 61.05 Favored 'General case' 0 C--N 1.33 -0.279 0 O-C-N 123.07 0.231 . . . . 10.0 111.468 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.62 -23.4 65.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.891 0.377 . . . . 10.0 111.265 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -89.38 -12.46 40.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.786 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 96.13 22.28 20.45 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.604 -0.808 . . . . 10.0 112.809 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.507 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 90.3 t -127.61 145.41 35.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.872 0.367 . . . . 10.0 110.052 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.2 m -139.44 117.92 12.14 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.996 0.427 . . . . 10.0 110.269 178.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 28.0 m -108.48 144.98 16.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.778 -0.647 . . . . 10.0 111.46 -179.536 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 48.5 m -155.47 142.46 19.12 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.885 -0.783 . . . . 10.0 108.885 178.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 2.6 p -104.44 117.39 49.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 -179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 16.6 m -132.52 118.93 19.87 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.252 -178.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.28 51.93 5.19 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 123.916 0.76 . . . . 10.0 112.402 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.509 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 78.3 m-20 60.44 33.89 20.59 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.059 -0.518 . . . . 10.0 111.594 179.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.615 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 64.2 tttt -143.69 129.28 19.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.789 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 36.7 mt -88.26 121.22 30.4 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.604 -0.888 . . . . 10.0 108.604 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -103.39 116.54 32.6 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.667 -179.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 2.8 t -111.43 118.01 56.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 N-CA-C 108.64 -0.874 . . . . 10.0 108.64 178.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -143.39 148.43 44.03 Favored Pre-proline 0 C--N 1.322 -0.625 0 CA-C-O 120.686 0.279 . . . . 10.0 111.144 -178.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -79.06 143.58 18.04 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.552 2.168 . . . . 10.0 110.911 178.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.85 155.19 36.74 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.202 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.31 72.14 3.56 Favored 'Trans proline' 0 CA--C 1.531 0.367 0 C-N-CA 122.771 2.314 . . . . 10.0 112.387 -179.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 21.2 m -137.94 -179.1 2.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.485 -0.779 . . . . 10.0 109.613 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 48.8 m -148.38 100.96 3.2 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.959 0.409 . . . . 10.0 110.586 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.04 121.43 26.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.867 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 84.41 46.57 5.76 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.6 -0.81 . . . . 10.0 111.778 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.54 94.7 8.11 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.994 0.426 . . . . 10.0 110.422 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -77.21 138.7 39.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.559 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 31.1 mt . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.283 -0.865 . . . . 10.0 110.116 179.747 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.685 0 N-CA-C 111.981 -0.448 . . . . 10.0 111.981 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 m -90.13 -25.88 20.48 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.763 0.316 . . . . 10.0 110.848 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -155.91 167.71 29.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.203 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.7 ptt? -83.43 -2.01 54.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.398 -0.365 . . . . 10.0 111.212 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.79 100.49 5.49 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.908 0.385 . . . . 10.0 111.029 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.8 mmtt -98.9 154.98 37.11 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.245 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -71.94 70.29 2.92 Favored 'Trans proline' 0 C--O 1.236 0.394 0 C-N-CA 122.594 2.196 . . . . 10.0 112.186 179.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.28 151.46 21.34 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.056 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.87 -158.86 0.07 OUTLIER 'Trans proline' 0 CA--C 1.532 0.382 0 C-N-CA 122.481 2.12 . . . . 10.0 112.413 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -75.25 -173.13 1.93 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.763 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -58.42 -41.57 85.29 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.99 0.424 . . . . 10.0 110.458 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -120.78 166.53 13.9 Favored Glycine 0 N--CA 1.442 -0.922 0 N-CA-C 111.123 -0.791 . . . . 10.0 111.123 179.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 76.39 75.23 0.89 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.624 -0.798 . . . . 10.0 111.358 -179.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -84.46 -170.84 3.3 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.487 0.184 . . . . 10.0 110.987 -179.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 77.0 m95 64.51 39.42 6.82 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.394 0.616 . . . . 10.0 110.081 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -127.94 29.28 5.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.451 -0.795 . . . . 10.0 109.963 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -85.43 89.7 7.76 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.191 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.58 99.37 4.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.683 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.2 p-10 -150.56 8.25 0.59 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.998 -0.547 . . . . 10.0 110.636 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 69.7 t60 -74.48 99.79 3.67 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.081 0.467 . . . . 10.0 110.19 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -92.62 136.01 33.6 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.639 -0.709 . . . . 10.0 110.664 -179.522 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -117.6 -12.76 10.29 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.623 0.725 . . . . 10.0 109.176 178.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -64.11 143.93 57.5 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 114.688 -1.142 . . . . 10.0 110.689 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -157.08 150.97 19.4 Favored Pre-proline 0 C--N 1.313 -1.018 0 CA-C-N 115.415 -0.811 . . . . 10.0 110.161 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.32 96.65 0.11 Allowed 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 122.574 2.183 . . . . 10.0 111.731 179.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 7.4 m -93.92 84.93 4.63 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.286 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -107.93 90.7 3.38 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.212 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 32.2 pt -104.38 140.04 20.68 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.166 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -62.17 110.4 1.02 Allowed 'Trans proline' 0 N--CA 1.464 -0.243 0 C-N-CA 122.504 2.136 . . . . 10.0 111.38 179.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mt -120.74 59.5 0.92 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.048 -0.524 . . . . 10.0 111.078 -179.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -67.52 116.53 8.36 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.498 -0.556 . . . . 10.0 109.498 179.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.11 111.64 1.4 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.482 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.4 m -132.23 97.91 4.26 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.168 0.508 . . . . 10.0 110.869 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -75.58 114.41 14.12 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.207 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 13.9 m -69.0 114.96 7.76 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.343 0.592 . . . . 10.0 110.256 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.488 ' O ' ' HA ' ' A' ' 97' ' ' SER . 52.0 m-85 -79.59 115.49 19.24 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.526 -0.761 . . . . 10.0 110.865 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -150.69 148.94 29.19 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.73 179.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.34 119.3 24.92 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.258 -0.645 . . . . 10.0 109.258 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.8 p -104.32 153.5 38.99 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.833 -179.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -64.42 -13.11 36.56 Favored 'Trans proline' 0 N--CA 1.465 -0.149 0 C-N-CA 122.67 2.246 . . . . 10.0 111.701 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 24.7 mmt -79.35 -21.96 45.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.313 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -75.31 -51.56 12.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.386 -0.598 . . . . 10.0 109.386 179.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.94 -65.25 2.95 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.918 -0.658 . . . . 10.0 112.846 178.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 30.0 p -117.22 169.73 9.23 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.018 0.437 . . . . 10.0 111.666 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 60.4 tp -62.85 -38.87 92.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.453 -0.794 . . . . 10.0 110.821 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -61.42 -52.17 65.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.474 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.24 -35.47 81.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.273 -0.422 . . . . 10.0 111.546 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.0 tmm? -68.06 -50.62 54.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.849 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 88.2 mt -63.23 -35.85 81.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.842 0.353 . . . . 10.0 110.229 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -61.53 -38.13 86.28 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 178.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 70' ' ' ARG . 3.8 tpp180 -68.17 -46.27 71.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.037 179.129 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 32.5 m0 -57.33 -50.94 71.33 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.827 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.52 -41.77 83.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.892 -0.594 . . . . 10.0 111.858 -179.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.83 -41.03 96.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.82 0.343 . . . . 10.0 111.668 -179.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -68.75 -34.07 74.96 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.316 -0.402 . . . . 10.0 111.266 -179.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.9 m -94.01 2.9 55.98 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.316 -0.402 . . . . 10.0 111.802 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 67.2 t30 57.74 55.26 5.61 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.366 0.603 . . . . 10.0 110.4 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 19.5 mtm -129.59 173.13 10.89 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.034 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -98.72 155.12 17.49 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.553 -0.294 . . . . 10.0 110.264 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.0 tp -132.2 135.57 46.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.919 0.39 . . . . 10.0 110.997 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.601 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 1.1 m -122.74 96.78 5.16 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.523 179.183 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.504 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 27.7 t80 -88.16 98.88 11.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.745 -0.662 . . . . 10.0 109.534 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -107.72 33.45 4.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.779 0.323 . . . . 10.0 111.463 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.436 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 39.4 mt -88.06 150.28 47.13 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 110.322 -0.251 . . . . 10.0 110.322 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -63.14 -29.56 74.4 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.577 2.185 . . . . 10.0 112.262 179.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.1 m -152.36 166.28 32.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.412 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.504 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 0.6 OUTLIER -87.97 140.44 29.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.507 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -120.98 144.94 48.24 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.935 0.398 . . . . 10.0 111.231 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.73 161.13 20.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.242 179.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.09 117.81 4.39 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.138 0.495 . . . . 10.0 110.573 179.125 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.6 pt -61.68 -35.97 70.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.407 -0.815 . . . . 10.0 112.162 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 137.87 -69.01 0.5 Allowed Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.633 -0.794 . . . . 10.0 112.285 -179.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.27 -13.12 36.25 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.718 2.278 . . . . 10.0 112.389 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.36 -32.46 53.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.631 0.729 . . . . 10.0 110.196 178.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.68 -10.58 59.84 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.834 -1.075 . . . . 10.0 111.261 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -92.32 -1.19 57.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.059 0.456 . . . . 10.0 110.715 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 56.9 mt -98.24 113.36 32.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.567 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.488 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 1.6 m -140.66 96.72 3.07 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.753 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.7 t -127.02 155.72 42.78 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.698 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.46 -5.05 52.71 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.356 -0.383 . . . . 10.0 111.972 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 62.3 m -100.27 119.38 38.31 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.906 -0.405 . . . . 10.0 109.906 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.72 -49.29 78.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.136 -0.484 . . . . 10.0 111.913 -178.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -62.07 -33.52 74.56 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.776 -0.647 . . . . 10.0 111.403 -178.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -73.36 -39.76 64.91 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.96 -48.74 79.08 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.216 179.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.11 -43.53 98.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.575 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 84.6 m -62.6 -44.75 95.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.963 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -66.15 -39.55 89.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.707 179.667 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 15.2 mt -61.06 -53.59 55.25 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.954 -0.387 . . . . 10.0 109.954 178.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.7 m -57.6 -31.78 66.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.589 -179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.98 -39.12 91.1 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.192 0.52 . . . . 10.0 110.789 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 6.4 t -90.61 -29.86 4.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.833 -0.622 . . . . 10.0 111.553 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -82.17 -24.04 35.2 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.465 1.283 . . . . 10.0 114.465 -177.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.76 -38.42 33.81 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.291 0.478 . . . . 10.0 112.291 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.97 -18.93 65.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.058 0.456 . . . . 10.0 111.717 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -97.71 -4.2 37.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.978 0.418 . . . . 10.0 110.209 179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.91 27.4 34.51 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.956 -0.64 . . . . 10.0 112.272 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 67.6 t -124.61 136.06 61.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 120.814 0.34 . . . . 10.0 110.642 -179.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 29.4 m -140.39 123.18 16.38 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.935 0.397 . . . . 10.0 110.091 179.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 5.4 m -111.61 147.88 15.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.873 -179.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 19.1 m -150.65 155.93 40.35 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.133 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.438 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.4 t -112.17 115.75 50.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.126 -0.694 . . . . 10.0 109.126 179.629 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 14.5 m -136.55 117.92 14.67 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.146 -178.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 63.92 51.49 2.31 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.671 -0.695 . . . . 10.0 111.929 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 54.91 35.04 23.52 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.531 0.681 . . . . 10.0 110.813 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.601 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 75.6 tttt -140.54 133.37 29.05 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.485 -0.779 . . . . 10.0 109.827 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.438 ' CD2' HG22 ' A' ' 121' ' ' VAL . 94.0 mt -88.65 121.5 31.09 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 109.039 -0.726 . . . . 10.0 109.039 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.472 ' CD2' ' HB2' ' A' ' 80' ' ' SER . 13.2 mt -112.86 125.96 54.93 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.199 0.523 . . . . 10.0 110.809 -178.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 2.6 t -108.3 118.73 56.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 N-CA-C 108.222 -1.029 . . . . 10.0 108.222 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -127.98 138.09 32.19 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-O 120.841 0.353 . . . . 10.0 111.365 -178.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -81.62 133.24 8.15 Favored 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.133 1.888 . . . . 10.0 110.898 177.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 1.6 m -99.05 143.93 27.28 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.691 -179.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -79.65 71.19 7.17 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.803 2.335 . . . . 10.0 112.419 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 31.5 m -120.79 166.62 15.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 1.5 m -87.77 78.42 8.41 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.278 0.561 . . . . 10.0 110.382 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 2.9 m -77.55 -29.14 52.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.076 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -154.39 -139.71 2.88 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.716 -0.674 . . . . 10.0 111.439 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -96.31 -30.92 13.16 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.948 0.404 . . . . 10.0 110.416 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 8.7 tptp -121.45 177.36 5.23 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.045 -0.525 . . . . 10.0 109.703 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.6 -0.715 . . . . 10.0 110.088 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.598 0 N-CA-C 111.87 -0.492 . . . . 10.0 111.87 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -69.47 107.24 3.27 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.022 0.439 . . . . 10.0 110.677 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 -89.93 102.4 15.11 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.932 -179.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 43.7 mtt -138.86 143.74 38.91 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.944 -0.571 . . . . 10.0 109.654 179.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.23 -26.16 39.24 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.106 -179.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp 56.63 77.26 0.43 Allowed Pre-proline 0 C--O 1.234 0.249 0 CA-C-N 115.767 -0.652 . . . . 10.0 110.73 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.43 160.18 42.16 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.451 2.101 . . . . 10.0 112.206 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -118.06 148.65 43.99 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.942 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -64.08 139.26 66.11 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 122.482 2.121 . . . . 10.0 111.669 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -86.93 163.91 16.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.721 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -155.85 112.64 3.18 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.426 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -156.89 -143.35 3.64 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.724 -0.55 . . . . 10.0 111.724 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -78.95 65.65 3.51 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 121.037 -0.601 . . . . 10.0 112.804 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -88.2 -33.7 18.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.194 0.521 . . . . 10.0 110.176 179.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 48.2 m95 -92.06 -59.15 2.18 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.883 -0.598 . . . . 10.0 109.987 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.9 mttm 57.78 39.93 26.64 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.721 -0.672 . . . . 10.0 111.633 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 8.5 t60 -81.73 102.55 10.82 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.881 -0.414 . . . . 10.0 109.881 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -139.87 98.85 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.206 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -148.67 92.3 1.98 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.275 0.559 . . . . 10.0 110.515 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.7 m80 -101.86 131.74 48.04 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.124 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -88.78 -65.22 1.04 Allowed 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.368 -0.604 . . . . 10.0 109.368 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -155.65 164.86 38.06 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.347 -0.842 . . . . 10.0 109.237 178.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -127.76 72.13 1.39 Allowed 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.465 0.65 . . . . 10.0 110.93 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -155.58 121.17 2.57 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.056 -0.975 . . . . 10.0 109.824 179.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -59.93 -66.23 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.847 2.365 . . . . 10.0 112.382 -179.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.6 m -142.31 97.67 3.17 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.333 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -132.65 80.77 1.91 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.226 0.536 . . . . 10.0 110.186 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 pt -120.45 107.81 38.47 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.524 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -75.39 58.15 5.04 Favored 'Trans proline' 0 N--CA 1.464 -0.243 0 C-N-CA 123.008 2.472 . . . . 10.0 111.969 179.299 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.5 tp -132.86 124.97 28.93 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.195 -179.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -104.41 150.07 24.85 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.624 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.58 109.15 0.65 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.837 0.351 . . . . 10.0 111.417 -179.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 4.6 m -127.82 96.25 4.45 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.182 0.515 . . . . 10.0 110.145 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -66.91 127.1 31.23 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.129 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.4 m -82.92 113.1 20.29 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.577 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.433 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 95.1 m-85 -83.29 107.54 15.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.525 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -147.6 174.07 12.11 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.818 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -100.91 127.55 47.33 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.381 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.6 p -109.71 153.9 42.74 Favored Pre-proline 0 C--N 1.323 -0.587 0 N-CA-C 109.872 -0.418 . . . . 10.0 109.872 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -66.85 -9.52 25.04 Favored 'Trans proline' 0 CA--C 1.529 0.264 0 C-N-CA 122.333 2.022 . . . . 10.0 111.626 179.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 61.8 mtm -84.6 -19.89 32.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.492 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -73.11 -57.9 3.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.151 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.05 -57.82 4.59 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.838 -0.696 . . . . 10.0 113.167 179.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.407 HG21 ' OD2' ' A' ' 86' ' ' ASP . 65.5 p -119.24 164.54 15.47 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.485 0.55 . . . . 10.0 112.485 -178.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 27.3 tp -61.35 -45.14 95.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.282 -0.872 . . . . 10.0 111.386 179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.1 ttpt -59.17 -50.34 74.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.828 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.581 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 51.8 m -60.74 -43.45 97.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.948 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 57.0 ttp -60.72 -50.82 71.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.612 179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 83.2 mt -63.55 -35.23 79.81 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.875 179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -60.87 -43.37 98.51 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.624 -0.51 . . . . 10.0 109.624 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.581 ' HG2' ' O ' ' A' ' 66' ' ' THR . 31.6 mmt180 -64.93 -46.06 83.2 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.643 -0.708 . . . . 10.0 109.643 178.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 38.9 m0 -55.23 -50.54 69.15 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.469 -0.787 . . . . 10.0 110.793 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.404 ' HA ' ' HB2' ' A' ' 77' ' ' MET . . . -66.0 -52.14 52.04 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.338 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.93 -43.61 77.55 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.253 0.464 . . . . 10.0 112.253 -178.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -58.21 -35.83 72.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.909 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.1 m -105.38 18.75 21.75 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.24 0.459 . . . . 10.0 112.24 -178.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 65.4 t30 57.91 35.54 25.44 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.636 0.732 . . . . 10.0 111.209 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.404 ' HB2' ' HA ' ' A' ' 72' ' ' ALA . 72.6 mtp -103.19 173.88 6.11 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.839 -0.618 . . . . 10.0 110.035 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 70.7 mm-40 -114.02 157.91 21.88 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.819 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 43.6 tp -124.99 131.51 53.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.195 0.522 . . . . 10.0 110.958 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -115.59 96.37 5.6 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.562 -0.745 . . . . 10.0 109.251 178.644 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.54 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 6.6 t80 -91.45 98.57 11.77 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.097 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.455 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 42.2 m-80 -94.94 11.96 29.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.901 -179.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.499 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 45.2 mt -84.12 147.61 51.24 Favored Pre-proline 0 C--N 1.324 -0.523 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.29 -41.86 68.63 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.662 2.241 . . . . 10.0 112.634 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 2.1 m -147.11 170.49 17.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.096 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.54 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 7.0 p-10 -80.82 148.06 30.16 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -123.72 143.24 50.4 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.838 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.28 152.32 36.5 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.524 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.75 136.31 57.7 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.735 0.302 . . . . 10.0 110.245 178.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.5 pt -81.48 -27.62 10.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.534 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 138.37 -62.49 0.57 Allowed Glycine 0 CA--C 1.523 0.536 0 C-N-CA 120.217 -0.992 . . . . 10.0 113.282 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -58.61 -15.75 27.03 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 123.02 2.48 . . . . 10.0 113.098 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t -61.81 -36.64 74.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.922 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 1.1 m -71.66 -14.71 62.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.87 -0.604 . . . . 10.0 111.723 -179.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -88.3 -1.31 57.95 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.052 0.453 . . . . 10.0 110.523 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 56.9 mt -101.65 111.77 32.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.771 -0.649 . . . . 10.0 109.371 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.0 m -139.99 97.16 3.19 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.112 0.482 . . . . 10.0 110.564 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.1 t -130.76 157.67 42.2 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.692 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.42 -18.29 30.31 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.462 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.03 113.31 25.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.619 -0.718 . . . . 10.0 110.275 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.433 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 9.8 p -61.14 -31.68 50.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.565 0.221 . . . . 10.0 111.269 -179.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -65.93 -41.1 91.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.945 0.402 . . . . 10.0 110.028 179.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -66.99 -41.96 85.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.923 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.05 -50.37 72.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.61 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.23 -36.44 79.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.582 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 63.0 m -64.18 -45.76 86.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.852 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -69.78 -39.19 76.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.862 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' ' 112' ' ' TYR . 1.7 mp -63.34 -50.29 70.57 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.839 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.5 ' O ' ' HB3' ' A' ' 113' ' ' ALA . 11.2 p -62.73 -21.72 66.01 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.696 0.258 . . . . 10.0 111.696 -179.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.51 -48.03 51.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.891 0.376 . . . . 10.0 110.893 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.8 p -82.55 -28.48 8.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-O 121.421 0.629 . . . . 10.0 111.186 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.445 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.1 m-85 -81.28 -22.86 38.33 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.658 -0.701 . . . . 10.0 112.798 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.5 ' HB3' ' O ' ' A' ' 109' ' ' SER . . . -49.65 -42.64 45.77 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 112.342 0.497 . . . . 10.0 112.342 -179.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.96 -20.01 63.33 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.876 0.37 . . . . 10.0 111.377 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -87.81 -13.31 42.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.187 0.518 . . . . 10.0 109.955 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 95.61 24.93 14.5 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 115.717 -0.674 . . . . 10.0 112.48 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.445 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 96.5 t -128.27 130.9 69.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.052 0.453 . . . . 10.0 111.378 -179.184 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.6 m -127.54 111.61 13.98 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.236 -0.438 . . . . 10.0 109.979 178.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 3.3 m -102.57 142.39 16.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.077 0.465 . . . . 10.0 111.088 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 15.3 m -150.38 165.53 32.82 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.813 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 3.4 t -119.64 117.31 53.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 179.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 13.8 m -134.6 118.71 17.53 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.639 -0.255 . . . . 10.0 110.659 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 65.05 43.75 3.63 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 123.732 0.645 . . . . 10.0 111.147 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 4.6 t30 59.37 29.67 19.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.116 -0.947 . . . . 10.0 110.619 -179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -129.77 133.78 47.2 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.29 -0.868 . . . . 10.0 109.056 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 96.0 mt -87.97 122.01 31.06 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.727 -0.842 . . . . 10.0 108.727 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -113.3 116.0 29.04 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-O 121.207 0.527 . . . . 10.0 111.322 -178.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.455 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 3.2 t -99.33 117.63 44.73 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.077 0 N-CA-C 107.869 -1.159 . . . . 10.0 107.869 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -128.28 131.56 23.85 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-O 120.983 0.42 . . . . 10.0 111.096 -178.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -73.77 136.97 24.0 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.365 2.043 . . . . 10.0 110.78 178.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -107.06 142.45 25.05 Favored Pre-proline 0 C--N 1.316 -0.879 0 C-N-CA 120.827 -0.349 . . . . 10.0 110.202 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -81.34 76.9 4.19 Favored 'Trans proline' 0 N--CA 1.453 -0.878 0 C-N-CA 122.66 2.24 . . . . 10.0 111.256 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 4.4 m -102.52 22.73 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.276 -0.875 . . . . 10.0 111.108 -178.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 19.3 m -116.85 105.74 12.69 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.241 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.4 m -79.76 72.0 6.44 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.748 -0.66 . . . . 10.0 111.061 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 133.97 -138.95 10.47 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.92 -0.657 . . . . 10.0 111.604 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -94.34 169.06 10.49 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.634 0.255 . . . . 10.0 110.425 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 48.0 pttt -75.8 157.75 33.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.553 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 38.2 tp . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.35 -0.833 . . . . 10.0 109.28 179.08 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.807 0 N-CA-C 112.04 -0.424 . . . . 10.0 112.04 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.9 m -84.21 111.98 19.86 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.999 0.428 . . . . 10.0 111.1 -179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 3.5 m170 -101.78 119.14 38.31 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.284 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -62.85 125.69 24.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.554 -179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.2 t -85.13 134.33 34.18 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.121 0.486 . . . . 10.0 110.117 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -118.16 149.1 45.05 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.711 -179.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -75.74 61.93 6.34 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.735 2.29 . . . . 10.0 112.09 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.26 148.12 34.13 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.32 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.37 145.43 65.41 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.52 2.147 . . . . 10.0 111.615 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -87.7 59.09 5.24 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.085 0.469 . . . . 10.0 111.079 -179.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 61.12 49.37 5.64 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.429 179.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -65.51 114.77 6.96 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.848 -0.615 . . . . 10.0 113.023 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 90.98 9.19 64.11 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.962 -0.637 . . . . 10.0 112.494 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 50.8 mtp180 -106.56 -2.57 21.73 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 122.655 -0.32 . . . . 10.0 111.141 -179.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 59.6 m95 -106.33 11.51 30.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.251 0.548 . . . . 10.0 110.922 -179.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -97.79 25.18 6.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.747 -0.66 . . . . 10.0 110.289 179.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -78.25 87.87 4.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.608 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 7.0 m -138.27 144.25 30.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.487 179.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -146.56 135.01 21.97 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 110.169 -0.308 . . . . 10.0 110.169 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -127.09 28.09 5.82 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.971 0.415 . . . . 10.0 110.792 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -105.38 60.08 0.67 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.006 0.431 . . . . 10.0 110.328 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -60.7 142.57 55.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.606 -0.724 . . . . 10.0 111.221 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -108.32 153.64 22.96 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.851 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -95.8 138.78 21.7 Favored Pre-proline 0 C--N 1.317 -0.824 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.598 179.236 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -49.97 -52.66 8.46 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.689 2.259 . . . . 10.0 111.87 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.1 m -149.16 94.66 2.27 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.203 179.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -72.38 130.3 40.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.148 0.499 . . . . 10.0 110.625 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 11.5 pt -140.6 147.81 50.57 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 115.55 -0.75 . . . . 10.0 110.059 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -68.18 166.18 25.98 Favored 'Trans proline' 0 C--O 1.236 0.424 0 C-N-CA 122.313 2.009 . . . . 10.0 111.16 179.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 25.0 tp -87.74 65.03 8.26 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.375 0.607 . . . . 10.0 109.918 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -76.74 119.67 20.85 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.423 -0.808 . . . . 10.0 108.943 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.74 110.02 0.53 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.14 0.495 . . . . 10.0 111.58 -179.16 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.7 m -142.27 90.97 2.29 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.84 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -64.6 126.4 27.76 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.142 0.496 . . . . 10.0 111.074 -179.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.2 m -86.96 122.87 31.41 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.78 -0.646 . . . . 10.0 110.395 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -89.5 119.84 30.29 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.465 ' HG3' ' OG ' ' A' ' 97' ' ' SER . 1.9 tt0 -152.58 144.56 23.74 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.671 -178.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.618 ' HB3' ' SD ' ' A' ' 67' ' ' MET . . . -78.16 128.05 33.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.002 178.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.443 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 82.5 p -113.71 159.64 34.92 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 116.571 -0.286 . . . . 10.0 110.576 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.443 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 47.1 Cg_endo -69.53 -3.31 11.61 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.459 2.106 . . . . 10.0 112.122 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 45.2 mtt -88.24 -25.14 23.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.362 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -72.22 -58.61 3.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.054 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 86.95 -57.21 4.63 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.77 -0.729 . . . . 10.0 112.895 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.63 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 65.3 p -121.52 172.57 7.98 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.426 0.528 . . . . 10.0 112.426 -179.366 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 25.7 tp -64.19 -48.62 75.22 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.114 -0.948 . . . . 10.0 111.752 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -58.79 -43.99 90.62 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.012 0.434 . . . . 10.0 110.472 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.8 m -66.51 -39.78 88.84 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.485 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.618 ' SD ' ' HB3' ' A' ' 57' ' ' ALA . 54.7 ttp -66.87 -50.14 63.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.044 0.45 . . . . 10.0 111.055 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 75.1 mt -62.17 -37.71 86.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.276 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -60.49 -41.34 94.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.284 179.07 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -65.78 -47.63 74.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.285 179.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 43.5 m0 -58.19 -51.94 67.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.574 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.69 -42.48 99.65 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.784 -0.643 . . . . 10.0 111.515 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.4 -44.77 95.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.727 0.298 . . . . 10.0 111.755 -179.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.15 -40.27 95.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.372 -0.376 . . . . 10.0 111.417 -179.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.9 m -94.0 6.96 46.83 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.897 -178.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 46.9 t30 55.85 49.25 16.43 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.239 0.542 . . . . 10.0 111.272 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.451 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 10.8 mtm -114.68 174.0 6.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.756 -179.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 26.6 mp0 -102.15 163.1 12.42 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.68 -179.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 45.9 tp -130.88 138.82 49.99 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.179 0.514 . . . . 10.0 111.134 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -124.54 96.23 4.82 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.432 -0.804 . . . . 10.0 109.142 178.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.48 ' CZ ' HD11 ' A' ' 83' ' ' LEU . 4.7 t80 -92.31 98.34 11.44 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.427 -0.583 . . . . 10.0 109.427 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . 0.413 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 15.0 m120 -96.89 24.03 6.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.122 0.487 . . . . 10.0 110.589 -179.316 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.48 HD11 ' CZ ' ' A' ' 81' ' ' TYR . 44.4 mt -93.51 142.48 25.24 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.425 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.84 -29.84 58.59 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.898 2.399 . . . . 10.0 112.327 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.2 m -147.46 153.26 39.34 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.587 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.479 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 34.3 t0 -80.68 125.12 29.64 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -100.47 149.8 23.31 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.643 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.63 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 2.0 t -92.84 151.95 19.7 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.7 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -50.59 121.67 6.11 Favored 'General case' 0 C--N 1.337 0.042 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.868 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.0 pt -67.01 -29.57 46.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.562 . . . . 10.0 111.935 -179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 141.72 -68.45 0.46 Allowed Glycine 0 CA--C 1.52 0.344 0 C-N-CA 120.375 -0.916 . . . . 10.0 113.2 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.17 -7.28 3.58 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.639 2.893 . . . . 10.0 113.868 -179.033 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 5.8 t -68.07 -32.79 57.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.239 0.542 . . . . 10.0 110.452 179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 1.5 m -72.62 -13.73 61.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.938 -0.573 . . . . 10.0 111.436 -179.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -89.5 -0.1 57.26 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.044 0.449 . . . . 10.0 110.562 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 51.6 mt -97.95 111.0 26.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.584 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.465 ' OG ' ' HG3' ' A' ' 56' ' ' GLN . 2.8 m -134.08 98.78 4.23 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.697 -179.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 12.8 t -129.76 155.69 45.52 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.442 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -90.24 -9.47 47.89 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.798 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.4 t -104.29 123.76 47.95 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.662 0.267 . . . . 10.0 110.908 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 13.1 p -65.99 -29.7 47.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-O 121.123 0.487 . . . . 10.0 110.104 179.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -69.93 -41.45 74.58 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.733 179.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -68.7 -39.43 80.5 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.83 -48.8 77.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.658 179.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.46 -35.38 80.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.324 0.583 . . . . 10.0 110.473 179.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 92.8 m -67.34 -47.5 70.28 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.46 -0.791 . . . . 10.0 110.802 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -69.6 -40.89 76.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.881 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 2.5 mp -59.04 -48.28 82.17 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.773 179.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 59.2 m -59.55 -31.91 69.86 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 111.86 0.318 . . . . 10.0 111.86 -179.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.4 -37.42 83.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.375 0.607 . . . . 10.0 110.833 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 2.7 t -87.47 -42.74 15.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.521 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.458 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 13.2 m-30 -64.83 -26.63 68.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.166 -0.925 . . . . 10.0 112.504 -178.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -55.37 -31.42 61.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.774 0.321 . . . . 10.0 111.389 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.74 -11.54 59.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.91 0.386 . . . . 10.0 111.198 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 -109.96 -0.28 18.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.566 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 82.36 28.13 41.26 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.95 -0.643 . . . . 10.0 112.855 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.458 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 74.1 t -127.54 143.86 39.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.952 0.406 . . . . 10.0 110.338 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.9 m -142.47 138.83 31.28 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 178.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 9.9 m -126.32 143.24 40.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.407 0.623 . . . . 10.0 111.782 -178.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.2 m -150.84 139.85 21.02 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.429 178.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 2.3 p -102.48 121.0 53.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.3 m -139.91 124.51 18.2 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.767 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.4 48.62 7.63 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 123.537 0.523 . . . . 10.0 111.476 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.451 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 23.6 m120 57.69 33.01 22.7 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.783 -0.644 . . . . 10.0 111.498 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -137.19 129.9 30.24 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.6 -0.519 . . . . 10.0 109.6 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 37.3 mt -87.54 120.73 29.14 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 107.8 -1.185 . . . . 10.0 107.8 178.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.71 118.97 37.93 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.103 0.478 . . . . 10.0 111.591 -178.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 3.0 t -104.44 118.36 51.57 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.957 0 N-CA-C 108.187 -1.042 . . . . 10.0 108.187 178.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -131.01 131.25 23.09 Favored Pre-proline 0 C--N 1.317 -0.827 0 CA-C-O 120.741 0.305 . . . . 10.0 110.96 -178.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -72.14 134.38 23.03 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.467 2.111 . . . . 10.0 111.058 179.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . 0.407 ' HA ' ' HD3' ' A' ' 132' ' ' PRO . 0.9 OUTLIER -97.71 144.7 28.45 Favored Pre-proline 0 C--N 1.315 -0.912 0 N-CA-C 109.892 -0.41 . . . . 10.0 109.892 179.368 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 131' ' ' VAL . 2.9 Cg_exo -73.1 85.75 1.18 Allowed 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.783 2.322 . . . . 10.0 111.651 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 16.5 m -128.26 125.81 64.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.82 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 65.7 m -159.13 55.0 0.41 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.599 0.714 . . . . 10.0 109.41 179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.5 m -76.18 119.22 19.79 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.227 -0.897 . . . . 10.0 110.564 -179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -113.55 28.87 8.26 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.663 -0.78 . . . . 10.0 112.657 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -86.31 -37.66 18.29 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.959 0.409 . . . . 10.0 110.531 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -132.08 98.58 4.46 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.898 179.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 2.6 mm? . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.254 -0.879 . . . . 10.0 110.138 -179.763 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.632 0 N-CA-C 111.63 -0.588 . . . . 10.0 111.63 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 14.7 m -76.43 71.64 3.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.186 0.517 . . . . 10.0 110.525 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 25.2 p80 -65.23 133.46 51.53 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.804 -0.634 . . . . 10.0 110.352 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 64.5 mtt -120.36 142.71 48.91 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.052 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -63.17 105.77 0.76 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.909 0.385 . . . . 10.0 111.361 -179.487 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -121.29 141.16 32.56 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.244 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -69.63 135.22 30.21 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.146 1.897 . . . . 10.0 111.416 179.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -71.35 154.62 93.53 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.63 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.72 149.72 57.73 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 122.55 2.167 . . . . 10.0 111.788 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.5 175.66 6.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.962 -179.242 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -164.08 150.06 11.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.006 -179.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 88.4 23.25 37.62 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.671 -0.776 . . . . 10.0 111.682 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -133.92 25.6 3.52 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 111.321 -0.712 . . . . 10.0 111.321 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 42.4 ttt180 -78.51 -33.15 48.24 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.938 0.399 . . . . 10.0 110.105 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 33.8 m95 -78.48 77.09 4.97 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.796 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -128.87 31.3 4.95 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.654 -0.703 . . . . 10.0 109.71 179.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -72.4 97.34 2.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.905 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 15.8 m -125.49 -5.65 5.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.479 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -127.1 114.66 18.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.998 0.428 . . . . 10.0 110.62 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -74.48 -70.06 0.42 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.113 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -164.33 143.88 7.61 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.103 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -101.66 94.42 5.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.171 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -152.49 -171.21 3.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.326 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.87 149.7 42.4 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.407 -0.361 . . . . 10.0 110.588 179.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -57.12 -61.26 0.32 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.651 2.234 . . . . 10.0 111.879 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.7 m -150.9 79.66 1.32 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.13 0.491 . . . . 10.0 110.52 179.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -83.75 103.24 12.88 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.508 179.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 20.9 pt -133.73 139.58 34.0 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.813 -0.631 . . . . 10.0 110.434 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.77 136.92 43.71 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.508 2.139 . . . . 10.0 111.261 179.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.8 107.82 13.2 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.093 0.473 . . . . 10.0 109.896 -179.427 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -133.04 116.35 16.27 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.408 -0.815 . . . . 10.0 109.714 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.44 120.8 12.36 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.504 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 13.5 m -144.53 88.78 1.95 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.134 0.492 . . . . 10.0 110.537 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -80.27 121.45 25.65 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.45 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.6 m -73.92 115.6 13.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.077 0.465 . . . . 10.0 110.358 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.409 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 91.4 m-85 -84.19 105.27 14.92 Favored 'General case' 0 C--N 1.313 -1.022 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -141.05 147.27 38.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.314 -179.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.537 ' HB1' ' SD ' ' A' ' 67' ' ' MET . . . -75.52 117.3 17.16 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.398 -0.593 . . . . 10.0 109.398 178.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 61.8 p -101.67 152.49 38.09 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 116.307 -0.406 . . . . 10.0 111.094 -178.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -64.98 -13.86 42.03 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.655 2.237 . . . . 10.0 112.416 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.5 ptp -86.78 -6.27 58.87 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.93 0.395 . . . . 10.0 110.447 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -84.14 -58.49 2.74 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 179.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 86.19 -60.24 4.6 Favored Glycine 0 N--CA 1.445 -0.754 0 CA-C-N 115.649 -0.705 . . . . 10.0 113.319 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 31.9 p -116.48 166.5 12.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.551 0.691 . . . . 10.0 112.705 -178.329 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.93 -46.25 82.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.368 -1.287 . . . . 10.0 111.392 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 29.9 ttmt -58.27 -56.7 18.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.922 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.1 m -56.49 -42.66 78.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.0 -0.546 . . . . 10.0 111.804 -179.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.537 ' SD ' ' HB1' ' A' ' 57' ' ' ALA . 50.2 ttp -59.77 -54.09 50.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.826 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.5 mt -64.81 -36.22 83.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.16 -0.473 . . . . 10.0 111.109 -179.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -60.18 -45.34 93.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.775 0.321 . . . . 10.0 110.323 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -66.3 -38.87 88.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.634 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 39.2 m0 -62.57 -53.74 50.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.325 0.583 . . . . 10.0 109.938 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.36 -39.88 92.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.225 -0.898 . . . . 10.0 111.637 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.69 -39.86 81.94 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.295 0.48 . . . . 10.0 112.295 -179.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -66.11 -36.16 82.43 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.87 0.322 . . . . 10.0 111.87 -178.792 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.401 ' HB2' ' SD ' ' A' ' 77' ' ' MET . 19.7 m -103.01 13.48 34.2 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 111.807 0.299 . . . . 10.0 111.807 -179.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 54.67 43.33 30.33 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.414 0.626 . . . . 10.0 111.29 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.462 ' HE2' ' CD2' ' A' ' 126' ' ' LEU . 64.2 mtp -102.97 160.49 14.57 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.205 -179.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -97.41 154.29 17.56 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 36.7 tp -122.01 133.89 54.81 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.483 0.659 . . . . 10.0 111.438 -179.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.427 ' CB ' HD12 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -114.76 95.39 5.21 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.145 -0.934 . . . . 10.0 109.03 179.04 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.494 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 9.8 t80 -99.94 95.79 7.12 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.987 0.422 . . . . 10.0 109.993 -179.427 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 20.8 m-20 -98.83 10.7 40.73 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.752 -179.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.494 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 40.4 mt -71.0 142.55 87.81 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.13 179.495 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.36 -39.23 92.63 Favored 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.842 2.361 . . . . 10.0 112.349 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 37.9 m -148.07 171.92 15.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.675 0.274 . . . . 10.0 110.585 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -82.32 135.57 35.18 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -113.17 128.62 56.53 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.999 -0.281 . . . . 10.0 110.279 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.418 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.0 OUTLIER -70.51 148.26 48.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.243 179.614 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.36 109.18 0.72 Allowed 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.4 pt -55.94 -37.05 46.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.417 -0.81 . . . . 10.0 112.503 -178.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 151.95 -70.62 0.3 Allowed Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.193 -1.003 . . . . 10.0 112.995 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -55.31 -16.88 14.36 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.544 2.829 . . . . 10.0 113.422 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 21.4 t -59.94 -35.57 61.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.905 179.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -71.4 -8.71 55.55 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.25 0.463 . . . . 10.0 112.25 -179.106 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.15 -1.98 57.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.885 0.374 . . . . 10.0 111.208 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 36.9 mt -93.78 107.05 18.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 109.695 -0.483 . . . . 10.0 109.695 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -133.97 91.54 2.83 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.141 0.496 . . . . 10.0 111.792 -179.257 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.6 t -130.33 155.2 46.73 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.117 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.3 p -87.33 -18.26 30.52 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 121.003 0.43 . . . . 10.0 110.522 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.5 m -88.72 108.53 19.53 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.648 179.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.409 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 11.3 p -57.36 -33.52 43.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.632 -178.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -67.72 -39.7 84.31 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -66.61 -42.89 86.13 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.29 -50.6 66.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.344 -0.844 . . . . 10.0 110.338 178.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.45 -35.94 79.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.996 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 48.0 m -64.53 -45.11 88.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.578 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -72.07 -38.07 69.49 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.597 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 62.8 mt -60.14 -50.72 72.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.666 179.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 72.2 m -58.34 -28.87 65.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.305 -0.407 . . . . 10.0 112.054 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.42 -37.24 82.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.19 0.519 . . . . 10.0 110.545 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 11.0 t -86.06 -41.01 14.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 121.424 0.63 . . . . 10.0 110.324 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.505 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 14.2 m-30 -66.56 -26.88 67.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.857 -1.065 . . . . 10.0 113.11 -178.371 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.91 -31.21 64.67 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.787 0.292 . . . . 10.0 111.787 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.22 -14.5 60.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.853 0.359 . . . . 10.0 111.232 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -107.83 -10.65 15.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.242 -0.436 . . . . 10.0 111.088 -179.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 95.2 31.79 7.41 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.645 -0.788 . . . . 10.0 113.155 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.505 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 69.1 t -131.1 142.43 43.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.871 0.367 . . . . 10.0 110.993 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -135.46 138.02 42.77 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 178.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.453 ' HA ' ' O ' ' A' ' 127' ' ' LEU . 14.4 m -130.99 143.72 40.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.143 0.496 . . . . 10.0 111.157 -179.429 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 19.9 m -152.64 153.38 33.21 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.865 179.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.489 HG22 ' CD1' ' A' ' 126' ' ' LEU . 5.7 t -106.1 118.16 53.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 68.7 m -140.43 118.46 11.89 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.561 -0.291 . . . . 10.0 111.05 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.88 51.06 4.86 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.607 -0.724 . . . . 10.0 112.021 179.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.7 t30 58.49 28.08 16.44 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.262 179.069 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -136.2 135.68 39.32 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.321 -0.4 . . . . 10.0 110.301 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.489 ' CD1' HG22 ' A' ' 121' ' ' VAL . 2.5 mm? -88.84 121.71 31.48 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.916 -0.772 . . . . 10.0 108.916 178.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.453 ' O ' ' HA ' ' A' ' 119' ' ' VAL . 4.6 mm? -102.19 115.74 31.19 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.946 0.403 . . . . 10.0 110.412 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 2.7 t -112.02 118.38 57.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 N-CA-C 108.501 -0.926 . . . . 10.0 108.501 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -136.2 144.68 48.98 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-O 120.814 0.34 . . . . 10.0 111.114 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -75.8 141.63 24.63 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.254 1.969 . . . . 10.0 111.213 178.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 7.6 m -113.8 144.47 31.53 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.504 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.36 93.58 1.08 Allowed 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.83 2.353 . . . . 10.0 112.161 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 4.2 m -133.04 170.94 19.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.553 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 2.6 p -160.22 134.78 7.56 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.198 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.3 m -115.15 21.14 14.45 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.3 0.572 . . . . 10.0 110.041 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 114.63 155.11 11.03 Favored Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 115.493 -0.776 . . . . 10.0 111.415 -179.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -111.8 127.75 55.9 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.77 0.319 . . . . 10.0 110.455 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mttp -87.25 71.31 10.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.062 0.458 . . . . 10.0 110.664 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 29.5 mt . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.511 -0.757 . . . . 10.0 110.254 -179.606 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.516 0 N-CA-C 111.684 -0.566 . . . . 10.0 111.684 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.62 -32.48 73.23 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.991 0.424 . . . . 10.0 110.824 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -160.12 96.95 1.23 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.226 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 59.9 mtt -126.92 72.5 1.36 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.25 0.548 . . . . 10.0 110.474 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.426 ' O ' ' HD3' ' A' ' 26' ' ' PRO . 0.7 OUTLIER -90.11 169.35 11.24 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.674 179.924 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -92.18 107.62 24.53 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 179.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.426 ' HD3' ' O ' ' A' ' 24' ' ' THR . 71.6 Cg_endo -83.59 80.91 2.37 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.671 2.248 . . . . 10.0 112.362 -179.551 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -101.47 133.27 20.96 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.893 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_exo -61.9 128.59 24.74 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.612 2.208 . . . . 10.0 111.341 179.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -70.11 156.92 38.51 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.135 0.493 . . . . 10.0 111.352 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -88.57 122.48 32.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.783 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 114.7 -1.61 23.23 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 111.46 -0.656 . . . . 10.0 111.46 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -79.79 100.02 1.81 Allowed Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 121.192 -0.528 . . . . 10.0 112.559 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 7.0 ttp180 -99.89 -167.51 1.47 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.232 -0.655 . . . . 10.0 109.232 179.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 56.2 m95 63.91 27.43 14.42 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.933 0.397 . . . . 10.0 110.952 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -81.89 -34.35 30.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.184 0.516 . . . . 10.0 109.989 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -90.73 91.64 8.47 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 178.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 m -136.19 108.74 8.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.184 0.516 . . . . 10.0 111.668 -179.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -152.35 98.82 2.44 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.804 -0.634 . . . . 10.0 110.134 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 5.8 t-160 -86.7 75.44 9.66 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.874 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 53.8 p90 -87.31 -27.61 22.76 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.589 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -91.34 87.94 6.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.34 0.591 . . . . 10.0 110.376 -179.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -114.97 -62.54 1.59 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.761 -0.654 . . . . 10.0 109.843 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -158.43 144.29 12.4 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.193 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -61.76 -42.15 33.75 Favored 'Trans proline' 0 CA--C 1.53 0.306 0 C-N-CA 122.382 2.055 . . . . 10.0 112.46 -179.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 8.7 m -154.18 87.82 1.21 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.151 0.501 . . . . 10.0 110.982 179.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -102.58 73.06 1.28 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.252 0.548 . . . . 10.0 110.712 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.8 pt -140.6 147.02 47.31 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.872 -0.604 . . . . 10.0 109.848 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.34 84.43 1.37 Allowed 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.269 1.98 . . . . 10.0 111.758 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -101.65 100.1 10.45 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.489 -0.778 . . . . 10.0 109.876 -179.422 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -103.71 104.24 14.25 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.694 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.19 110.96 2.37 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.108 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -125.76 99.16 5.85 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.899 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -69.24 132.02 45.81 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.703 -0.681 . . . . 10.0 111.038 -179.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.6 m -95.46 120.87 36.46 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.593 -0.731 . . . . 10.0 110.642 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.437 ' CE2' HG22 ' A' ' 101' ' ' VAL . 36.7 m-85 -82.11 112.29 19.02 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.314 -0.624 . . . . 10.0 109.314 179.209 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -153.05 160.33 42.95 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.188 -179.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -76.23 137.63 40.09 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.736 -0.468 . . . . 10.0 109.736 179.037 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.406 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 40.0 p -121.9 163.19 32.86 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.426 -178.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.406 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 71.7 Cg_endo -79.64 10.39 3.1 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 121.443 1.429 . . . . 10.0 112.15 179.013 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 22.1 mmt -112.62 -12.77 13.38 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 113.518 0.933 . . . . 10.0 113.518 -178.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.47 -66.17 0.66 Allowed 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.336 -0.546 . . . . 10.0 110.54 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.92 -63.73 0.27 Allowed Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 120.995 -0.621 . . . . 10.0 111.734 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 82.1 p -128.93 175.63 8.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.729 0.299 . . . . 10.0 110.893 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 50.7 tp -57.95 -41.96 83.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.526 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -60.0 -51.11 71.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.775 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.01 -41.34 97.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.308 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 41.1 ttp -61.41 -50.87 71.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.761 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 93.6 mt -63.77 -41.34 97.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.784 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -60.06 -41.59 92.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.531 179.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 11.6 ttm180 -65.67 -44.62 85.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.465 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 44.9 m0 -58.69 -48.25 81.75 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.458 0.647 . . . . 10.0 110.093 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.93 -46.13 79.32 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.105 -0.952 . . . . 10.0 111.416 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -56.88 -45.32 82.63 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.359 0.503 . . . . 10.0 112.359 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -64.08 -32.1 73.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.147 0.498 . . . . 10.0 110.811 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.9 m -98.41 12.0 36.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.932 -0.577 . . . . 10.0 111.925 -178.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 56.06 43.41 27.06 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.363 0.601 . . . . 10.0 111.204 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 72.2 mtp -117.05 173.85 6.43 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.721 -179.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -114.45 166.82 11.29 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.558 -179.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.1 tp -136.62 138.65 41.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.961 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.487 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 35.5 m -121.4 96.93 5.28 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.378 -0.828 . . . . 10.0 110.475 179.471 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.487 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 8.0 t80 -89.67 108.17 19.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.033 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -103.84 12.84 33.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.971 0.415 . . . . 10.0 111.578 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.456 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 35.0 mt -87.09 144.97 37.15 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.796 -0.446 . . . . 10.0 109.796 179.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -57.69 -46.71 25.09 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.876 2.384 . . . . 10.0 112.845 -179.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.0 m -133.65 161.41 34.72 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.474 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.487 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 2.3 p30 -78.08 147.83 34.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.152 -0.476 . . . . 10.0 109.924 179.239 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -120.02 139.38 52.59 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.142 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.57 153.58 31.08 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.429 ' H ' HD21 ' A' ' 89' ' ' LEU . 0.5 OUTLIER -60.33 122.38 14.38 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 179.239 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.7 pt -62.7 -29.8 47.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 113.086 0.773 . . . . 10.0 113.086 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 144.85 -64.77 0.46 Allowed Glycine 0 CA--C 1.517 0.164 0 C-N-CA 120.054 -1.07 . . . . 10.0 112.749 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -65.36 0.91 2.39 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.748 2.298 . . . . 10.0 112.847 179.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.8 t -67.8 -42.75 86.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.049 0.452 . . . . 10.0 110.365 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.59 -15.08 60.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.321 179.096 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -80.31 -7.27 58.97 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.924 0.392 . . . . 10.0 110.573 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 29.8 mt -96.37 110.85 25.37 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 116.051 -0.522 . . . . 10.0 109.879 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 11.0 m -139.73 95.54 2.93 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.447 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.0 t -131.45 155.97 46.44 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.827 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -88.9 -14.44 36.78 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.086 0.47 . . . . 10.0 110.965 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.3 m -92.84 124.74 37.05 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.513 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.437 HG22 ' CE2' ' A' ' 55' ' ' TYR . 1.2 t -62.22 -46.33 96.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.12 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -60.86 -32.87 72.28 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.467 -0.788 . . . . 10.0 110.907 -179.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -71.97 -41.04 68.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.229 -0.441 . . . . 10.0 109.884 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.34 -50.17 75.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.698 -0.683 . . . . 10.0 110.664 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.77 -37.54 87.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.159 0.504 . . . . 10.0 110.694 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 37.4 m -63.76 -49.19 73.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.806 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.34 -40.37 93.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.492 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 47.7 mt -60.57 -51.09 70.89 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.331 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.4 m -58.5 -33.25 69.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.354 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.32 -40.19 93.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.939 0.4 . . . . 10.0 111.048 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.9 t -87.78 -39.76 13.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.359 0.6 . . . . 10.0 111.105 -179.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.483 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 12.7 m-30 -66.58 -24.64 66.37 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.36 -0.836 . . . . 10.0 112.711 -178.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.416 ' O ' HG23 ' A' ' 133' ' ' VAL . . . -51.43 -37.43 48.5 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.889 0.329 . . . . 10.0 111.889 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.66 -9.48 54.4 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.807 0.337 . . . . 10.0 111.592 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -112.35 2.33 16.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.864 0.364 . . . . 10.0 110.188 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 77.92 26.36 60.51 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 115.841 -0.618 . . . . 10.0 113.049 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.483 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 96.3 t -121.85 140.46 45.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.607 0.242 . . . . 10.0 110.734 -179.458 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.4 t -139.21 140.72 37.84 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.563 -0.532 . . . . 10.0 109.563 179.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 9.8 m -131.19 139.81 50.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.897 0.379 . . . . 10.0 110.657 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.1 m -142.89 156.83 44.98 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.605 -0.27 . . . . 10.0 110.382 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.542 HG21 ' CD2' ' A' ' 126' ' ' LEU . 5.3 t -109.43 114.44 46.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 108.65 -0.87 . . . . 10.0 108.65 179.053 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 15.8 m -132.83 118.2 18.68 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.668 -178.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 63.6 42.33 6.54 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.674 0.609 . . . . 10.0 110.752 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 5.4 t30 61.04 27.81 17.64 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.784 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.487 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 36.5 tttt -130.0 135.54 48.4 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.542 ' CD2' HG21 ' A' ' 121' ' ' VAL . 88.2 mt -88.55 122.63 32.22 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.704 0.288 . . . . 10.0 110.232 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -108.2 125.83 52.09 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.699 -179.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 6.6 t -113.57 119.95 62.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.36 -0.607 . . . . 10.0 109.36 178.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -140.82 148.09 51.11 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.634 0.254 . . . . 10.0 110.51 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -76.89 147.2 26.88 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.378 2.052 . . . . 10.0 111.913 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.8 m -114.99 149.46 42.54 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.922 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -77.3 99.14 1.27 Allowed 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.737 2.291 . . . . 10.0 112.444 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 113' ' ' ALA . 2.8 m -137.54 22.1 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.915 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 1.2 m -72.18 121.36 19.19 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.19 -0.914 . . . . 10.0 110.977 -179.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.6 m -119.38 86.08 2.49 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.468 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 140.92 -154.23 24.27 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.796 -0.638 . . . . 10.0 111.697 -179.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.04 133.74 35.31 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.742 0.306 . . . . 10.0 110.727 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 27.4 mmmt -134.07 -164.46 1.5 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.187 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 16.3 tp . . . . . 0 C--O 1.245 0.852 0 CA-C-O 118.718 -0.658 . . . . 10.0 109.819 179.422 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.686 0 N-CA-C 111.848 -0.501 . . . . 10.0 111.848 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.2 m -81.83 115.12 20.89 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.716 0.293 . . . . 10.0 110.219 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -75.34 79.36 2.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.072 0.463 . . . . 10.0 110.461 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 57.8 mtt -91.72 -4.71 54.74 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.251 -179.144 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.17 87.0 4.92 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.083 0.468 . . . . 10.0 110.626 179.648 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -134.62 108.1 10.94 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.764 -179.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -65.51 145.77 83.24 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.445 2.097 . . . . 10.0 110.966 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.91 147.24 90.14 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.875 -179.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -69.43 -175.71 1.16 Allowed 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.559 2.173 . . . . 10.0 112.331 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -77.25 168.39 20.14 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.907 -179.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -159.6 106.98 1.71 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.907 -179.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.29 -160.76 10.96 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.99 -0.624 . . . . 10.0 111.678 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 75.83 76.54 0.78 Allowed Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.767 -0.73 . . . . 10.0 112.087 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 13.6 mtp180 -129.39 -174.73 3.36 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 110.38 -0.23 . . . . 10.0 110.38 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 41.7 m95 61.43 33.17 18.8 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 123.667 0.605 . . . . 10.0 110.912 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.2 mtpt -97.39 -176.29 3.46 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.944 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 55.99 60.15 3.38 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 115.523 -0.762 . . . . 10.0 109.993 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.82 28.26 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.827 -179.001 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -111.64 118.68 36.34 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.384 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 39.2 t-80 -65.75 -56.57 11.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.562 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -166.79 133.29 2.37 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.237 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -78.22 98.51 5.9 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.176 -0.466 . . . . 10.0 109.983 179.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -155.98 167.17 31.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.65 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -127.08 155.06 76.55 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.084 -0.507 . . . . 10.0 109.644 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -53.02 -47.49 27.28 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.799 2.332 . . . . 10.0 112.22 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.2 m -143.44 90.63 2.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.077 0.465 . . . . 10.0 110.389 179.149 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.41 91.39 4.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.402 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.6 pt -125.07 148.68 61.07 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.453 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -68.96 85.91 0.49 Allowed 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.519 2.146 . . . . 10.0 111.932 179.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -128.05 118.91 24.33 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.53 -0.759 . . . . 10.0 110.51 -179.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -90.95 116.53 28.83 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.042 179.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.27 130.32 45.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.863 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.3 m -142.06 107.92 5.15 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.974 0.416 . . . . 10.0 110.927 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.413 ' CD2' ' HB3' ' A' ' 74' ' ' ASP . 13.6 t80 -82.04 131.62 35.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.364 179.232 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.1 m -79.14 118.49 21.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.284 0.564 . . . . 10.0 111.084 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -83.5 109.31 17.26 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.751 -0.658 . . . . 10.0 110.184 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.408 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 12.0 pt20 -147.36 154.82 41.36 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.829 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . 0.434 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -85.42 124.59 32.18 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.049 0.452 . . . . 10.0 110.0 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.408 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 73.0 p -117.01 158.91 42.94 Favored Pre-proline 0 C--N 1.317 -0.807 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.225 -179.459 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.408 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 45.2 Cg_endo -68.23 -7.98 21.55 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 121.997 1.798 . . . . 10.0 111.322 179.061 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 52.3 mtm -82.85 -20.33 35.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.82 179.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -75.64 -59.39 2.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.857 -0.61 . . . . 10.0 109.461 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 91.51 -61.98 2.77 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.799 -0.715 . . . . 10.0 112.938 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 49.5 p -124.45 166.29 16.27 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.939 0.399 . . . . 10.0 111.551 -179.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 45.2 tp -56.85 -44.73 82.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.492 -0.776 . . . . 10.0 111.217 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.447 ' O ' ' HG3' ' A' ' 69' ' ' GLU . 36.9 ttmt -59.87 -53.62 55.81 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.379 -179.837 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.553 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 2.3 m -57.49 -43.81 84.46 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.423 -0.353 . . . . 10.0 111.069 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 52.0 ttp -57.63 -51.52 69.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.121 0.486 . . . . 10.0 110.407 179.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 77.0 mt -64.95 -36.86 85.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.131 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 22.3 mt-10 -63.86 -41.0 97.88 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 110.261 -0.274 . . . . 10.0 110.261 179.002 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.553 ' HG2' ' O ' ' A' ' 66' ' ' THR . 32.0 mmt180 -69.32 -39.26 78.33 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 179.05 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 37.6 m0 -61.93 -54.77 37.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.734 179.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -59.89 -44.11 94.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.531 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.433 ' HB1' ' O ' ' A' ' 69' ' ' GLU . . . -64.95 -36.25 83.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.734 0.302 . . . . 10.0 111.541 -179.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 70' ' ' ARG . 0.5 OUTLIER -73.28 -12.89 61.01 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.887 0.375 . . . . 10.0 111.424 -179.304 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.5 m -120.58 12.28 11.48 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.437 -0.347 . . . . 10.0 111.312 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 62.2 t30 56.05 51.68 11.6 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.358 0.599 . . . . 10.0 110.619 179.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.408 ' HG2' ' OD1' ' A' ' 124' ' ' ASN . 71.1 mtp -124.27 171.17 10.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.984 -0.553 . . . . 10.0 111.029 -179.093 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 37.6 mm-40 -101.68 164.87 11.52 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.063 179.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.7 tp -141.52 142.48 33.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.344 0.593 . . . . 10.0 111.473 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.426 ' HB2' ' HG ' ' A' ' 127' ' ' LEU . 12.9 m -131.12 97.38 4.28 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.13 -0.941 . . . . 10.0 110.525 179.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.632 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 15.7 t80 -91.01 103.48 16.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.298 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -93.41 0.99 57.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.766 0.317 . . . . 10.0 111.65 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.632 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 2.1 mm? -74.33 137.13 75.01 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.316 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.56 -26.66 54.12 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.969 2.446 . . . . 10.0 112.577 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 57.2 m -141.19 161.92 36.71 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.946 0.403 . . . . 10.0 111.033 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -85.91 143.67 28.07 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.974 179.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -121.37 134.91 55.13 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.223 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.07 161.37 29.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.57 -0.286 . . . . 10.0 110.371 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.98 107.96 3.33 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.0 pt -47.99 -46.13 12.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.621 -0.718 . . . . 10.0 112.533 -178.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 165.38 -69.33 0.19 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.044 -1.074 . . . . 10.0 112.881 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -56.41 -13.4 10.16 Favored 'Trans proline' 0 N--CA 1.478 0.583 0 C-N-CA 123.661 2.907 . . . . 10.0 113.39 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.1 t -60.47 -36.31 68.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.246 0.546 . . . . 10.0 110.346 179.692 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.434 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.8 m -69.34 -12.0 61.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.605 -0.725 . . . . 10.0 111.51 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.48 -1.19 53.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.936 0.398 . . . . 10.0 110.921 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.408 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 53.6 mt -98.36 113.72 33.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.801 -0.444 . . . . 10.0 109.801 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.1 m -142.29 95.39 2.79 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.979 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.0 t -131.02 153.58 49.1 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.549 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.09 -8.71 58.54 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.903 0.382 . . . . 10.0 111.315 179.498 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.8 t -100.02 119.18 37.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.578 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 12.8 p -65.78 -30.85 51.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-O 121.024 0.44 . . . . 10.0 110.255 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -69.07 -41.94 76.88 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 52.9 tp60 -66.43 -40.9 89.79 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.597 178.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.61 -49.09 78.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.331 179.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.82 -35.96 79.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.169 0.509 . . . . 10.0 110.221 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 95.0 m -66.14 -49.29 67.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.965 179.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -65.8 -44.73 84.81 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.028 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 64.1 mt -59.85 -49.24 78.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.676 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.416 ' O ' ' HB2' ' A' ' 113' ' ' ALA . 49.4 m -62.38 -23.45 66.82 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.551 0.204 . . . . 10.0 111.551 -179.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.79 -41.43 78.74 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.837 0.351 . . . . 10.0 110.656 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.4 p -89.03 -32.63 5.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.408 0.623 . . . . 10.0 111.326 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.42 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.5 m-30 -77.67 -23.42 49.6 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.254 0.835 . . . . 10.0 113.254 -178.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.416 ' HB2' ' O ' ' A' ' 109' ' ' SER . . . -49.08 -49.32 42.28 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 111.78 0.289 . . . . 10.0 111.78 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.85 -22.86 67.07 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.112 0.482 . . . . 10.0 111.441 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -84.89 -15.02 45.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.264 0.554 . . . . 10.0 110.306 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 94.68 25.99 14.16 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.747 -0.739 . . . . 10.0 112.275 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . 0.42 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 95.4 t -129.54 138.39 54.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.929 0.395 . . . . 10.0 110.877 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.1 m -138.34 120.98 16.27 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.058 0.456 . . . . 10.0 110.314 178.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.47 ' CG1' HG11 ' A' ' 128' ' ' VAL . 3.9 m -104.78 137.46 33.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.171 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.96 140.47 23.38 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.191 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 1.7 p -107.96 123.2 63.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.186 0.517 . . . . 10.0 109.685 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 56.4 m -143.72 132.99 23.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.578 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 59.1 39.86 22.65 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.317 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.408 ' OD1' ' HG2' ' A' ' 77' ' ' MET . 18.8 t30 63.81 24.18 13.68 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.488 -0.778 . . . . 10.0 111.048 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 41.5 tttt -128.03 133.13 49.08 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.251 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 17.2 mt -89.04 121.44 31.38 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.595 -0.891 . . . . 10.0 108.595 178.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.426 ' HG ' ' HB2' ' A' ' 80' ' ' SER . 0.3 OUTLIER -117.34 122.95 45.31 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.174 0.511 . . . . 10.0 110.876 -179.358 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . 0.552 ' CG1' HD21 ' A' ' 83' ' ' LEU . 1.8 t -111.26 121.03 63.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.632 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -134.94 146.05 57.09 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.076 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -76.54 150.77 32.09 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.316 2.011 . . . . 10.0 111.676 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -119.96 147.12 43.66 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.659 179.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -78.48 98.1 1.18 Allowed 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.76 2.307 . . . . 10.0 112.497 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 1.6 m -127.69 19.0 3.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.367 0.604 . . . . 10.0 110.761 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.13 101.11 13.17 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.66 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.9 m -70.64 131.63 44.21 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.5 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 94.26 -95.97 1.99 Allowed Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 120.719 -0.753 . . . . 10.0 112.183 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -87.62 117.27 26.32 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.731 0.3 . . . . 10.0 111.415 -179.577 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . 0.43 ' HD3' ' C ' ' A' ' 138' ' ' LYS . 7.5 tmtt? -159.87 124.05 3.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.312 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 66.7 mt . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.775 -0.631 . . . . 10.0 109.967 179.361 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.711 0 N-CA-C 111.76 -0.536 . . . . 10.0 111.76 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 m -100.26 140.18 34.88 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.278 -0.268 . . . . 10.0 110.278 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -127.57 33.31 4.85 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.381 0.61 . . . . 10.0 110.275 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.97 159.98 14.69 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.627 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.6 t -148.96 145.31 27.29 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.85 0.357 . . . . 10.0 110.293 179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -132.7 71.88 78.1 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.813 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -83.64 154.12 13.61 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 123.028 2.485 . . . . 10.0 111.823 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -153.78 136.89 10.06 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.514 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_exo -57.44 141.02 94.88 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.596 2.198 . . . . 10.0 111.495 179.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.94 166.92 12.58 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.553 -179.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -165.89 106.44 0.72 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.009 -179.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 175.78 137.24 2.51 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.896 -0.669 . . . . 10.0 111.965 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 131.27 -3.74 5.54 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.58 -0.819 . . . . 10.0 112.56 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.2 mtp180 -73.65 -33.03 64.32 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 120.771 0.319 . . . . 10.0 110.768 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 78.4 m95 -82.74 -11.09 58.57 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.053 0.454 . . . . 10.0 110.545 -179.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt -94.6 91.82 6.76 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.649 -0.705 . . . . 10.0 109.909 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -146.45 89.85 1.89 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.233 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.1 m -137.83 168.29 20.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.464 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -120.61 105.25 10.62 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.09 0.471 . . . . 10.0 110.039 179.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 16.5 m170 -82.91 8.41 12.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.043 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -85.56 -1.41 57.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.343 -0.389 . . . . 10.0 110.582 179.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -67.95 130.23 42.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.081 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.18 -64.37 1.16 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.507 -179.469 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -121.85 144.63 41.4 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.309 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -62.26 -50.25 5.0 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.044 1.83 . . . . 10.0 111.523 -179.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.8 m -142.35 107.69 5.02 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.851 179.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -82.88 106.13 14.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.916 0.389 . . . . 10.0 110.353 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.407 HD11 HG22 ' A' ' 47' ' ' ILE . 0.8 OUTLIER -129.56 101.72 18.66 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.792 -179.54 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -68.61 99.66 0.64 Allowed 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.807 2.338 . . . . 10.0 111.419 179.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.1 tp -151.95 119.53 6.06 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.413 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -75.09 123.08 24.57 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 179.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.21 111.95 1.38 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.829 0.347 . . . . 10.0 110.237 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.6 m -143.02 99.23 3.42 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 120.994 0.426 . . . . 10.0 111.107 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -68.9 120.18 14.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.527 -0.76 . . . . 10.0 109.931 179.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.8 m -76.95 122.81 25.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.728 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' TYR . . . . . 0.458 ' O ' ' HA ' ' A' ' 97' ' ' SER . 95.2 m-85 -89.96 121.99 32.56 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.562 -0.744 . . . . 10.0 109.979 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.408 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 19.8 pt20 -152.21 153.06 33.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.688 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.17 121.26 28.52 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 52.2 p -111.54 154.41 43.86 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-O 120.69 0.281 . . . . 10.0 111.322 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.92 -10.54 27.26 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.726 2.284 . . . . 10.0 111.83 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 21.4 mmt -82.4 -18.54 41.61 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.189 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -79.35 -52.78 7.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.694 -0.685 . . . . 10.0 109.575 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 92.82 -67.35 1.85 Allowed Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.464 -0.789 . . . . 10.0 112.855 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.478 HG23 ' OD2' ' A' ' 86' ' ' ASP . 28.4 p -118.58 169.39 9.83 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.79 0.329 . . . . 10.0 111.512 -179.19 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.463 HD13 ' CE2' ' A' ' 112' ' ' TYR . 41.2 tp -59.35 -36.43 75.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.679 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -61.16 -58.3 8.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.527 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.39 -33.31 75.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.161 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.435 ' HB2' ' O ' ' A' ' 63' ' ' THR . 4.4 tmm? -63.03 -54.8 32.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.733 -0.667 . . . . 10.0 111.166 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.0 mp -68.42 -31.52 70.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.317 -0.401 . . . . 10.0 111.263 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -57.84 -43.5 85.88 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.706 -0.479 . . . . 10.0 109.706 178.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -68.47 -42.35 78.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.119 179.483 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 25.4 m0 -55.85 -55.42 32.67 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.624 -0.717 . . . . 10.0 110.683 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.82 -45.54 85.79 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.072 -0.967 . . . . 10.0 111.702 -178.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.95 -40.76 90.07 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.929 0.344 . . . . 10.0 111.929 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -66.24 -27.83 68.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.012 0.434 . . . . 10.0 111.51 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.0 m -108.76 11.65 26.18 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 -178.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 55.55 48.42 18.76 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.589 0.709 . . . . 10.0 110.67 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 59.1 mtp -114.65 168.09 10.18 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.164 -179.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -99.88 158.99 15.42 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.655 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 26.8 tp -132.83 128.26 36.31 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.571 0.7 . . . . 10.0 110.935 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 69.4 m -114.96 94.75 4.89 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 114.972 -1.013 . . . . 10.0 109.427 178.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.491 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 12.5 t80 -94.45 101.46 13.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.808 -179.164 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -105.23 28.37 7.36 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.99 0.424 . . . . 10.0 111.473 -179.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.482 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 34.2 mt -96.01 145.85 30.27 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.052 179.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.4 -38.43 89.33 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 123.183 2.589 . . . . 10.0 112.547 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.4 m -150.73 171.09 17.71 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.992 0.425 . . . . 10.0 110.888 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.491 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 8.9 p-10 -83.1 131.56 35.14 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.718 -0.674 . . . . 10.0 109.839 179.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -103.79 131.74 50.7 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.747 -179.29 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.65 150.8 48.53 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.441 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.28 108.86 0.67 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 120.977 0.418 . . . . 10.0 110.09 178.481 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.2 pt -52.57 -37.93 25.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.071 -0.968 . . . . 10.0 112.91 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 141.17 -72.38 0.4 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.291 -0.957 . . . . 10.0 112.071 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -57.07 -17.05 23.3 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 123.039 2.493 . . . . 10.0 112.367 179.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 10.2 p -63.8 -32.0 55.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.512 0.672 . . . . 10.0 110.267 178.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 1.4 m -72.53 -7.42 49.93 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.153 -0.931 . . . . 10.0 111.08 179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.2 -4.72 48.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.315 0.578 . . . . 10.0 110.237 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . 0.408 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 65.1 mt -92.2 112.51 25.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 CA-C-N 115.422 -0.808 . . . . 10.0 109.82 -179.368 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.458 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 1.7 m -142.61 97.9 3.2 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.605 -0.725 . . . . 10.0 109.821 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.1 t -131.38 157.16 44.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.747 0.308 . . . . 10.0 110.888 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.03 -21.79 39.88 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.786 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.2 t -90.16 119.03 30.14 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.771 0.32 . . . . 10.0 110.491 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.0 p -65.04 -31.69 55.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.85 0.357 . . . . 10.0 110.556 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -68.9 -41.24 78.51 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 109.546 -0.539 . . . . 10.0 109.546 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -66.75 -41.43 87.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.845 179.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.57 -47.09 76.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.158 178.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.11 -35.21 80.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.295 178.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 86.0 m -65.58 -48.42 72.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.228 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -65.17 -37.56 87.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.089 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LEU . . . . . 0.496 ' O ' HG13 ' A' ' 111' ' ' VAL . 1.8 mp -63.91 -52.78 58.29 Favored 'General case' 0 C--O 1.219 -0.508 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.22 178.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.6 m -57.91 -29.61 65.24 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.967 0.358 . . . . 10.0 111.967 -179.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.2 -45.78 91.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.255 0.55 . . . . 10.0 110.51 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . 0.496 HG13 ' O ' ' A' ' 108' ' ' LEU . 11.9 p -89.55 -22.65 6.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.756 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' TYR . . . . . 0.463 ' CE2' HD13 ' A' ' 64' ' ' LEU . 3.7 m-85 -83.13 -24.08 32.74 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.143 0.794 . . . . 10.0 113.143 -178.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.63 -40.11 38.23 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.077 0.399 . . . . 10.0 112.077 -179.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.47 -19.49 63.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.103 0.478 . . . . 10.0 111.402 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -93.72 -2.57 53.63 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.398 0.618 . . . . 10.0 109.632 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.22 23.33 52.01 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 115.466 -0.788 . . . . 10.0 112.625 179.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 60.8 t -124.55 140.25 48.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.026 0.441 . . . . 10.0 111.546 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 6.6 m -139.94 122.6 16.34 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.359 -0.608 . . . . 10.0 109.359 178.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 10.8 m -114.65 149.35 16.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.143 0.497 . . . . 10.0 111.358 -178.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.0 p -152.13 170.47 19.89 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.088 -0.506 . . . . 10.0 109.872 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' VAL . . . . . 0.464 HG23 ' CD2' ' A' ' 126' ' ' LEU . 3.5 t -125.7 119.07 53.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.173 -0.677 . . . . 10.0 109.173 179.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 15.3 m -128.73 109.62 11.47 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.028 -179.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 58.99 57.69 3.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.63 -0.714 . . . . 10.0 112.06 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 19.9 t30 61.13 21.6 12.0 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.569 -0.742 . . . . 10.0 111.782 178.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 47.8 tttt -125.54 133.12 52.45 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.984 -0.376 . . . . 10.0 109.984 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.464 ' CD2' HG23 ' A' ' 121' ' ' VAL . 69.6 mt -87.95 122.23 31.31 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.511 -0.551 . . . . 10.0 109.511 179.307 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -107.93 117.24 33.6 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.533 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 11.5 t -109.05 118.06 55.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 108.515 -0.92 . . . . 10.0 108.515 178.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -134.19 141.66 40.24 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-O 120.766 0.317 . . . . 10.0 110.569 -179.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -81.31 145.21 14.97 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.313 2.009 . . . . 10.0 111.365 179.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 1.7 m -110.82 145.81 33.13 Favored Pre-proline 0 C--N 1.323 -0.579 0 C-N-CA 120.942 -0.303 . . . . 10.0 110.617 179.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -79.07 88.6 1.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.699 2.266 . . . . 10.0 111.846 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 13.1 m -130.93 -175.42 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.109 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 1.1 m -73.89 145.73 44.58 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.95 0.405 . . . . 10.0 110.761 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 2.6 m -70.07 -38.35 75.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.151 0.5 . . . . 10.0 110.031 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -106.15 57.41 0.47 Allowed Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.703 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -73.48 98.64 2.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.036 0.446 . . . . 10.0 110.626 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -162.04 175.89 11.31 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.617 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.512 -0.756 . . . . 10.0 110.141 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.1 t80 . . . . . 0 N--CA 1.455 -0.18 0 CA-C-O 120.753 0.311 . . . . 10.0 110.703 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.6 m -85.41 119.03 25.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.219 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -88.64 113.34 24.11 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.022 -0.733 . . . . 10.0 109.022 179.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -153.73 158.57 41.17 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.018 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.52 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -73.85 139.08 44.81 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.817 -0.809 . . . . 10.0 108.817 178.36 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.2 p -126.23 161.82 49.8 Favored Pre-proline 0 C--N 1.319 -0.725 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.353 -177.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -75.53 12.33 1.38 Allowed 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 121.93 1.754 . . . . 10.0 112.326 179.017 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 16.2 ptt? -111.27 -17.17 13.23 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.426 0.528 . . . . 10.0 112.426 -179.401 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.17 -61.67 1.87 Allowed 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.17 -0.612 . . . . 10.0 110.669 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.18 -53.59 2.49 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.731 -0.747 . . . . 10.0 112.019 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 61.8 p -126.78 166.44 17.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.727 0.298 . . . . 10.0 111.058 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.401 HD13 ' CE2' ' A' ' 112' ' ' TYR . 62.6 tp -56.23 -45.35 79.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.815 -0.63 . . . . 10.0 111.168 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -56.48 -54.57 44.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.646 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.89 -35.99 78.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.586 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.413 ' HE3' HD21 ' A' ' 108' ' ' LEU . 50.5 ttp -64.03 -50.5 68.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.367 -0.378 . . . . 10.0 110.218 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 71.3 mt -64.76 -34.75 79.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.248 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -60.0 -50.02 75.4 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.163 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -66.43 -40.69 89.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.235 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 31.3 m0 -57.64 -54.3 48.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.152 0.501 . . . . 10.0 110.829 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.92 -42.4 81.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.699 -0.682 . . . . 10.0 111.944 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.42 -40.56 78.6 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.564 0.579 . . . . 10.0 112.564 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -60.5 -39.33 87.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.905 0.383 . . . . 10.0 111.415 -179.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.403 ' HB2' ' HG3' ' A' ' 77' ' ' MET . 8.7 m -97.78 11.98 35.4 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.36 -179.273 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 m120 56.06 39.96 30.35 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.532 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.403 ' HG3' ' HB2' ' A' ' 75' ' ' SER . 5.2 mtm -102.88 164.09 11.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.783 -0.644 . . . . 10.0 109.488 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 -96.82 157.86 15.7 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.565 -0.288 . . . . 10.0 110.953 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 34.0 tp -128.74 138.06 51.91 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.194 0.521 . . . . 10.0 110.649 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.24 96.16 4.98 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.121 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.509 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 16.4 t80 -95.45 98.83 10.84 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.708 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -101.77 37.87 1.74 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.858 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.509 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 44.2 mt -106.01 142.15 24.24 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -61.04 -30.31 89.33 Favored 'Trans proline' 0 CA--C 1.529 0.23 0 C-N-CA 122.764 2.31 . . . . 10.0 113.313 -179.03 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.2 m -145.69 166.85 24.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.893 0.378 . . . . 10.0 111.494 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.38 124.97 39.68 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.214 -0.662 . . . . 10.0 109.214 179.331 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -110.27 156.7 20.33 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.554 0.216 . . . . 10.0 110.714 -178.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.8 OUTLIER -79.99 177.02 9.22 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.727 179.574 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.98 134.54 41.45 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.41 HG12 ' H ' ' A' ' 90' ' ' ILE . 1.7 pt -65.87 -28.8 44.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 112.517 0.562 . . . . 10.0 112.517 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 138.03 -62.72 0.57 Allowed Glycine 0 CA--C 1.52 0.36 0 C-N-CA 120.296 -0.954 . . . . 10.0 113.618 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.86 7.99 1.47 Allowed 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.534 2.156 . . . . 10.0 113.151 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.9 t -69.41 -45.63 78.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.939 0.4 . . . . 10.0 110.658 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.52 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.0 OUTLIER -65.77 -13.75 60.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.593 179.85 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.68 1.8 47.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.031 0.443 . . . . 10.0 110.875 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.418 HD13 HD12 ' A' ' 108' ' ' LEU . 46.6 mt -107.62 107.2 22.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.181 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.4 97.61 4.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.048 0.451 . . . . 10.0 111.128 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.2 t -130.74 155.95 45.78 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.711 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.12 -6.26 55.6 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.235 0.541 . . . . 10.0 110.816 179.372 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 19.4 t -98.46 116.24 30.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.287 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.15 -31.63 54.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.186 0.517 . . . . 10.0 110.059 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -68.12 -43.47 78.33 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.798 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.6 tp60 -67.77 -41.21 83.63 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.286 -0.416 . . . . 10.0 110.343 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.96 -49.15 72.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.413 179.151 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.16 -36.95 85.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.461 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 98.9 m -63.37 -43.81 96.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.824 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -70.78 -41.36 71.81 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.454 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.418 HD12 HD13 ' A' ' 96' ' ' ILE . 2.0 mp -61.92 -51.17 69.22 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.91 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.7 p -58.31 -25.52 61.96 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.172 0.434 . . . . 10.0 112.172 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.36 -43.65 66.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.029 0.443 . . . . 10.0 111.149 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.439 HG13 ' HD1' ' A' ' 112' ' ' TYR . 10.5 p -87.56 -24.5 6.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.203 0.525 . . . . 10.0 111.291 -179.325 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.439 ' HD1' HG13 ' A' ' 111' ' ' VAL . 8.0 m-85 -79.79 -24.28 41.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.795 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -51.28 -36.43 42.27 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.438 -0.346 . . . . 10.0 111.643 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.65 -27.09 68.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.959 0.409 . . . . 10.0 111.664 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -91.97 -11.98 34.61 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.715 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' GLY . . . . . 0.449 ' HA2' HG23 ' A' ' 131' ' ' VAL . . . 93.45 27.46 13.13 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.622 -0.799 . . . . 10.0 112.107 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 57.8 t -124.53 125.67 70.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.798 0.332 . . . . 10.0 111.076 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.4 m -122.67 113.87 19.82 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.188 178.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 16.4 m -105.39 142.33 18.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.801 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 41.6 m -152.46 166.27 32.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.015 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.504 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.5 t -117.73 128.4 74.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 110.111 -0.329 . . . . 10.0 110.111 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.6 m -147.6 120.86 8.94 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.728 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 61.68 43.13 10.11 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 123.636 0.585 . . . . 10.0 111.559 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 19.1 m120 62.33 26.61 15.91 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.727 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -130.31 132.8 46.04 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.61 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.504 ' CD2' HG22 ' A' ' 121' ' ' VAL . 97.4 mt -88.61 122.72 32.36 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 108.62 -0.882 . . . . 10.0 108.62 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -112.79 122.76 48.59 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.331 0.586 . . . . 10.0 111.234 -178.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.2 t -108.17 119.21 57.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.269 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -128.45 138.49 33.16 Favored Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 110.032 -0.358 . . . . 10.0 110.032 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.425 ' HA ' ' O ' ' A' ' 116' ' ' GLY . 69.4 Cg_endo -77.96 135.02 13.66 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 121.98 1.786 . . . . 10.0 111.855 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.449 HG23 ' HA2' ' A' ' 116' ' ' GLY . 3.2 m . . . . . 0 C--N 1.319 -0.727 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.347 179.521 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 29.0 t80 . . . . . 0 C--O 1.234 0.241 0 CA-C-O 120.924 0.392 . . . . 10.0 110.313 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 30.4 m -75.36 121.29 22.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.831 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -86.47 116.54 24.68 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.408 -0.814 . . . . 10.0 109.088 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -145.85 147.74 32.13 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.187 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.797 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -74.77 112.14 10.68 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.733 -0.469 . . . . 10.0 109.733 178.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.425 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 26.2 p -107.55 157.26 36.21 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.799 -179.143 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.425 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 37.3 Cg_endo -65.99 -11.21 30.03 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.348 2.032 . . . . 10.0 111.255 178.562 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 51.3 mtt -77.74 -29.42 51.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.64 -0.709 . . . . 10.0 109.891 179.034 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -75.88 -51.67 12.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.221 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 81.2 -63.14 4.37 Favored Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.478 -0.783 . . . . 10.0 113.64 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 43.8 p -113.1 169.33 9.01 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.881 0.372 . . . . 10.0 111.67 -178.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.495 HD13 ' HE2' ' A' ' 112' ' ' TYR . 66.9 tp -63.46 -47.42 81.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.64 -0.709 . . . . 10.0 111.227 -179.468 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 34.1 ttmt -56.11 -55.99 26.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.222 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.0 m -61.37 -32.45 72.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.845 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 55.9 ttp -68.99 -51.19 41.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.938 0.399 . . . . 10.0 110.35 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.1 mt -62.35 -35.66 79.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.703 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -61.44 -40.94 96.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.558 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -68.66 -40.55 80.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.278 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.441 ' CZ3' ' HB1' ' A' ' 104' ' ' ALA . 43.7 m0 -64.13 -50.01 69.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.447 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.547 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -60.48 -37.14 80.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.199 179.376 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.45 -34.71 77.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.567 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.06 -41.32 95.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.331 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.76 7.69 45.59 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.33 0.492 . . . . 10.0 112.33 -177.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 60.72 53.22 4.04 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.59 0.71 . . . . 10.0 109.856 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.487 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 22.0 mtm -124.43 171.22 10.12 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.831 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -106.24 171.11 7.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.468 -0.333 . . . . 10.0 110.585 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.3 tp -133.27 133.53 42.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.149 0.5 . . . . 10.0 111.578 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -119.24 95.9 4.99 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.467 -0.788 . . . . 10.0 109.506 178.725 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.467 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 6.7 t80 -88.98 98.52 11.8 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.697 -0.683 . . . . 10.0 109.394 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.419 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 64.3 m-80 -101.81 37.09 1.9 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.283 0.563 . . . . 10.0 110.898 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.437 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 33.7 mt -101.21 145.44 30.44 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.816 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -62.35 -40.29 41.06 Favored 'Trans proline' 0 N--CA 1.464 -0.232 0 C-N-CA 122.617 2.211 . . . . 10.0 111.531 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -138.72 141.85 38.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.727 -0.669 . . . . 10.0 110.083 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.467 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 15.1 t70 -78.56 131.31 36.72 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.741 -0.466 . . . . 10.0 109.741 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -100.58 148.19 25.09 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.111 0.482 . . . . 10.0 111.532 -178.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.9 m -81.84 147.52 29.31 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.494 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -54.31 123.81 14.02 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 121.097 0.475 . . . . 10.0 111.372 179.345 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.46 HD12 ' HG2' ' A' ' 92' ' ' PRO . 24.2 pt -80.99 -164.28 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.508 -0.769 . . . . 10.0 110.733 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -77.18 -68.84 1.46 Allowed Glycine 0 CA--C 1.522 0.511 0 C-N-CA 120.836 -0.697 . . . . 10.0 113.304 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.46 ' HG2' HD12 ' A' ' 90' ' ' ILE . 13.8 Cg_endo -56.96 -14.55 14.55 Favored 'Trans proline' 0 N--CA 1.477 0.517 0 C-N-CA 123.592 2.861 . . . . 10.0 115.267 -178.111 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.413 HG22 ' HB2' ' A' ' 57' ' ' ALA . 12.6 p -68.93 -40.49 81.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.303 0.573 . . . . 10.0 110.406 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.797 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 2.1 m -67.82 -12.52 60.78 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.556 -0.747 . . . . 10.0 111.379 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.06 1.84 56.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.298 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 54.4 mt -96.69 111.39 26.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.254 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.7 m -130.11 100.67 5.5 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.675 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 15.4 t -129.72 155.46 45.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.785 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.64 10.09 38.0 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.085 0.402 . . . . 10.0 112.085 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.6 t -125.55 127.49 46.47 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.679 0.276 . . . . 10.0 110.71 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 6.0 p -66.4 -28.59 43.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.252 0.548 . . . . 10.0 110.249 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -70.72 -44.83 66.08 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.565 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -66.63 -38.62 87.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.871 -0.604 . . . . 10.0 109.902 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.441 ' HB1' ' CZ3' ' A' ' 71' ' ' TRP . . . -56.6 -50.42 72.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.864 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.48 -29.93 71.13 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.265 0.555 . . . . 10.0 110.551 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 36.9 m -69.03 -50.85 44.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.67 -0.695 . . . . 10.0 110.972 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -67.73 -36.96 81.53 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.055 -0.52 . . . . 10.0 111.652 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 26.7 mt -59.51 -50.01 75.57 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.704 0.288 . . . . 10.0 110.814 179.545 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.6 m -60.52 -27.76 67.87 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.356 -0.384 . . . . 10.0 111.937 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.89 -41.67 77.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.825 0.345 . . . . 10.0 111.144 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.8 p -87.48 -35.55 8.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.037 0.446 . . . . 10.0 111.585 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.495 ' HE2' HD13 ' A' ' 64' ' ' LEU . 4.0 m-30 -71.49 -22.19 61.83 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -178.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -55.39 -22.61 20.55 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.614 0.245 . . . . 10.0 111.334 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.07 -31.04 71.69 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.958 0.409 . . . . 10.0 110.615 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -94.46 -24.11 17.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.314 0.578 . . . . 10.0 109.964 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 106.77 34.37 3.06 Favored Glycine 0 N--CA 1.444 -0.77 0 CA-C-N 115.613 -0.721 . . . . 10.0 112.484 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.447 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 75.8 t -124.44 135.96 62.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.743 0.306 . . . . 10.0 110.298 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.1 m -136.1 132.22 35.82 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.108 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 7.5 m -120.73 149.29 23.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.275 0.56 . . . . 10.0 111.87 -178.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 58.3 m -155.21 154.45 32.26 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.668 179.099 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 1.7 p -110.83 119.55 59.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.981 0.419 . . . . 10.0 109.896 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.0 m -137.14 128.47 28.14 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.221 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 58.49 43.6 19.21 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 123.692 0.62 . . . . 10.0 111.447 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.487 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 9.8 m-20 58.27 39.28 25.8 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.902 0.858 . . . . 10.0 110.193 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 69.5 tttt -145.3 128.94 17.14 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.892 -1.049 . . . . 10.0 109.239 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.547 HD12 ' HB2' ' A' ' 72' ' ' ALA . 20.7 mt -88.01 121.73 30.76 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 108.265 -1.013 . . . . 10.0 108.265 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.38 123.93 51.23 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.163 0.506 . . . . 10.0 111.428 -178.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.419 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 2.9 t -102.11 120.82 52.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.223 179.065 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -129.91 133.33 24.88 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.112 -179.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.23 131.9 9.99 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.113 1.875 . . . . 10.0 111.993 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 4.5 m . . . . . 0 C--N 1.318 -0.803 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.18 179.929 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 32.9 t80 . . . . . 0 N--CA 1.453 -0.316 0 CA-C-O 121.017 0.437 . . . . 10.0 110.815 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.1 m -82.63 120.85 26.08 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.682 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -86.81 113.14 22.38 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.11 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -152.07 151.39 31.04 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.476 -0.783 . . . . 10.0 109.721 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -85.33 125.84 33.26 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.889 -0.412 . . . . 10.0 109.889 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.7 p -105.31 149.56 37.88 Favored Pre-proline 0 C--N 1.321 -0.646 0 C-N-CA 120.885 -0.326 . . . . 10.0 110.704 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -64.69 -12.29 33.15 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.643 2.228 . . . . 10.0 111.951 179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 40.1 mtt -85.25 -14.15 47.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.456 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -78.77 -48.64 14.47 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.259 -0.645 . . . . 10.0 109.259 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.58 -64.18 4.34 Favored Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.324 -0.853 . . . . 10.0 113.612 178.561 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 28.0 p -113.3 168.4 9.76 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 112.212 0.449 . . . . 10.0 112.212 -178.057 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 47.2 tp -66.01 -43.21 88.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.723 -0.671 . . . . 10.0 111.797 -179.143 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -55.25 -54.43 43.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.978 0.418 . . . . 10.0 110.42 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.1 m -64.75 -38.99 92.85 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.712 -0.676 . . . . 10.0 111.52 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.413 ' HB2' ' O ' ' A' ' 63' ' ' THR . 9.5 tmm? -61.89 -48.4 80.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.976 0.417 . . . . 10.0 111.164 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 57.6 mt -68.12 -31.35 70.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.319 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -62.24 -42.17 99.08 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.728 -0.471 . . . . 10.0 109.728 179.015 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' A' ' 74' ' ' ASP . 17.1 mmm-85 -60.6 -42.57 97.04 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.214 178.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 37.1 m0 -60.13 -55.29 35.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.59 -0.732 . . . . 10.0 111.07 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.49 -47.37 84.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.907 -179.278 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.46 -35.75 80.29 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -178.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.482 ' HB2' ' O ' ' A' ' 70' ' ' ARG . 0.4 OUTLIER -73.4 -23.97 60.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.756 0.312 . . . . 10.0 111.805 -179.211 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.4 t -108.63 7.15 26.45 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.854 -0.339 . . . . 10.0 111.555 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 65.2 t30 62.18 38.84 13.33 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.606 0.717 . . . . 10.0 110.374 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 68.3 mtp -111.08 173.6 6.26 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.219 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.405 ' HB2' ' HG3' ' A' ' 125' ' ' LYS . 88.6 mm-40 -108.15 158.72 17.18 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.531 -0.304 . . . . 10.0 110.252 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.7 tp -133.07 136.91 46.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.984 0.421 . . . . 10.0 110.891 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.578 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 3.9 m -124.12 97.64 5.43 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.709 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.544 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 4.6 t80 -86.06 97.41 10.28 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.742 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -104.65 29.35 6.25 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.943 0.401 . . . . 10.0 111.03 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.544 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 57.4 mt -89.12 146.87 37.23 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.45 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -57.64 -35.85 98.7 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.637 2.225 . . . . 10.0 111.856 179.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.0 m -151.31 155.98 39.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.904 -0.589 . . . . 10.0 109.924 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.417 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 37.7 t0 -77.84 130.83 37.14 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.603 -0.518 . . . . 10.0 109.603 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -104.73 140.04 38.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.03 0.443 . . . . 10.0 111.349 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 2.9 m -81.27 149.04 29.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.34 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.436 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -55.28 112.81 1.18 Allowed 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.872 0.368 . . . . 10.0 110.817 179.564 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 11.0 pt -65.19 -36.72 78.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.862 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 149.36 -71.5 0.3 Allowed Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.38 -0.914 . . . . 10.0 113.335 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -50.78 -17.74 3.47 Favored 'Trans proline' 0 N--CA 1.48 0.694 0 C-N-CA 123.775 2.984 . . . . 10.0 113.832 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.412 HG23 ' H ' ' A' ' 93' ' ' VAL . 0.4 OUTLIER -60.91 -37.26 76.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.118 0.485 . . . . 10.0 110.882 179.499 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.0 -9.08 57.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.494 -179.596 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -92.11 -0.93 57.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.164 0.507 . . . . 10.0 110.561 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.407 HD13 HD12 ' A' ' 108' ' ' LEU . 56.7 mt -100.34 116.39 43.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.962 -0.563 . . . . 10.0 109.525 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -142.49 95.48 2.8 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.736 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 11.9 t -130.91 154.32 48.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.449 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.02 -13.9 43.1 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.223 -0.444 . . . . 10.0 111.117 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.0 m -91.65 116.1 28.6 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.358 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.6 p -60.82 -36.48 71.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.351 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -67.56 -38.06 83.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.125 0.488 . . . . 10.0 109.893 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -67.35 -42.63 83.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.885 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.62 -47.73 81.37 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.348 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.31 -34.05 76.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.482 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 81.8 m -68.58 -50.91 48.13 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.078 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -64.04 -40.77 97.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.3 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.407 HD12 HD13 ' A' ' 96' ' ' ILE . 2.1 mp -63.56 -49.28 74.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.581 -0.281 . . . . 10.0 110.513 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.4 m -61.38 -29.19 69.76 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.499 0.185 . . . . 10.0 111.499 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.15 -42.39 98.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.906 0.384 . . . . 10.0 110.785 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.6 p -88.61 -37.67 10.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.38 0.61 . . . . 10.0 111.245 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.555 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.5 m-30 -72.65 -23.13 60.86 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 113.994 1.109 . . . . 10.0 113.994 -177.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.29 -36.93 33.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.568 0.223 . . . . 10.0 111.216 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.95 -32.23 70.38 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.948 0.404 . . . . 10.0 110.534 179.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -79.92 -9.85 59.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.439 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' GLY . . . . . 0.445 ' HA2' HG23 ' A' ' 131' ' ' VAL . . . 89.28 26.77 24.87 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.827 -0.624 . . . . 10.0 112.33 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.555 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 76.3 t -125.28 129.67 73.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.986 0.422 . . . . 10.0 111.053 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 8.0 t -127.46 113.07 15.7 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.288 -0.634 . . . . 10.0 109.288 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 2.6 m -102.28 135.72 37.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.168 0.509 . . . . 10.0 110.564 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -147.43 141.1 25.6 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.857 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.481 ' HB ' HD23 ' A' ' 126' ' ' LEU . 2.4 p -106.09 124.18 61.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-O 121.249 0.547 . . . . 10.0 109.68 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 64.5 m -142.47 123.12 14.18 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.72 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.4 51.33 5.39 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.811 -0.631 . . . . 10.0 111.48 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.6 m-20 57.41 28.87 16.04 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.815 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.578 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 50.5 tttt -136.29 131.82 34.91 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.321 -0.4 . . . . 10.0 109.991 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.481 HD23 ' HB ' ' A' ' 121' ' ' VAL . 37.7 mt -88.08 120.96 29.93 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.824 -0.806 . . . . 10.0 108.824 178.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -107.32 115.42 30.13 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.381 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.409 HG12 HD21 ' A' ' 83' ' ' LEU . 2.2 t -100.64 116.57 44.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 107.834 -1.173 . . . . 10.0 107.834 177.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -122.47 131.51 24.38 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 116.484 -0.325 . . . . 10.0 110.916 -177.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.434 ' HA ' ' O ' ' A' ' 116' ' ' GLY . 73.8 Cg_endo -79.07 131.85 10.13 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.122 1.881 . . . . 10.0 111.496 178.79 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.445 HG23 ' HA2' ' A' ' 116' ' ' GLY . 8.5 m . . . . . 0 C--N 1.317 -0.847 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.424 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 16.4 t80 . . . . . 0 N--CA 1.452 -0.351 0 CA-C-O 120.831 0.348 . . . . 10.0 111.08 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.0 m -81.0 106.22 12.84 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.819 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -77.46 100.11 5.89 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.24 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.448 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 3.0 tt0 -141.86 142.35 33.11 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.98 -1.009 . . . . 10.0 110.223 -178.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.462 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -74.96 122.09 22.94 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.149 -0.685 . . . . 10.0 109.149 178.331 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 22.1 p -94.33 141.37 23.45 Favored Pre-proline 0 C--N 1.318 -0.802 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.723 -179.304 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -70.26 0.72 5.61 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 122.63 2.22 . . . . 10.0 112.104 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 60.9 mtt -104.71 -6.3 20.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.737 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.54 ' OD1' ' HB ' ' A' ' 66' ' ' THR . 10.9 t70 -72.47 -69.57 0.4 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.831 0.348 . . . . 10.0 110.827 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.446 ' O ' HG22 ' A' ' 88' ' ' THR . . . 113.09 -42.35 1.98 Allowed Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.485 -0.865 . . . . 10.0 114.008 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 72.0 p -135.99 168.64 18.97 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 118.454 1.127 . . . . 10.0 113.664 -177.393 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.461 HD13 ' HE2' ' A' ' 112' ' ' TYR . 60.2 tp -69.67 -48.29 60.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.048 -0.978 . . . . 10.0 111.121 179.278 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.55 ' HD3' ' CD1' ' A' ' 81' ' ' TYR . 25.6 tptp -58.37 -50.16 74.64 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.82 -0.627 . . . . 10.0 111.293 -178.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.54 ' HB ' ' OD1' ' A' ' 61' ' ' ASP . 62.8 m -60.48 -40.77 92.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.705 0.288 . . . . 10.0 110.906 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 47.7 ttp -61.55 -48.04 82.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.951 0.405 . . . . 10.0 110.213 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 79.6 mt -63.87 -37.53 87.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.496 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -62.04 -44.03 97.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.561 178.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.83 -43.89 97.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.392 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.417 ' CZ3' HD11 ' A' ' 108' ' ' LEU . 44.4 m0 -63.76 -50.79 67.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.461 -0.79 . . . . 10.0 111.078 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.564 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -63.41 -47.86 80.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.561 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.25 -41.38 88.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.693 0.282 . . . . 10.0 111.427 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -64.96 -37.57 88.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.951 0.405 . . . . 10.0 111.366 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 7.4 p -91.04 5.59 48.28 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.642 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 63.1 t30 60.47 32.73 20.59 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.629 0.728 . . . . 10.0 110.219 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.44 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 17.4 mtm -107.08 168.57 9.11 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.42 -179.419 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 -98.46 165.87 11.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.488 -0.324 . . . . 10.0 110.206 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 24.4 tp -133.86 131.23 38.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.123 0.487 . . . . 10.0 111.335 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -116.6 97.1 5.82 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.509 179.138 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.599 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 25.2 t80 -92.07 98.05 11.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.641 -0.708 . . . . 10.0 110.421 -179.034 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -101.23 20.95 14.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.907 0.384 . . . . 10.0 111.122 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.599 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 31.4 mt -80.94 143.21 53.07 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.036 179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -57.3 -45.4 35.15 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.674 2.249 . . . . 10.0 112.448 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.1 m -135.93 168.26 19.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.982 0.42 . . . . 10.0 110.884 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.424 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 0.4 OUTLIER -79.57 135.03 36.5 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.593 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -115.62 162.89 16.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.878 0.37 . . . . 10.0 111.153 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.446 HG22 ' O ' ' A' ' 62' ' ' GLY . 1.2 p -108.37 172.61 6.74 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.658 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.48 114.51 14.11 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.4 pt -62.41 -37.37 78.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.685 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 155.24 -71.73 0.26 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.551 -0.833 . . . . 10.0 112.805 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.33 -2.13 1.21 Allowed 'Trans proline' 0 N--CA 1.481 0.782 0 C-N-CA 123.649 2.899 . . . . 10.0 113.922 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.412 ' H ' HG23 ' A' ' 93' ' ' VAL . 2.3 t -65.8 -44.12 93.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.892 0.377 . . . . 10.0 110.451 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.462 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.7 OUTLIER -65.17 -8.96 19.45 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.028 -0.533 . . . . 10.0 112.053 179.421 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.67 -10.95 54.95 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.063 0.459 . . . . 10.0 110.496 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.448 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 23.8 mt -90.16 107.56 18.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -136.21 91.96 2.73 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.029 0.443 . . . . 10.0 111.088 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.0 t -132.33 155.76 47.81 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.58 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -90.75 -5.63 55.45 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.285 0.564 . . . . 10.0 110.567 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.6 t -95.67 115.58 27.63 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.508 HG13 HG11 ' A' ' 121' ' ' VAL . 13.9 p -64.1 -30.07 49.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.896 0.379 . . . . 10.0 110.405 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -68.71 -43.17 76.57 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.678 178.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -65.3 -42.62 92.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.989 178.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.66 -50.48 73.02 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.846 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.61 -35.2 77.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.235 0.54 . . . . 10.0 110.357 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 99.4 m -66.01 -49.72 66.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.74 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -63.32 -40.57 97.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.487 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.417 HD11 ' CZ3' ' A' ' 71' ' ' TRP . 83.5 mt -61.33 -49.86 75.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.568 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.2 m -59.29 -27.7 66.09 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.48 -42.57 78.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.972 0.415 . . . . 10.0 111.232 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -87.98 -29.6 5.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.971 0.415 . . . . 10.0 111.874 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.541 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.6 m-30 -81.07 -22.69 39.04 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 114.0 1.111 . . . . 10.0 114.0 -177.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.27 -30.23 11.37 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 111.74 0.274 . . . . 10.0 111.74 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.76 -39.6 73.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.056 0.455 . . . . 10.0 110.739 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 -74.91 -24.09 58.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.112 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' GLY . . . . . 0.433 ' HA2' HG23 ' A' ' 131' ' ' VAL . . . 103.86 35.11 3.57 Favored Glycine 0 N--CA 1.445 -0.739 0 CA-C-N 115.515 -0.766 . . . . 10.0 112.381 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.541 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 94.8 t -131.35 129.54 62.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.08 0.467 . . . . 10.0 111.116 -179.549 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.1 m -130.0 118.84 22.21 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.462 ' CG1' HG13 ' A' ' 128' ' ' VAL . 9.2 m -112.44 136.83 47.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.224 0.535 . . . . 10.0 112.04 -177.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 73.1 m -145.0 140.12 27.94 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.798 -0.637 . . . . 10.0 109.723 179.057 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.508 HG11 HG13 ' A' ' 101' ' ' VAL . 2.5 p -102.05 128.83 54.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.856 -0.424 . . . . 10.0 109.856 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.1 m -151.12 130.88 13.18 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.223 -0.444 . . . . 10.0 111.06 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 59.33 45.63 13.71 Favored 'General case' 0 C--O 1.235 0.298 0 O-C-N 123.684 0.615 . . . . 10.0 111.842 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.44 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 92.4 m-20 59.7 33.85 21.97 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.505 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.94 131.44 27.02 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.26 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.564 HD12 ' HB2' ' A' ' 72' ' ' ALA . 18.6 mt -89.53 120.97 31.3 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 107.587 -1.264 . . . . 10.0 107.587 177.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.86 119.91 40.95 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.306 0.574 . . . . 10.0 111.179 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.462 HG13 ' CG1' ' A' ' 119' ' ' VAL . 3.2 t -106.42 118.57 54.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-N 115.246 -0.888 . . . . 10.0 108.827 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -131.17 138.3 32.59 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-O 120.768 0.318 . . . . 10.0 110.782 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.49 138.71 13.95 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.2 1.933 . . . . 10.0 111.68 178.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.433 HG23 ' HA2' ' A' ' 116' ' ' GLY . 0.2 OUTLIER . . . . . 0 C--N 1.321 -0.665 0 N-CA-C 110.041 -0.355 . . . . 10.0 110.041 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 29.1 t80 . . . . . 0 N--CA 1.453 -0.324 0 CA-C-O 120.766 0.317 . . . . 10.0 110.762 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.9 m -75.1 110.93 9.83 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 121.194 0.521 . . . . 10.0 110.233 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -89.31 98.87 12.01 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.188 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -134.56 147.14 50.2 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.006 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.41 ' HB2' ' SD ' ' A' ' 67' ' ' MET . . . -74.77 121.0 21.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.74 0.305 . . . . 10.0 110.418 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.425 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 81.3 p -107.1 158.47 32.89 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.354 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.425 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 50.6 Cg_endo -68.54 -4.14 12.46 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.286 1.991 . . . . 10.0 112.036 179.534 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 61.6 mtt -92.28 -18.66 23.08 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.825 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -73.12 -55.64 6.2 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.419 0.628 . . . . 10.0 109.686 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 88.71 -64.21 3.46 Favored Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.595 -0.73 . . . . 10.0 113.347 178.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 15.7 p -117.57 165.59 13.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.04 0.447 . . . . 10.0 112.088 -178.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.523 HD13 ' CE2' ' A' ' 112' ' ' TYR . 55.0 tp -57.89 -42.32 84.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.118 -0.946 . . . . 10.0 110.565 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.4 ' O ' ' HG3' ' A' ' 69' ' ' GLU . 58.0 tttt -60.89 -57.84 10.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.847 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.18 -38.38 73.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.165 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.41 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 51.7 ttp -63.52 -51.67 64.51 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.628 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 98.6 mt -64.2 -36.96 85.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.091 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 51.9 mt-10 -63.5 -38.86 92.76 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.206 0.526 . . . . 10.0 110.087 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? -71.65 -32.13 67.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.216 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 38.6 m0 -70.98 -55.12 9.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.754 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.05 -28.5 69.64 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.711 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.13 -35.57 81.2 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.024 0.379 . . . . 10.0 112.024 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -68.79 -37.81 79.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.86 0.362 . . . . 10.0 111.195 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.431 ' HB2' ' HG3' ' A' ' 77' ' ' MET . 0.1 OUTLIER -95.29 6.77 48.13 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.471 -179.284 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 63.9 t30 55.58 46.7 22.36 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.591 0.71 . . . . 10.0 110.577 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.431 ' HG3' ' HB2' ' A' ' 75' ' ' SER . 22.1 mtm -111.1 165.67 11.7 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.324 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -98.81 154.47 17.98 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.32 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.9 tp -124.72 131.42 53.46 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.312 0.577 . . . . 10.0 110.5 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 61.8 m -113.03 96.21 5.82 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.104 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.506 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 15.9 t80 -91.31 98.47 11.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.695 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -101.37 30.76 4.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.98 0.419 . . . . 10.0 111.175 -179.052 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.506 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 43.8 mt -97.43 146.96 32.28 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.048 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -56.43 -41.63 74.13 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.943 2.429 . . . . 10.0 112.633 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 30.4 m -143.45 167.6 21.8 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.697 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.472 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 12.5 p-10 -83.9 129.04 34.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.012 -0.54 . . . . 10.0 109.636 179.111 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -105.27 136.98 43.79 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.775 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 1.3 p -76.09 155.4 34.77 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.999 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -56.74 116.43 3.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.511 -0.313 . . . . 10.0 110.179 178.865 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.2 pt -63.06 -33.88 63.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.711 -179.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 142.73 -67.48 0.46 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.471 -0.871 . . . . 10.0 113.157 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.71 -2.93 1.22 Allowed 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.838 3.025 . . . . 10.0 114.137 -179.256 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.436 HG23 ' H ' ' A' ' 93' ' ' VAL . 0.3 OUTLIER -68.7 -36.74 75.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.299 0.571 . . . . 10.0 110.274 179.577 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 22.8 m -72.64 -9.04 58.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.825 -0.625 . . . . 10.0 111.559 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.22 -1.35 56.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.499 0.666 . . . . 10.0 109.917 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.518 HD13 HD12 ' A' ' 108' ' ' LEU . 19.6 mt -106.07 105.56 18.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.261 -0.881 . . . . 10.0 109.931 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -124.95 89.59 3.09 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.148 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.9 t -121.98 153.78 38.08 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.969 0.414 . . . . 10.0 111.089 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -92.94 -7.22 46.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.722 179.321 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.1 m -103.78 116.66 32.71 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.022 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.1 p -60.59 -32.5 51.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.712 -0.222 . . . . 10.0 111.352 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -67.1 -40.79 86.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.857 0.36 . . . . 10.0 110.176 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -65.06 -41.2 95.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.11 -0.495 . . . . 10.0 109.939 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.42 -51.45 66.83 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.581 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.51 -32.47 73.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.197 0.522 . . . . 10.0 110.813 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 88.3 m -66.83 -49.21 66.49 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.575 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -69.73 -37.23 76.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.947 -0.57 . . . . 10.0 111.353 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.518 HD12 HD13 ' A' ' 96' ' ' ILE . 3.4 mp -61.47 -49.41 76.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.962 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.0 m -59.22 -30.28 68.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.556 -0.293 . . . . 10.0 111.706 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.73 -47.05 79.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.901 0.381 . . . . 10.0 111.178 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.54 HG13 ' HD1' ' A' ' 112' ' ' TYR . 3.9 p -82.26 -35.89 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.139 0.495 . . . . 10.0 111.339 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.54 ' HD1' HG13 ' A' ' 111' ' ' VAL . 3.3 m-30 -72.06 -23.9 61.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.934 -0.575 . . . . 10.0 112.469 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -51.27 -31.33 20.77 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.892 0.33 . . . . 10.0 111.892 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.81 -20.9 57.84 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.144 0.497 . . . . 10.0 111.268 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -94.69 -7.98 39.13 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.416 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 90.57 24.82 27.28 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-N 115.686 -0.688 . . . . 10.0 112.364 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.424 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 56.1 t -126.43 141.89 44.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.751 0.31 . . . . 10.0 111.0 -179.258 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 29.2 m -141.61 138.88 32.89 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 9.0 m -127.92 152.93 36.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.191 0.52 . . . . 10.0 111.872 -178.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.0 m -154.01 158.82 41.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.237 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.517 HG22 ' CD2' ' A' ' 126' ' ' LEU . 5.5 t -113.42 114.86 48.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.538 -0.912 . . . . 10.0 108.538 178.748 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 13.7 m -132.34 116.03 16.35 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.597 -0.274 . . . . 10.0 111.124 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.45 51.68 5.12 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.848 -0.614 . . . . 10.0 111.121 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.8 m120 54.95 38.09 29.89 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.05 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -141.5 132.14 25.56 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.509 -0.769 . . . . 10.0 109.164 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.517 ' CD2' HG22 ' A' ' 121' ' ' VAL . 89.8 mt -88.96 121.61 31.49 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 109.303 -0.629 . . . . 10.0 109.303 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -108.03 115.76 30.72 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.947 -179.118 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.8 t -102.98 118.65 50.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 N-CA-C 108.321 -0.992 . . . . 10.0 108.321 178.138 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -133.78 138.4 30.82 Favored Pre-proline 0 C--N 1.317 -0.809 0 CA-C-O 120.841 0.353 . . . . 10.0 110.539 -178.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.06 146.39 25.56 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.212 1.942 . . . . 10.0 111.683 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.322 -0.617 0 N-CA-C 109.736 -0.468 . . . . 10.0 109.736 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.9 t80 . . . . . 0 N--CA 1.452 -0.371 0 CA-C-O 120.705 0.288 . . . . 10.0 110.719 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 60.4 m -72.66 113.8 10.1 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.216 0.531 . . . . 10.0 109.959 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -81.14 114.0 19.68 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.091 -0.959 . . . . 10.0 109.627 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -148.17 154.68 40.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.185 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.55 107.82 14.62 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.702 -0.481 . . . . 10.0 109.702 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.472 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 21.4 p -100.1 158.21 32.44 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.96 -178.64 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.472 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 40.5 Cg_endo -66.6 -8.43 21.0 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.904 2.403 . . . . 10.0 112.421 179.745 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 26.4 mmt -90.97 -7.62 51.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.035 0.445 . . . . 10.0 110.507 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -87.9 -58.78 2.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.391 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.31 -58.4 4.91 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.418 -0.896 . . . . 10.0 113.275 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 28.9 p -121.49 168.16 12.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.044 0.449 . . . . 10.0 111.801 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.444 HD22 ' HE2' ' A' ' 112' ' ' TYR . 59.4 tp -61.81 -37.41 84.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.251 -0.886 . . . . 10.0 110.712 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -61.7 -55.12 33.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.198 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.26 -41.96 90.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.074 0.464 . . . . 10.0 111.109 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 47.8 ttp -61.0 -53.2 60.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.811 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 87.6 mt -63.67 -36.23 83.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.029 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.438 ' OE2' HD23 ' A' ' 79' ' ' LEU . 44.2 mm-40 -59.29 -44.86 92.46 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.985 -0.376 . . . . 10.0 109.985 178.807 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -63.81 -45.29 90.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.36 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 42.8 m0 -57.41 -49.08 77.37 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.54 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.87 -50.01 58.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.446 -0.797 . . . . 10.0 111.761 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.29 -45.55 87.73 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.273 0.471 . . . . 10.0 112.273 -178.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -64.17 -35.68 81.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.026 0.441 . . . . 10.0 111.237 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.6 m -90.67 5.14 49.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.044 -0.525 . . . . 10.0 111.57 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 59.75 41.4 18.37 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.093 0.473 . . . . 10.0 111.218 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.479 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 24.0 mtm -117.94 173.18 6.92 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.655 -0.702 . . . . 10.0 109.913 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -105.13 161.0 14.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.626 -0.261 . . . . 10.0 110.795 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.438 HD23 ' OE2' ' A' ' 69' ' ' GLU . 20.1 tp -132.15 134.61 45.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.375 0.607 . . . . 10.0 111.22 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 19.7 m -118.57 96.14 5.15 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.054 -0.975 . . . . 10.0 110.07 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.455 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 17.8 t80 -89.96 97.78 11.39 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.128 -0.693 . . . . 10.0 109.128 179.65 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -107.19 48.44 0.84 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.556 0.693 . . . . 10.0 110.53 -179.056 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.455 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 38.5 mt -108.31 153.96 41.66 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.206 -0.906 . . . . 10.0 109.329 179.258 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -59.33 -38.19 86.21 Favored 'Trans proline' 0 CA--C 1.529 0.239 0 C-N-CA 122.568 2.179 . . . . 10.0 112.465 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.8 m -152.15 169.67 21.86 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.08 -0.341 . . . . 10.0 110.08 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.422 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 7.7 p-10 -78.4 143.51 36.74 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.816 -0.439 . . . . 10.0 109.816 178.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -121.15 138.72 54.07 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.466 -0.334 . . . . 10.0 111.017 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.7 OUTLIER -81.61 158.93 24.18 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.394 179.301 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.62 133.77 55.37 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.047 -0.353 . . . . 10.0 110.047 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.0 pt -78.35 -29.82 15.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 112.437 0.532 . . . . 10.0 112.437 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 144.34 -64.92 0.46 Allowed Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.043 -1.075 . . . . 10.0 113.74 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -68.16 6.78 0.76 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 123.227 2.618 . . . . 10.0 113.762 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.429 ' HA ' HD12 ' A' ' 96' ' ' ILE . 2.9 t -76.88 -38.23 28.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.105 0.479 . . . . 10.0 110.115 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 41.8 m -67.69 -15.72 63.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.141 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -79.71 -9.83 59.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.149 0.499 . . . . 10.0 110.329 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.429 HD12 ' HA ' ' A' ' 93' ' ' VAL . 28.8 mt -94.78 113.51 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.8 m -139.13 93.89 2.74 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.93 -179.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 15.3 t -131.21 155.67 46.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.481 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.88 -6.34 54.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.169 0.509 . . . . 10.0 111.101 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.4 m -100.68 114.95 29.12 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.559 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.1 p -62.37 -30.92 50.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.183 -178.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -68.17 -40.85 82.17 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -67.03 -39.38 86.98 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.359 -0.608 . . . . 10.0 109.359 178.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.18 -50.33 74.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.266 178.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.63 -33.54 74.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.15 0.5 . . . . 10.0 110.396 179.14 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 97.8 m -64.5 -50.61 66.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.404 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -66.03 -44.15 85.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.85 -0.613 . . . . 10.0 110.173 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -54.2 -54.24 42.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.633 -0.712 . . . . 10.0 110.953 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.7 m -62.06 -34.71 76.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.415 -0.357 . . . . 10.0 111.74 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.73 -37.1 80.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.151 0.501 . . . . 10.0 111.133 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 16.0 t -87.87 -49.29 14.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.2 0.524 . . . . 10.0 111.023 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.445 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.4 m-30 -62.25 -23.89 66.94 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.598 0.962 . . . . 10.0 113.598 -178.09 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -54.96 -22.99 16.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.743 0.306 . . . . 10.0 111.14 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.06 -37.36 75.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.133 0.492 . . . . 10.0 110.474 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 -85.62 -23.1 27.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.46 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 107.54 30.73 3.96 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.63 -0.795 . . . . 10.0 113.034 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.445 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 86.9 t -125.09 135.5 63.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.776 0.322 . . . . 10.0 110.5 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 5.2 m -131.38 132.18 44.22 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.222 -0.444 . . . . 10.0 109.891 178.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 11.7 m -122.77 140.97 44.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.052 -178.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.0 m -145.41 163.47 34.52 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.408 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.473 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.3 t -118.59 127.75 75.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.551 -0.536 . . . . 10.0 109.551 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 20.3 m -145.58 119.33 9.23 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.7 -0.227 . . . . 10.0 111.061 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 58.39 48.6 12.07 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.206 0.602 . . . . 10.0 112.146 179.017 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.479 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 89.3 m-20 60.1 38.33 20.51 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.804 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -145.85 135.35 23.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.718 -0.674 . . . . 10.0 109.58 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.473 ' CD2' HG22 ' A' ' 121' ' ' VAL . 75.2 mt -92.27 123.34 35.53 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.189 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -106.38 116.9 32.73 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.297 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.9 t -105.73 119.67 55.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 179.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -134.78 140.14 34.39 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.824 -178.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -80.44 140.41 13.49 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 122.235 1.956 . . . . 10.0 111.275 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 3.9 m . . . . . 0 C--N 1.323 -0.574 0 C-N-CA 120.96 -0.296 . . . . 10.0 110.935 179.893 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 27.2 t80 . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 110.199 -0.297 . . . . 10.0 110.199 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 13.2 m -77.24 123.11 26.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.495 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -92.15 117.4 29.82 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -158.61 165.61 34.05 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.595 -179.344 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.817 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -78.56 124.48 28.2 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.717 -0.846 . . . . 10.0 108.717 177.781 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.431 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 44.8 p -104.86 163.48 17.1 Favored Pre-proline 0 C--N 1.313 -0.982 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.748 -178.097 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.431 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 95.6 Cg_endo -80.53 12.26 2.63 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 121.787 1.658 . . . . 10.0 112.074 178.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 21.4 ptm -112.32 -18.35 12.52 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.76 -62.89 1.19 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.835 0.35 . . . . 10.0 111.517 -179.022 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.0 -49.37 1.4 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.511 -0.852 . . . . 10.0 112.129 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 32.5 p -130.74 168.92 16.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 117.028 0.414 . . . . 10.0 110.511 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.55 HD13 ' HE2' ' A' ' 112' ' ' TYR . 59.8 tp -57.49 -44.77 85.23 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.271 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -59.23 -53.49 57.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.835 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -33.32 71.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.482 -0.326 . . . . 10.0 111.677 -179.299 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 51.3 ttp -69.23 -49.96 51.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.101 0.477 . . . . 10.0 110.042 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.4 mt -65.11 -33.9 77.12 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.655 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -61.34 -39.77 91.79 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 178.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -65.89 -42.14 90.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.005 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 43.0 m0 -62.46 -51.85 65.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.174 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.441 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -63.0 -44.99 94.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.57 -0.741 . . . . 10.0 111.838 -179.618 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.02 -47.83 84.6 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 111.796 0.295 . . . . 10.0 111.796 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.04 -20.23 62.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.912 0.387 . . . . 10.0 111.36 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.5 t -96.93 -1.81 45.0 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.317 -0.402 . . . . 10.0 110.738 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 9.8 m120 60.44 41.39 16.03 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.525 0.679 . . . . 10.0 110.172 -179.043 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 26.8 mtm -121.17 168.82 11.16 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.303 -0.862 . . . . 10.0 110.453 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -98.42 160.52 14.23 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.084 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 34.5 tp -129.44 134.15 47.68 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.78 0.324 . . . . 10.0 110.577 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.475 ' HB2' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -121.14 97.37 5.49 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.027 179.157 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.574 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 20.6 t80 -84.12 98.22 9.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.556 -0.747 . . . . 10.0 109.587 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.51 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 84.8 m-20 -100.38 37.54 1.66 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.073 0.463 . . . . 10.0 110.462 -179.156 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.574 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 26.6 mt -103.42 150.83 38.4 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 116.062 -0.517 . . . . 10.0 109.868 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -64.65 -34.48 51.25 Favored 'Trans proline' 0 CA--C 1.531 0.326 0 C-N-CA 122.579 2.186 . . . . 10.0 112.939 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.9 m -148.05 172.68 13.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.666 0.27 . . . . 10.0 110.752 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -83.88 130.99 34.9 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.273 -0.64 . . . . 10.0 109.273 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -114.78 149.84 36.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.964 0.411 . . . . 10.0 111.309 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.96 169.46 11.2 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.219 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.62 129.7 38.21 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 178.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 pt -67.1 -28.55 43.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 112.084 0.401 . . . . 10.0 112.084 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 145.8 -70.75 0.36 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.525 -0.845 . . . . 10.0 112.905 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.92 5.14 0.68 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.237 2.625 . . . . 10.0 113.435 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 3.8 t -67.68 -39.23 81.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.034 0.445 . . . . 10.0 110.185 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.817 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 9.1 m -68.19 -11.06 58.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.375 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -88.77 -6.68 57.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.889 0.376 . . . . 10.0 110.628 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 42.1 mt -93.93 107.52 19.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 N-CA-C 109.156 -0.683 . . . . 10.0 109.156 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.0 m -141.17 104.74 4.69 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.4 t -132.42 157.2 45.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.107 -0.497 . . . . 10.0 109.785 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.78 -11.71 47.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.848 0.356 . . . . 10.0 111.613 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.6 m -98.38 118.57 35.34 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.212 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.46 -32.69 54.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.748 0.309 . . . . 10.0 111.342 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -66.93 -43.2 83.88 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -66.91 -40.31 87.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.769 179.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.08 -46.72 75.48 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.364 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.01 -36.36 84.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.166 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 39.0 m -64.85 -50.64 65.84 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.886 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -66.12 -44.43 84.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.398 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.439 ' HB3' ' CG2' ' A' ' 119' ' ' VAL . 3.2 tp -58.07 -48.1 81.17 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 120.945 0.402 . . . . 10.0 110.165 179.201 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 70.4 m -61.46 -31.2 71.16 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.686 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.4 -39.45 94.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.15 0.5 . . . . 10.0 110.953 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.1 t -86.91 -34.91 7.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.926 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.55 ' HE2' HD13 ' A' ' 64' ' ' LEU . 3.6 m-30 -79.75 -23.87 41.95 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 113.576 0.954 . . . . 10.0 113.576 -177.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.46 -42.23 42.56 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.059 0.392 . . . . 10.0 112.059 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.36 -21.91 62.84 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.032 0.444 . . . . 10.0 111.336 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -87.83 -12.83 43.81 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.591 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 96.46 18.71 29.83 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.954 -0.641 . . . . 10.0 112.392 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.462 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 57.6 t -123.52 137.37 56.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.881 0.372 . . . . 10.0 111.005 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.1 m -138.52 122.3 17.61 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.543 -0.539 . . . . 10.0 109.543 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.439 ' CG2' ' HB3' ' A' ' 108' ' ' LEU . 6.0 m -107.16 139.56 28.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.941 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 37.2 m -149.58 144.02 25.95 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.409 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 2.1 p -106.08 122.24 59.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 44.7 m -140.4 124.34 17.4 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.415 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 62.73 46.58 5.16 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.68 0.613 . . . . 10.0 110.839 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 20.3 m-20 54.02 40.78 31.97 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.823 0.821 . . . . 10.0 110.394 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.472 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 57.2 tttt -143.08 129.06 19.57 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.809 -1.087 . . . . 10.0 108.929 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.441 HD12 ' HB2' ' A' ' 72' ' ' ALA . 21.7 mt -88.45 122.22 31.69 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.475 HD22 ' HB2' ' A' ' 80' ' ' SER . 14.8 mt -114.25 134.18 55.11 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 120.971 0.415 . . . . 10.0 110.52 -178.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.51 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 2.5 t -111.39 119.03 58.88 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 108.293 -1.003 . . . . 10.0 108.293 178.115 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -125.63 135.88 27.57 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-O 120.776 0.322 . . . . 10.0 110.969 -178.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -79.72 134.83 11.12 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.194 1.929 . . . . 10.0 111.682 178.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.8 m . . . . . 0 C--N 1.321 -0.636 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.61 179.841 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.6 t80 . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 120.943 0.401 . . . . 10.0 111.039 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.5 m -87.1 117.73 26.02 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.414 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -83.3 123.53 29.71 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.385 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -155.53 149.76 25.8 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.047 -0.524 . . . . 10.0 109.969 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.476 ' HB2' ' SD ' ' A' ' 67' ' ' MET . . . -84.8 130.22 34.71 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.786 0.327 . . . . 10.0 110.529 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 48.0 p -107.74 153.72 41.35 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.052 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.55 5.92 2.18 Favored 'Trans proline' 0 CA--C 1.53 0.308 0 C-N-CA 122.386 2.058 . . . . 10.0 111.819 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.3 mtt -105.97 -12.42 15.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.752 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -69.05 -52.04 32.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.019 0.437 . . . . 10.0 110.505 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 97.74 -68.46 0.75 Allowed Glycine 0 N--CA 1.444 -0.806 0 C-N-CA 120.511 -0.852 . . . . 10.0 112.816 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.433 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 67.6 p -126.83 170.34 12.3 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.084 0.469 . . . . 10.0 112.199 -178.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 54.1 tp -57.38 -43.06 83.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.898 -1.046 . . . . 10.0 110.764 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -59.94 -52.44 65.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.945 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -43.05 91.5 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.256 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.476 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 50.8 ttp -63.36 -52.33 62.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.69 -0.686 . . . . 10.0 111.117 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.426 ' HB3' HD13 ' A' ' 79' ' ' LEU . 74.9 mt -62.51 -36.78 83.65 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.31 -0.404 . . . . 10.0 111.24 -179.495 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -60.01 -44.01 94.84 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.7 ttm180 -65.27 -41.76 93.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.467 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 42.7 m0 -61.48 -50.2 73.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.567 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -68.41 -36.6 79.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.702 -179.289 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.1 -41.1 87.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.518 -0.31 . . . . 10.0 111.813 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -56.28 -39.56 72.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.572 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.415 ' HB2' ' HG3' ' A' ' 77' ' ' MET . 67.7 m -101.8 14.09 32.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.447 -0.342 . . . . 10.0 111.792 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 54.99 38.08 29.94 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.068 0.461 . . . . 10.0 111.252 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.415 ' HG3' ' HB2' ' A' ' 75' ' ' SER . 11.8 mtm -95.88 173.15 7.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.931 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.465 ' HB2' ' HG3' ' A' ' 125' ' ' LYS . 14.0 mt-30 -103.88 156.42 17.85 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.945 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.426 HD13 ' HB3' ' A' ' 68' ' ' LEU . 23.8 tp -128.52 132.79 48.31 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.089 0.471 . . . . 10.0 110.186 178.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.44 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 75.6 m -120.16 97.16 5.46 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.398 -0.819 . . . . 10.0 110.852 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.564 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 9.0 t80 -87.03 98.5 11.31 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.848 -0.614 . . . . 10.0 110.283 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.531 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 37.0 m-80 -99.83 21.97 11.77 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.07 0.462 . . . . 10.0 110.701 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.564 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 41.8 mt -90.27 141.5 27.66 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.672 179.354 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -61.88 -34.1 82.7 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.695 2.264 . . . . 10.0 112.82 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -138.95 165.63 26.59 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.872 0.368 . . . . 10.0 110.951 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.433 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 6.5 m-20 -86.44 136.62 33.04 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -119.22 140.03 50.9 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.252 -0.579 . . . . 10.0 111.496 -179.155 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.433 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.8 OUTLIER -79.92 158.13 26.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.06 179.405 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.45 122.63 15.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.988 0.423 . . . . 10.0 110.313 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.7 pt -62.5 -30.77 49.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.788 -0.642 . . . . 10.0 111.878 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 140.64 -65.76 0.51 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.452 -0.88 . . . . 10.0 113.152 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -60.88 -5.55 4.84 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.37 2.713 . . . . 10.0 113.604 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.431 ' H ' HG23 ' A' ' 93' ' ' VAL . 1.6 t -64.16 -39.26 84.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.277 0.561 . . . . 10.0 109.91 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 66.0 m -71.72 -6.14 39.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.419 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.2 -8.42 39.36 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.27 0.557 . . . . 10.0 110.156 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.512 HD13 HD12 ' A' ' 108' ' ' LEU . 56.2 mt -92.74 109.49 21.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.16 -0.682 . . . . 10.0 109.16 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -131.72 95.37 3.71 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.016 -178.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.8 t -131.1 156.25 45.56 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.869 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.49 -10.52 43.35 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 121.13 0.49 . . . . 10.0 110.311 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 29.6 t -96.01 118.54 32.81 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.351 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 11.0 p -64.22 -30.23 49.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.088 0.47 . . . . 10.0 110.295 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -69.77 -44.62 69.76 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.49 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -63.18 -41.62 99.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.868 179.289 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.46 -49.38 76.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.607 179.167 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.28 -37.26 84.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.069 0.461 . . . . 10.0 110.488 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 91.1 m -64.94 -48.79 72.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.544 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -64.63 -40.76 96.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.934 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.512 HD12 HD13 ' A' ' 96' ' ' ILE . 3.0 mp -60.71 -53.97 50.93 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 116.153 -0.476 . . . . 10.0 109.85 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.8 m -55.85 -30.83 62.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.579 0.228 . . . . 10.0 111.54 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.32 -44.12 92.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.767 0.318 . . . . 10.0 111.098 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.475 HG13 ' HD1' ' A' ' 112' ' ' TYR . 8.7 p -90.15 -21.85 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 121.008 0.432 . . . . 10.0 111.929 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.475 ' HD1' HG13 ' A' ' 111' ' ' VAL . 6.3 m-85 -82.41 -25.04 34.05 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.461 0.541 . . . . 10.0 112.461 -179.283 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -52.68 -33.7 48.55 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.119 0.414 . . . . 10.0 112.119 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.422 ' HB3' ' NE2' ' A' ' 115' ' ' GLN . . . -65.48 -25.64 67.58 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.811 0.339 . . . . 10.0 111.383 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' GLN . . . . . 0.422 ' NE2' ' HB3' ' A' ' 114' ' ' ALA . 3.6 mp0 -92.07 -19.9 21.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.191 0.519 . . . . 10.0 109.682 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.82 30.27 6.17 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.496 -0.775 . . . . 10.0 112.428 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 94.4 t -125.83 140.05 49.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.899 0.381 . . . . 10.0 110.753 -179.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 9.5 m -137.03 131.8 33.34 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.16 -0.473 . . . . 10.0 109.821 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 127' ' ' LEU . 6.4 m -122.95 140.01 47.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.014 0.435 . . . . 10.0 111.165 -178.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.6 m -144.69 163.55 33.66 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.504 -0.316 . . . . 10.0 110.517 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.525 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.2 t -116.65 115.19 48.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.414 -0.588 . . . . 10.0 109.414 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 19.9 m -136.39 116.65 13.55 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.608 -0.269 . . . . 10.0 110.728 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 59.0 54.25 5.12 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.716 -0.675 . . . . 10.0 111.768 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 55.42 33.53 21.11 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.763 -0.653 . . . . 10.0 111.569 179.434 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.465 ' HG3' ' HB2' ' A' ' 78' ' ' GLN . 19.4 tttt -138.83 130.79 27.96 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.382 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.525 ' CD2' HG22 ' A' ' 121' ' ' VAL . 91.1 mt -89.6 121.82 32.16 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.873 -0.788 . . . . 10.0 108.873 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.425 ' O ' ' HA ' ' A' ' 119' ' ' VAL . 4.0 mm? -103.01 115.68 31.07 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.872 -178.825 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.531 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 3.6 t -105.93 117.82 52.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 107.57 -1.27 . . . . 10.0 107.57 177.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -136.42 142.83 40.95 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-O 120.699 0.285 . . . . 10.0 111.186 -178.365 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -81.54 130.56 7.0 Favored 'Trans proline' 0 N--CA 1.451 -0.981 0 C-N-CA 122.269 1.979 . . . . 10.0 111.028 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 1.7 m . . . . . 0 C--N 1.316 -0.856 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.547 -179.586 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.1 t80 . . . . . 0 N--CA 1.452 -0.348 0 CA-C-O 120.724 0.297 . . . . 10.0 110.412 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.5 m -77.24 115.56 17.12 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.568 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.51 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 93.0 m-85 -85.87 115.72 23.68 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.915 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.415 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 10.7 pt20 -146.36 160.32 42.2 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.52 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.427 ' HB2' ' SD ' ' A' ' 67' ' ' MET . . . -92.7 114.81 27.47 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.158 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.9 p -97.09 153.91 38.33 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 116.408 -0.36 . . . . 10.0 110.836 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -65.42 -16.43 54.18 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.399 2.066 . . . . 10.0 111.638 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 19.0 ptt? -86.2 -6.5 58.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.701 -0.681 . . . . 10.0 110.682 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -79.44 -56.99 3.92 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.187 -0.671 . . . . 10.0 109.187 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 92.86 -69.07 1.69 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.849 -0.691 . . . . 10.0 113.229 178.163 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 35.5 p -118.91 166.22 13.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.179 0.514 . . . . 10.0 111.993 -178.427 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.523 HD13 ' CE2' ' A' ' 112' ' ' TYR . 61.4 tp -56.64 -40.69 75.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.852 -1.067 . . . . 10.0 111.06 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -61.53 -51.98 66.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.716 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.97 -40.29 95.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.004 0.43 . . . . 10.0 111.318 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.427 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 54.4 ttp -62.2 -53.67 51.89 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.131 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.7 mt -63.82 -33.65 76.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.024 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.11 -43.24 91.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.327 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.3 ttm-85 -67.7 -44.31 78.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.481 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 40.2 m0 -56.65 -52.3 65.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.037 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.77 -45.42 82.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.555 -179.268 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.92 -40.54 93.56 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.736 0.303 . . . . 10.0 111.62 -179.217 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -60.62 -41.85 95.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.163 -0.472 . . . . 10.0 111.425 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 20.0 m -98.94 12.32 36.25 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.229 0.455 . . . . 10.0 112.229 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 57.66 41.14 25.88 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.371 0.605 . . . . 10.0 111.389 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 60.3 mtp -104.27 173.48 6.29 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.023 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -104.94 158.06 16.79 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.511 -0.313 . . . . 10.0 110.769 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 19.8 tp -129.5 136.24 49.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.412 0.625 . . . . 10.0 111.577 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.463 ' HB2' ' HG ' ' A' ' 127' ' ' LEU . 1.8 m -124.22 95.34 4.51 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.036 -0.984 . . . . 10.0 109.525 179.153 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.524 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 12.6 t80 -91.79 97.88 11.27 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.537 -0.542 . . . . 10.0 109.537 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 38.9 m-80 -101.26 31.33 3.73 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.149 0.499 . . . . 10.0 111.065 -178.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.524 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 64.2 mt -96.03 140.54 22.32 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.59 -30.83 93.13 Favored 'Trans proline' 0 N--CA 1.466 -0.137 0 C-N-CA 122.778 2.319 . . . . 10.0 112.187 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 17.0 m -149.88 170.5 18.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.224 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.463 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 4.9 p-10 -87.06 147.28 25.75 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.953 -0.567 . . . . 10.0 109.699 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -124.55 141.22 52.25 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.71 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -83.9 151.15 25.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.093 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -56.05 120.77 8.0 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.125 178.985 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 pt -67.96 -29.62 45.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 112.567 0.58 . . . . 10.0 112.567 -179.201 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.421 ' H ' HG23 ' A' ' 93' ' ' VAL . . . 140.35 -65.27 0.52 Allowed Glycine 0 CA--C 1.521 0.427 0 C-N-CA 120.577 -0.82 . . . . 10.0 112.789 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.59 -0.85 2.72 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.913 2.409 . . . . 10.0 112.89 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.421 HG23 ' H ' ' A' ' 91' ' ' GLY . 2.0 t -67.34 -38.21 80.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.118 0.485 . . . . 10.0 109.907 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 74.3 m -68.83 -11.69 60.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.543 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -84.16 -6.75 59.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.164 0.507 . . . . 10.0 110.064 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.415 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 34.8 mt -94.76 105.25 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-N 115.782 -0.645 . . . . 10.0 109.6 179.617 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.0 m -139.5 96.02 3.02 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.374 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.0 t -131.32 156.32 45.69 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.59 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.54 -13.41 51.89 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.085 0.469 . . . . 10.0 110.753 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.9 t -94.49 114.69 26.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.105 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.51 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 9.3 p -65.07 -30.99 52.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.993 0.425 . . . . 10.0 109.943 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -67.78 -43.27 80.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.79 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -66.79 -40.38 88.1 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.272 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.92 -50.81 67.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.751 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.93 -31.51 72.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.918 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 54.4 m -66.69 -45.42 78.89 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.156 0.503 . . . . 10.0 110.395 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -71.23 -41.33 70.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.714 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 19.2 mt -58.07 -48.66 79.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 10.0 111.391 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.434 ' O ' ' HB2' ' A' ' 113' ' ' ALA . 4.9 p -62.83 -22.79 66.9 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.038 0.384 . . . . 10.0 112.038 -179.003 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.77 -43.71 45.14 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.282 0.563 . . . . 10.0 110.494 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 13.6 t -78.96 -32.52 15.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 121.58 0.705 . . . . 10.0 110.707 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.523 ' CE2' HD13 ' A' ' 64' ' ' LEU . 3.1 m-85 -81.16 -21.94 39.33 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.28 -0.873 . . . . 10.0 112.574 -178.823 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.434 ' HB2' ' O ' ' A' ' 109' ' ' SER . . . -52.84 -27.95 20.63 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.772 0.286 . . . . 10.0 111.772 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.4 -21.36 61.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.073 0.463 . . . . 10.0 111.123 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -95.44 -25.99 16.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.981 -0.554 . . . . 10.0 109.691 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 107.41 34.06 2.99 Favored Glycine 0 N--CA 1.448 -0.539 0 CA-C-N 115.62 -0.718 . . . . 10.0 112.291 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.472 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 72.2 t -128.87 128.07 67.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.682 0.277 . . . . 10.0 111.104 -179.443 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.4 m -123.47 104.29 8.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.21 0.529 . . . . 10.0 110.179 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.47 HG12 HG13 ' A' ' 128' ' ' VAL . 5.2 m -94.23 139.7 17.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.924 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -147.11 152.49 38.56 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.045 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.433 HG22 ' CD2' ' A' ' 126' ' ' LEU . 2.9 t -110.12 120.69 61.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 17.5 m -136.91 115.87 12.32 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.544 -0.298 . . . . 10.0 111.103 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 63.21 48.56 3.64 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.669 -0.696 . . . . 10.0 111.523 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 16.0 t30 60.73 23.54 13.42 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.082 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 40.9 tttt -126.74 131.0 51.43 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.475 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.433 ' CD2' HG22 ' A' ' 121' ' ' VAL . 95.2 mt -88.09 121.62 30.71 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 108.822 -0.807 . . . . 10.0 108.822 179.315 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.463 ' HG ' ' HB2' ' A' ' 80' ' ' SER . 0.3 OUTLIER -117.46 119.52 35.31 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.201 0.524 . . . . 10.0 111.035 -179.031 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.515 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 2.8 t -102.89 119.67 51.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 CA-C-N 115.644 -0.707 . . . . 10.0 109.104 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -127.66 132.99 24.62 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-O 120.909 0.385 . . . . 10.0 110.815 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.53 132.44 12.22 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 122.7 2.266 . . . . 10.0 112.554 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 1.1 m . . . . . 0 C--N 1.32 -0.677 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.053 179.598 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 16.1 t80 . . . . . 0 N--CA 1.452 -0.344 0 CA-C-O 120.964 0.412 . . . . 10.0 111.235 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.8 m -87.72 113.79 23.73 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.093 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -80.47 108.55 14.19 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.095 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.444 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 16.6 pt20 -141.99 159.56 41.98 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.886 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.637 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -92.92 126.97 38.26 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.03 -0.532 . . . . 10.0 109.842 178.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.404 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 16.2 p -118.31 158.86 45.57 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 116.115 -0.493 . . . . 10.0 109.972 -179.567 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.404 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 56.1 Cg_endo -72.04 -0.96 9.3 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 122.183 1.922 . . . . 10.0 111.495 178.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 68.5 mtm -90.31 -26.83 19.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.444 -0.798 . . . . 10.0 110.259 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -65.79 -50.08 66.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.964 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.43 -66.11 1.77 Allowed Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.589 -0.815 . . . . 10.0 113.153 178.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 29.9 p -125.35 173.93 8.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.143 0.497 . . . . 10.0 111.86 -178.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 46.1 tp -62.75 -41.22 99.1 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.006 -0.997 . . . . 10.0 110.491 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -61.31 -54.74 40.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.841 -179.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.92 -42.09 84.04 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.402 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 57.3 ttp -61.2 -51.5 68.73 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.488 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 86.4 mt -64.03 -38.04 89.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.116 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -60.34 -44.8 95.17 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 120.853 0.359 . . . . 10.0 110.311 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.0 mtp85 -68.98 -42.16 76.9 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.44 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 31.2 m0 -55.69 -48.54 74.92 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.43 0.633 . . . . 10.0 109.863 178.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.504 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -68.55 -51.84 38.52 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.158 -0.928 . . . . 10.0 111.613 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.27 -46.28 72.63 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.057 0.391 . . . . 10.0 112.057 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -60.75 -40.19 91.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.94 0.4 . . . . 10.0 111.571 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.4 m -93.14 9.71 34.8 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.887 -178.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 56.14 48.25 17.86 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.482 0.658 . . . . 10.0 110.45 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 81.1 mtp -116.2 173.54 6.53 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.047 -0.979 . . . . 10.0 109.88 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -108.83 160.74 15.74 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.433 -0.348 . . . . 10.0 110.228 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 19.9 tp -133.71 143.0 48.23 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.291 0.567 . . . . 10.0 110.773 -179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.474 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 31.7 m -127.91 96.06 4.38 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.042 -0.981 . . . . 10.0 109.595 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.521 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 13.8 t80 -93.02 98.16 11.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.441 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -98.64 22.07 10.45 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.075 0.464 . . . . 10.0 111.159 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.521 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 48.0 mt -88.01 143.59 33.37 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 109.565 -0.532 . . . . 10.0 109.565 179.324 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -61.71 -30.79 85.66 Favored 'Trans proline' 0 N--CA 1.465 -0.162 0 C-N-CA 122.633 2.222 . . . . 10.0 112.881 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.3 m -148.27 167.73 24.39 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.608 -0.269 . . . . 10.0 110.576 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.451 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 3.8 p-10 -83.47 146.16 28.55 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.57 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -129.16 149.56 50.91 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 110.241 -0.281 . . . . 10.0 110.241 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.58 169.95 11.28 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.79 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -74.19 144.28 44.84 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.813 -0.44 . . . . 10.0 109.813 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.7 pt -83.64 -36.15 12.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.337 -0.392 . . . . 10.0 111.71 -179.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 155.07 -67.92 0.3 Allowed Glycine 0 N--CA 1.453 -0.19 0 C-N-CA 120.297 -0.954 . . . . 10.0 113.13 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.5 -12.13 13.11 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 123.395 2.73 . . . . 10.0 113.468 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.402 HG23 ' H ' ' A' ' 93' ' ' VAL . 2.9 t -63.75 -39.49 85.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.028 0.442 . . . . 10.0 110.357 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.637 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.3 m -69.08 -7.53 36.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.843 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.99 -3.28 48.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.035 0.445 . . . . 10.0 110.604 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.444 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 52.2 mt -95.79 113.47 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.74 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.0 m -141.98 91.52 2.36 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.34 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 11.9 t -129.97 155.8 45.5 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.299 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.81 -10.77 54.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.037 0.446 . . . . 10.0 111.071 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.5 t -93.54 113.26 25.34 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.776 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.25 -28.94 45.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.054 0.454 . . . . 10.0 110.439 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 61.7 mt-30 -70.51 -39.64 73.98 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.013 -0.539 . . . . 10.0 109.81 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLN . . . . . 0.427 ' O ' ' HB ' ' A' ' 106' ' ' THR . 53.7 tp60 -69.99 -41.0 74.96 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.047 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.99 -50.03 73.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.51 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.47 -30.75 71.82 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.367 179.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.427 ' HB ' ' O ' ' A' ' 103' ' ' GLN . 55.5 m -64.34 -51.07 65.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.824 -0.625 . . . . 10.0 110.811 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -68.09 -39.75 82.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.153 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.449 ' HB3' HG21 ' A' ' 119' ' ' VAL . 1.6 mp -60.95 -50.9 71.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.126 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 13.0 p -63.54 -31.93 73.24 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.102 -0.239 . . . . 10.0 111.247 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.23 -40.79 98.44 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.146 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.587 HG13 ' HD1' ' A' ' 112' ' ' TYR . 12.0 p -89.28 -24.31 5.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 120.945 0.403 . . . . 10.0 111.942 -179.233 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.587 ' HD1' HG13 ' A' ' 111' ' ' VAL . 3.4 m-30 -83.35 -24.26 32.15 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.575 0.954 . . . . 10.0 113.575 -179.07 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.04 -32.62 15.91 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.64 -18.94 62.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.903 0.382 . . . . 10.0 111.386 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -98.03 -0.26 44.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.021 0.439 . . . . 10.0 110.182 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.85 21.25 56.25 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.975 -0.631 . . . . 10.0 112.887 179.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 92.5 t -121.49 128.64 75.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.805 0.336 . . . . 10.0 110.554 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.9 m -126.96 104.17 7.86 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.982 0.42 . . . . 10.0 110.728 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.659 HG12 HG13 ' A' ' 128' ' ' VAL . 27.7 m -94.59 148.26 5.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.012 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 18.9 m -154.62 175.89 13.09 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.887 -0.783 . . . . 10.0 108.887 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 13.9 p -142.62 125.77 14.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 121.526 0.679 . . . . 10.0 110.268 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 19.6 m -113.25 108.31 17.09 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.246 -0.888 . . . . 10.0 109.36 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 64.57 -89.61 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 O-C-N 123.755 0.66 . . . . 10.0 111.346 -179.373 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.9 m-20 -132.76 23.96 4.31 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.188 0.518 . . . . 10.0 109.843 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.474 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 38.6 tttt -125.72 127.91 46.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.032 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.504 HD12 ' HB2' ' A' ' 72' ' ' ALA . 36.0 mt -87.31 122.28 30.87 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.463 -0.939 . . . . 10.0 108.463 178.701 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -107.12 115.58 30.43 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.179 0.514 . . . . 10.0 111.121 -178.206 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.659 HG13 HG12 ' A' ' 119' ' ' VAL . 5.7 t -112.4 117.91 56.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 108.268 -1.012 . . . . 10.0 108.268 178.324 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -137.66 143.33 40.13 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-O 120.602 0.239 . . . . 10.0 110.456 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -81.03 142.53 13.76 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.519 2.146 . . . . 10.0 111.932 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 3.3 m . . . . . 0 C--N 1.32 -0.696 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.14 179.184 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 27.5 t80 . . . . . 0 N--CA 1.454 -0.227 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.6 m -79.83 121.02 24.88 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.86 0.362 . . . . 10.0 111.032 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -90.99 111.64 23.19 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.631 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -146.08 147.83 32.0 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.847 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.493 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -81.7 115.25 20.86 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.362 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 73.2 p -96.61 152.23 38.43 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.24 -0.436 . . . . 10.0 109.873 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.93 -18.38 64.66 Favored 'Trans proline' 0 CA--C 1.527 0.159 0 C-N-CA 122.225 1.95 . . . . 10.0 112.041 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.0 ptt? -89.6 2.92 54.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.515 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.604 ' HA ' ' NH1' ' A' ' 70' ' ' ARG . 28.9 m-20 -82.09 -52.21 7.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.262 0.553 . . . . 10.0 109.808 178.965 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.08 -66.98 2.97 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.534 -0.757 . . . . 10.0 113.697 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.5 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 24.4 p -122.34 165.92 15.51 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.663 0.616 . . . . 10.0 112.663 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.518 HD13 ' CE2' ' A' ' 112' ' ' TYR . 33.2 tp -62.42 -42.05 99.16 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.819 -1.082 . . . . 10.0 111.143 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 51.8 tttt -57.99 -55.37 35.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.739 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.6 m -59.63 -41.22 89.96 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.155 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 57.6 ttp -63.54 -52.53 60.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.856 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 70.8 mt -62.1 -40.24 95.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.369 -0.378 . . . . 10.0 111.286 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -60.54 -43.39 97.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.312 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.604 ' NH1' ' HA ' ' A' ' 61' ' ' ASP . 97.2 mtt180 -66.85 -42.5 85.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.225 179.287 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -58.83 -54.13 50.58 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.605 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.96 -40.16 96.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.687 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.11 -40.74 94.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.771 0.32 . . . . 10.0 111.311 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.69 -21.14 64.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.408 -179.471 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.408 ' HB2' ' SD ' ' A' ' 77' ' ' MET . 1.5 m -109.35 7.09 24.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.526 -0.306 . . . . 10.0 111.706 -179.079 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 61.4 t30 56.46 48.22 17.26 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.837 0.827 . . . . 10.0 110.655 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.408 ' SD ' ' HB2' ' A' ' 75' ' ' SER . 72.7 mtp -116.89 173.19 6.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.16 -0.927 . . . . 10.0 110.128 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.424 ' HB3' ' HE3' ' A' ' 125' ' ' LYS . 29.3 mm-40 -106.1 159.48 16.04 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.969 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.7 tp -134.8 138.77 44.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.319 0.581 . . . . 10.0 111.669 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.426 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 1.4 m -123.74 96.59 5.02 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.08 179.159 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.625 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 8.7 t80 -91.65 102.82 15.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.864 -178.828 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.482 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 37.1 m-80 -104.85 33.49 3.59 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.009 0.433 . . . . 10.0 110.908 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.528 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 55.6 mt -102.94 146.88 33.23 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.018 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.97 -34.54 94.98 Favored 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.735 2.29 . . . . 10.0 112.321 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.3 m -152.5 166.59 31.51 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.36 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.625 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 9.5 p-10 -84.92 128.75 34.76 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 178.511 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -100.39 136.99 39.42 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.18 -178.613 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.5 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.9 OUTLIER -72.59 154.99 40.5 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.518 179.181 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.11 114.84 3.34 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 179.267 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.3 pt -59.74 -32.83 50.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -178.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 149.26 -70.75 0.31 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.578 -0.82 . . . . 10.0 112.66 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.14 -4.69 3.21 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.511 2.807 . . . . 10.0 113.48 -179.367 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.414 HG23 ' H ' ' A' ' 93' ' ' VAL . 2.9 t -64.97 -36.04 76.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.308 0.575 . . . . 10.0 110.236 179.349 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.493 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.7 OUTLIER -67.22 -14.14 62.63 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.544 -0.753 . . . . 10.0 111.677 -179.342 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -87.67 1.56 53.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.876 0.37 . . . . 10.0 111.1 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 40.3 mt -98.51 110.28 25.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.1 t -141.12 93.99 2.65 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.543 -178.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.8 t -132.19 156.78 45.83 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.511 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -89.5 -13.69 36.91 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.052 0.453 . . . . 10.0 110.791 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.5 114.06 26.34 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.336 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.5 p -62.2 -33.83 60.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.832 0.348 . . . . 10.0 110.854 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -64.18 -39.38 93.87 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.122 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -72.53 -42.1 65.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.305 -0.407 . . . . 10.0 109.999 179.176 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.77 -51.09 66.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.91 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.74 -33.08 74.85 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.958 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 95.9 m -67.59 -47.12 70.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.669 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.406 ' O ' HG23 ' A' ' 111' ' ' VAL . 14.4 mt-10 -66.26 -40.08 89.9 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.262 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.402 ' O ' ' HB2' ' A' ' 112' ' ' TYR . 30.7 mt -61.24 -49.6 76.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.934 179.243 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.429 ' O ' ' HB2' ' A' ' 113' ' ' ALA . 4.6 p -64.17 -22.14 66.82 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 111.765 0.283 . . . . 10.0 111.765 -179.217 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.49 -46.82 52.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.09 0.471 . . . . 10.0 110.311 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 107' ' ' GLU . 4.7 t -75.78 -47.74 32.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.678 0.752 . . . . 10.0 110.334 179.72 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.518 ' CE2' HD13 ' A' ' 64' ' ' LEU . 3.6 m-30 -64.33 -21.11 66.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.928 -1.033 . . . . 10.0 113.254 -178.635 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.429 ' HB2' ' O ' ' A' ' 109' ' ' SER . . . -52.18 -28.55 18.64 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.806 0.298 . . . . 10.0 111.806 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.12 -23.72 54.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.148 0.499 . . . . 10.0 111.101 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 17.8 mp0 -89.75 -6.92 55.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.298 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 89.11 27.38 23.53 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.72 -0.752 . . . . 10.0 111.994 -179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.453 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 97.0 t -127.8 134.51 65.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.849 0.357 . . . . 10.0 110.605 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 14.4 m -136.16 105.15 5.91 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.267 0.556 . . . . 10.0 110.614 179.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.518 HG12 HG13 ' A' ' 128' ' ' VAL . 13.2 m -97.45 150.09 4.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.522 -0.763 . . . . 10.0 111.145 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 15.1 m -155.66 170.82 21.13 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.366 -0.605 . . . . 10.0 109.366 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.432 HG22 ' CD2' ' A' ' 126' ' ' LEU . 2.8 t -120.96 129.47 75.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 179.158 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 25.3 m -145.25 117.32 8.32 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.717 0.294 . . . . 10.0 111.268 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.56 50.68 5.59 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.551 -0.749 . . . . 10.0 111.901 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 30.5 t30 59.48 25.86 14.72 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.394 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.426 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 56.7 tttt -131.54 137.64 48.57 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.432 ' CD2' HG22 ' A' ' 121' ' ' VAL . 97.3 mt -87.91 122.16 31.2 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.116 -0.698 . . . . 10.0 109.116 179.4 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -103.91 115.76 31.05 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.317 -178.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.518 HG13 HG12 ' A' ' 119' ' ' VAL . 10.6 t -108.54 118.22 55.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 N-CA-C 108.552 -0.907 . . . . 10.0 108.552 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -137.71 139.64 27.41 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.436 -178.65 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -79.13 154.4 25.29 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.736 2.29 . . . . 10.0 112.098 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.32 -0.676 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.074 179.049 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.2 t80 . . . . . 0 N--CA 1.455 -0.196 0 CA-C-O 120.94 0.4 . . . . 10.0 111.329 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.7 m -84.39 117.74 23.81 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.143 178.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.437 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 93.0 m-85 -84.99 116.18 23.24 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.006 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -153.08 146.88 25.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.142 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.407 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -81.11 136.63 35.94 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.904 -0.406 . . . . 10.0 109.904 179.169 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 80.3 p -119.52 157.91 50.52 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 116.341 -0.391 . . . . 10.0 110.354 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -68.61 -8.16 22.43 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.405 2.07 . . . . 10.0 111.802 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 60.3 mtt -84.72 -17.36 38.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.496 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -73.27 -49.21 28.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.47 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.62 -61.64 4.54 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.871 -0.68 . . . . 10.0 112.413 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.438 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 24.4 p -121.55 170.37 9.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.872 0.368 . . . . 10.0 111.085 -179.658 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.437 ' O ' HD22 ' A' ' 64' ' ' LEU . 1.7 tm? -67.15 -39.09 86.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.226 179.431 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.41 -55.14 38.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.129 179.517 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.9 m -65.09 -27.47 68.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.238 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.403 ' HB2' ' O ' ' A' ' 63' ' ' THR . 9.7 tmm? -69.78 -55.27 10.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.371 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 43.0 mt -64.53 -32.74 74.52 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.669 0.271 . . . . 10.0 111.087 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -60.5 -39.06 86.38 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.636 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 59.7 ttp85 -70.18 -41.73 73.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.434 . . . . 10.0 110.222 179.636 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 29.1 m0 -58.02 -48.72 79.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.473 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.505 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -68.97 -42.46 76.59 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.553 -0.749 . . . . 10.0 111.626 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.42 -40.76 79.04 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -178.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -63.13 -38.23 90.37 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.854 0.316 . . . . 10.0 111.854 -179.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 10.2 m -98.75 11.63 38.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.435 -0.348 . . . . 10.0 111.817 -178.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 60.5 t30 58.14 30.1 18.86 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.482 0.658 . . . . 10.0 110.762 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 73.1 mtp -92.9 169.67 10.27 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.698 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -106.71 151.09 25.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.043 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 41.9 tp -116.08 126.54 53.89 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.288 0.566 . . . . 10.0 111.117 179.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.412 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 0.5 OUTLIER -108.97 95.87 5.94 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 178.725 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.564 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 7.7 t80 -93.41 101.82 14.04 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.088 -179.056 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.7 m-80 -100.68 31.07 3.65 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.326 0.584 . . . . 10.0 110.452 -179.469 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.536 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 32.1 mt -105.57 151.24 39.75 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.606 -0.725 . . . . 10.0 109.716 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.74 -27.68 21.47 Favored 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 122.542 2.161 . . . . 10.0 112.918 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.0 m -153.75 167.24 30.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.646 0.26 . . . . 10.0 110.76 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.564 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 6.6 p-10 -93.04 146.3 23.73 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.43 -0.581 . . . . 10.0 109.43 178.441 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.428 ' HE2' HD13 ' A' ' 83' ' ' LEU . 9.2 m-85 -124.78 157.93 34.57 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.416 -0.356 . . . . 10.0 110.237 -179.229 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.438 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.6 OUTLIER -81.76 163.79 22.15 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.087 179.702 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.46 119.35 15.49 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 179.373 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.4 pt -57.41 -34.92 47.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 112.439 0.533 . . . . 10.0 112.439 -179.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 152.31 -72.84 0.27 Allowed Glycine 0 CA--C 1.518 0.279 0 C-N-CA 120.06 -1.067 . . . . 10.0 113.261 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -61.54 -3.25 3.21 Favored 'Trans proline' 0 N--CA 1.478 0.588 0 C-N-CA 123.374 2.716 . . . . 10.0 113.903 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.1 t -61.62 -41.24 89.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.237 0.541 . . . . 10.0 110.64 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.407 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.9 OUTLIER -73.09 -7.11 49.87 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.613 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.09 2.28 56.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.927 0.394 . . . . 10.0 111.017 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 32.5 mt -104.6 113.76 42.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.558 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.4 m -138.34 99.47 3.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.004 0.431 . . . . 10.0 111.868 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.8 t -131.52 156.24 46.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.535 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.56 -13.12 43.78 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.043 0.449 . . . . 10.0 110.903 178.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 17.0 t -93.13 116.82 29.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.219 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.437 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 14.6 p -65.1 -30.38 50.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.921 0.391 . . . . 10.0 110.206 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -68.44 -42.35 79.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.954 -0.567 . . . . 10.0 109.825 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -68.75 -43.37 75.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.937 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.02 -48.34 73.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.626 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.72 -39.61 92.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.573 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 62.2 m -65.69 -48.0 73.53 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.807 -0.633 . . . . 10.0 111.0 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -65.75 -38.71 89.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.045 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.411 ' HA ' HD23 ' A' ' 108' ' ' LEU . 16.7 mt -62.54 -48.89 77.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.749 -0.463 . . . . 10.0 109.749 178.638 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.8 m -58.95 -33.01 70.13 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.854 -0.612 . . . . 10.0 111.227 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.25 -40.51 94.3 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.933 0.396 . . . . 10.0 110.999 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.85 -40.72 15.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.49 0.662 . . . . 10.0 110.852 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.433 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 8.3 m-30 -69.64 -25.46 63.93 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.249 -0.887 . . . . 10.0 112.647 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.05 -42.27 49.42 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.295 0.48 . . . . 10.0 112.295 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.37 -23.84 67.43 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -95.1 -3.79 47.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.839 0.352 . . . . 10.0 110.928 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 88.62 23.8 35.22 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.715 -0.755 . . . . 10.0 113.237 179.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.433 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 88.6 t -126.33 139.76 50.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.965 0.412 . . . . 10.0 110.578 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.0 m -142.28 140.84 32.33 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 110.068 -0.345 . . . . 10.0 110.068 178.576 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.437 HG12 HG22 ' A' ' 128' ' ' VAL . 11.0 m -126.5 134.23 66.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.103 0.478 . . . . 10.0 111.55 -178.725 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.8 m -140.1 143.71 36.41 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 179.093 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.468 ' HB ' HD23 ' A' ' 126' ' ' LEU . 3.1 p -107.75 127.58 63.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-O 121.275 0.559 . . . . 10.0 110.039 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.4 m -145.99 130.53 17.83 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.153 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.32 39.51 18.77 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.564 0.54 . . . . 10.0 111.089 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 14.4 m120 62.67 28.84 16.76 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.65 -0.705 . . . . 10.0 110.986 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.412 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 66.7 tttt -130.81 132.25 45.13 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.867 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.505 HD12 ' HB2' ' A' ' 72' ' ' ALA . 48.9 mt -87.88 122.11 31.11 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.298 -1.001 . . . . 10.0 108.298 179.097 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.14 115.52 27.65 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.062 0.458 . . . . 10.0 111.286 -178.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.437 HG22 HG12 ' A' ' 119' ' ' VAL . 3.2 t -97.17 119.91 45.82 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 N-CA-C 108.742 -0.836 . . . . 10.0 108.742 178.534 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -132.6 128.48 20.98 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 109.943 -0.392 . . . . 10.0 109.943 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.23 131.22 16.23 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.311 2.008 . . . . 10.0 112.087 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.318 -0.771 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.315 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.9 t80 . . . . . 0 C--O 1.234 0.287 0 CA-C-O 120.998 0.428 . . . . 10.0 111.467 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.4 m -86.19 122.21 29.86 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.76 -0.655 . . . . 10.0 110.4 179.332 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.425 ' OH ' ' HB3' ' A' ' 75' ' ' SER . 67.4 m-85 -87.68 114.12 24.0 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.741 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -146.64 145.18 29.96 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.91 -0.586 . . . . 10.0 109.994 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -79.18 123.54 27.49 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 178.642 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.449 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 50.6 p -111.06 158.16 36.68 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-O 120.66 0.267 . . . . 10.0 111.04 -178.654 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.449 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 35.6 Cg_endo -64.25 -20.19 66.57 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.431 2.087 . . . . 10.0 111.321 178.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -66.28 -35.1 79.54 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -75.11 -56.07 5.1 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.484 -0.932 . . . . 10.0 108.484 178.631 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.63 -56.13 3.39 Favored Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.309 -0.86 . . . . 10.0 113.536 178.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 63.5 p -108.04 166.03 11.03 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.062 0.458 . . . . 10.0 111.883 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 31.6 tp -61.92 -48.12 81.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.143 -0.935 . . . . 10.0 111.553 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -58.09 -54.55 45.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.77 -0.195 . . . . 10.0 111.133 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.3 m -58.41 -37.84 76.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.98 0.419 . . . . 10.0 111.497 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 10.1 tmm? -68.84 -52.29 31.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.002 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 26.8 mt -63.64 -34.13 77.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.519 -0.309 . . . . 10.0 111.09 -179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -62.24 -43.38 98.97 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 -64.48 -43.04 95.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.076 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 21.3 m0 -60.03 -54.48 45.53 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.719 -0.673 . . . . 10.0 110.985 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.562 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -62.94 -36.82 84.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.982 -0.554 . . . . 10.0 111.655 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.83 -44.05 97.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.811 0.339 . . . . 10.0 111.158 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.04 -34.56 77.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.55 -179.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.425 ' HB3' ' OH ' ' A' ' 55' ' ' TYR . 4.7 p -91.51 0.77 57.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.415 -0.357 . . . . 10.0 111.551 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 56.29 46.41 21.18 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.569 0.699 . . . . 10.0 109.705 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.508 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 21.9 mtm -115.37 168.07 10.3 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.698 -179.481 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -93.79 150.08 20.69 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.125 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 22.4 tp -124.06 134.66 53.35 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.92 0.39 . . . . 10.0 110.174 179.576 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.62 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 1.6 m -121.46 95.98 4.9 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.987 179.092 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.512 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 11.6 t80 -90.83 96.78 10.81 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.273 -0.64 . . . . 10.0 109.273 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -98.92 22.52 10.09 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.258 0.552 . . . . 10.0 110.841 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.512 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 63.5 mt -87.56 138.33 31.81 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.537 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -61.44 -35.78 81.15 Favored 'Trans proline' 0 C--O 1.235 0.332 0 C-N-CA 123.08 2.52 . . . . 10.0 113.122 -179.023 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.8 m -137.51 168.71 19.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.143 0.497 . . . . 10.0 111.037 -179.267 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -82.78 143.81 30.59 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.574 178.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.461 ' CE2' HD13 ' A' ' 83' ' ' LEU . 48.4 m-85 -124.12 145.43 49.28 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.482 -0.326 . . . . 10.0 110.193 179.651 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 1.5 m -97.82 151.57 20.06 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.882 -179.413 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.54 112.73 1.7 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 120.875 0.369 . . . . 10.0 110.126 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -62.64 -33.8 61.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 112.68 0.622 . . . . 10.0 112.68 -178.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 151.02 -64.78 0.38 Allowed Glycine 0 CA--C 1.519 0.332 0 C-N-CA 120.172 -1.013 . . . . 10.0 113.455 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.56 -13.98 28.45 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.883 2.389 . . . . 10.0 113.16 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.441 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.4 t -64.91 -35.5 75.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.862 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.93 -11.48 60.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.427 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.12 2.95 55.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.341 -0.39 . . . . 10.0 111.392 -179.438 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.599 HD13 HD12 ' A' ' 108' ' ' LEU . 39.3 mt -98.0 108.36 21.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.533 -0.303 . . . . 10.0 110.273 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.72 100.43 5.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.755 -179.196 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.2 t -132.54 155.59 48.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.579 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -91.05 -1.63 57.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.846 0.355 . . . . 10.0 111.484 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.4 t -109.01 121.44 45.13 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.467 -0.333 . . . . 10.0 110.279 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.58 -30.78 51.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.83 0.348 . . . . 10.0 110.733 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -68.88 -46.28 68.8 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 179.002 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -65.12 -36.38 84.08 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.329 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.34 -51.12 70.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.229 178.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.81 -33.38 75.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.632 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 51.5 m -66.91 -46.32 75.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.775 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -70.99 -36.81 72.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.277 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.599 HD12 HD13 ' A' ' 96' ' ' ILE . 2.9 mp -62.75 -47.61 82.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.751 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.1 p -62.45 -29.84 70.81 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 116.734 -0.212 . . . . 10.0 111.281 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.04 -35.74 81.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.166 0.508 . . . . 10.0 110.791 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 45.6 t -84.94 -41.65 15.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.409 0.624 . . . . 10.0 110.264 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.531 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 12.1 m-30 -68.3 -26.75 65.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.166 -0.924 . . . . 10.0 112.273 -178.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -51.02 -44.69 61.05 Favored 'General case' 0 C--N 1.33 -0.279 0 O-C-N 123.07 0.231 . . . . 10.0 111.468 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.62 -23.4 65.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.891 0.377 . . . . 10.0 111.265 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -89.38 -12.46 40.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.786 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 96.13 22.28 20.45 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.604 -0.808 . . . . 10.0 112.809 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.531 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 90.3 t -127.61 145.41 35.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.872 0.367 . . . . 10.0 110.052 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.2 m -139.44 117.92 12.14 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.996 0.427 . . . . 10.0 110.269 178.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.469 HG12 HG13 ' A' ' 128' ' ' VAL . 28.0 m -108.48 144.98 16.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.778 -0.647 . . . . 10.0 111.46 -179.536 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 48.5 m -155.47 142.46 19.12 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.885 -0.783 . . . . 10.0 108.885 178.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.516 ' HB ' HD23 ' A' ' 126' ' ' LEU . 2.6 p -104.44 117.39 49.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 16.6 m -132.52 118.93 19.87 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.252 -178.403 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.28 51.93 5.19 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 123.916 0.76 . . . . 10.0 112.402 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.508 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 78.3 m-20 60.44 33.89 20.59 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.059 -0.518 . . . . 10.0 111.594 179.159 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.62 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 64.2 tttt -143.69 129.28 19.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.789 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.562 HD12 ' HB2' ' A' ' 72' ' ' ALA . 36.7 mt -88.26 121.22 30.4 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.604 -0.888 . . . . 10.0 108.604 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 127' ' ' LEU . 2.3 mm? -103.39 116.54 32.6 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.667 -179.062 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.469 HG13 HG12 ' A' ' 119' ' ' VAL . 2.8 t -111.43 118.01 56.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 N-CA-C 108.64 -0.874 . . . . 10.0 108.64 178.66 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -143.39 148.43 44.03 Favored Pre-proline 0 C--N 1.322 -0.625 0 CA-C-O 120.686 0.279 . . . . 10.0 111.144 -178.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -79.06 143.58 18.04 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.552 2.168 . . . . 10.0 110.911 178.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.712 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.202 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 30.1 t80 . . . . . 0 N--CA 1.452 -0.37 0 CA-C-O 120.741 0.305 . . . . 10.0 110.207 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 13.9 m -69.0 114.96 7.76 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.343 0.592 . . . . 10.0 110.256 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.501 ' O ' ' HA ' ' A' ' 97' ' ' SER . 52.0 m-85 -79.59 115.49 19.24 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.526 -0.761 . . . . 10.0 110.865 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -150.69 148.94 29.19 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.73 179.064 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.34 119.3 24.92 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.258 -0.645 . . . . 10.0 109.258 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.8 p -104.32 153.5 38.99 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.833 -179.021 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -64.42 -13.11 36.56 Favored 'Trans proline' 0 N--CA 1.465 -0.149 0 C-N-CA 122.67 2.246 . . . . 10.0 111.701 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 24.7 mmt -79.35 -21.96 45.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.313 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -75.31 -51.56 12.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.386 -0.598 . . . . 10.0 109.386 179.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.94 -65.25 2.95 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.918 -0.658 . . . . 10.0 112.846 178.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.473 HG22 HG23 ' A' ' 88' ' ' THR . 30.0 p -117.22 169.73 9.23 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.018 0.437 . . . . 10.0 111.666 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.403 HD13 ' CE2' ' A' ' 112' ' ' TYR . 60.4 tp -62.85 -38.87 92.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.453 -0.794 . . . . 10.0 110.821 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -61.42 -52.17 65.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.474 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.24 -35.47 81.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.273 -0.422 . . . . 10.0 111.546 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.0 tmm? -68.06 -50.62 54.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.849 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 88.2 mt -63.23 -35.85 81.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.842 0.353 . . . . 10.0 110.229 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -61.53 -38.13 86.28 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 178.088 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.433 HH11 ' HD3' ' A' ' 70' ' ' ARG . 3.8 tpp180 -68.17 -46.27 71.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.037 179.129 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 32.5 m0 -57.33 -50.94 71.33 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.827 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.52 -41.77 83.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.892 -0.594 . . . . 10.0 111.858 -179.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.83 -41.03 96.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.82 0.343 . . . . 10.0 111.668 -179.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -68.75 -34.07 74.96 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.316 -0.402 . . . . 10.0 111.266 -179.272 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.9 m -94.01 2.9 55.98 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.316 -0.402 . . . . 10.0 111.802 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 67.2 t30 57.74 55.26 5.61 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.366 0.603 . . . . 10.0 110.4 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 19.5 mtm -129.59 173.13 10.89 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.034 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -98.72 155.12 17.49 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.553 -0.294 . . . . 10.0 110.264 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.0 tp -132.2 135.57 46.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.919 0.39 . . . . 10.0 110.997 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.608 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 1.1 m -122.74 96.78 5.16 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.523 179.183 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.514 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 27.7 t80 -88.16 98.88 11.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.745 -0.662 . . . . 10.0 109.534 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -107.72 33.45 4.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.779 0.323 . . . . 10.0 111.463 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.449 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 39.4 mt -88.06 150.28 47.13 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 110.322 -0.251 . . . . 10.0 110.322 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -63.14 -29.56 74.4 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.577 2.185 . . . . 10.0 112.262 179.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.1 m -152.36 166.28 32.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.412 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.514 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 0.6 OUTLIER -87.97 140.44 29.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.507 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -120.98 144.94 48.24 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.935 0.398 . . . . 10.0 111.231 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.473 HG23 HG22 ' A' ' 63' ' ' THR . 0.2 OUTLIER -84.73 161.13 20.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.242 179.766 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -57.09 117.81 4.39 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.138 0.495 . . . . 10.0 110.573 179.125 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.6 pt -61.68 -35.97 70.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.407 -0.815 . . . . 10.0 112.162 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 137.87 -69.01 0.5 Allowed Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.633 -0.794 . . . . 10.0 112.285 -179.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.27 -13.12 36.25 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.718 2.278 . . . . 10.0 112.389 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.36 -32.46 53.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.631 0.729 . . . . 10.0 110.196 178.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.68 -10.58 59.84 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.834 -1.075 . . . . 10.0 111.261 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -92.32 -1.19 57.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.059 0.456 . . . . 10.0 110.715 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 56.9 mt -98.24 113.36 32.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.567 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.501 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 1.6 m -140.66 96.72 3.07 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.753 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.7 t -127.02 155.72 42.78 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.698 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.46 -5.05 52.71 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.356 -0.383 . . . . 10.0 111.972 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 62.3 m -100.27 119.38 38.31 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.906 -0.405 . . . . 10.0 109.906 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.4 HG22 ' HE2' ' A' ' 55' ' ' TYR . 0.8 OUTLIER -56.72 -49.29 78.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.136 -0.484 . . . . 10.0 111.913 -178.979 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -62.07 -33.52 74.56 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.776 -0.647 . . . . 10.0 111.403 -178.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -73.36 -39.76 64.91 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.96 -48.74 79.08 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.216 179.316 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.11 -43.53 98.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.575 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 84.6 m -62.6 -44.75 95.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.963 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -66.15 -39.55 89.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.707 179.667 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.444 HD23 ' HA ' ' A' ' 108' ' ' LEU . 15.2 mt -61.06 -53.59 55.25 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.954 -0.387 . . . . 10.0 109.954 178.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.7 m -57.6 -31.78 66.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.589 -179.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.98 -39.12 91.1 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.192 0.52 . . . . 10.0 110.789 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 6.4 t -90.61 -29.86 4.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.833 -0.622 . . . . 10.0 111.553 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.405 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.1 m-85 -82.17 -24.04 35.2 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.465 1.283 . . . . 10.0 114.465 -177.683 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.76 -38.42 33.81 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.291 0.478 . . . . 10.0 112.291 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.97 -18.93 65.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.058 0.456 . . . . 10.0 111.717 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -97.71 -4.2 37.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.978 0.418 . . . . 10.0 110.209 179.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' GLY . . . . . 0.4 ' HA2' HG23 ' A' ' 131' ' ' VAL . . . 84.91 27.4 34.51 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.956 -0.64 . . . . 10.0 112.272 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.405 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 67.6 t -124.61 136.06 61.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 120.814 0.34 . . . . 10.0 110.642 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 29.4 m -140.39 123.18 16.38 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.935 0.397 . . . . 10.0 110.091 179.053 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 5.4 m -111.61 147.88 15.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.873 -179.001 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 19.1 m -150.65 155.93 40.35 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.133 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.472 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.4 t -112.17 115.75 50.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.126 -0.694 . . . . 10.0 109.126 179.629 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 14.5 m -136.55 117.92 14.67 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.146 -178.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 63.92 51.49 2.31 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.671 -0.695 . . . . 10.0 111.929 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 54.91 35.04 23.52 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.531 0.681 . . . . 10.0 110.813 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.608 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 75.6 tttt -140.54 133.37 29.05 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.485 -0.779 . . . . 10.0 109.827 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.472 ' CD2' HG22 ' A' ' 121' ' ' VAL . 94.0 mt -88.65 121.5 31.09 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 109.039 -0.726 . . . . 10.0 109.039 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.535 HD22 ' HB2' ' A' ' 80' ' ' SER . 13.2 mt -112.86 125.96 54.93 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.199 0.523 . . . . 10.0 110.809 -178.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 2.6 t -108.3 118.73 56.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 N-CA-C 108.222 -1.029 . . . . 10.0 108.222 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -127.98 138.09 32.19 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-O 120.841 0.353 . . . . 10.0 111.365 -178.296 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -81.62 133.24 8.15 Favored 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.133 1.888 . . . . 10.0 110.898 177.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.4 HG23 ' HA2' ' A' ' 116' ' ' GLY . 1.6 m . . . . . 0 C--N 1.317 -0.836 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.691 -179.657 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.8 t80 . . . . . 0 N--CA 1.456 -0.136 0 CA-C-O 120.952 0.406 . . . . 10.0 111.129 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.4 m -82.92 113.1 20.29 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.577 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.436 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 95.1 m-85 -83.29 107.54 15.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.525 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -147.6 174.07 12.11 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.818 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.52 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -100.91 127.55 47.33 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.381 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.6 p -109.71 153.9 42.74 Favored Pre-proline 0 C--N 1.323 -0.587 0 N-CA-C 109.872 -0.418 . . . . 10.0 109.872 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -66.85 -9.52 25.04 Favored 'Trans proline' 0 CA--C 1.529 0.264 0 C-N-CA 122.333 2.022 . . . . 10.0 111.626 179.178 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 61.8 mtm -84.6 -19.89 32.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.492 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -73.11 -57.9 3.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.151 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLY . . . . . 0.407 ' O ' HD22 ' A' ' 89' ' ' LEU . . . 87.05 -57.82 4.59 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.838 -0.696 . . . . 10.0 113.167 179.18 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 65.5 p -119.24 164.54 15.47 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.485 0.55 . . . . 10.0 112.485 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.416 HD13 ' CE2' ' A' ' 112' ' ' TYR . 27.3 tp -61.35 -45.14 95.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.282 -0.872 . . . . 10.0 111.386 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.1 ttpt -59.17 -50.34 74.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.828 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.594 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 51.8 m -60.74 -43.45 97.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.948 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.402 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 57.0 ttp -60.72 -50.82 71.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.612 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.441 ' HB3' HD13 ' A' ' 79' ' ' LEU . 83.2 mt -63.55 -35.23 79.81 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.875 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -60.87 -43.37 98.51 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.624 -0.51 . . . . 10.0 109.624 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.594 ' HG2' ' O ' ' A' ' 66' ' ' THR . 31.6 mmt180 -64.93 -46.06 83.2 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.643 -0.708 . . . . 10.0 109.643 178.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 38.9 m0 -55.23 -50.54 69.15 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.469 -0.787 . . . . 10.0 110.793 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.428 ' HA ' ' HB2' ' A' ' 77' ' ' MET . . . -66.0 -52.14 52.04 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.338 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.93 -43.61 77.55 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.253 0.464 . . . . 10.0 112.253 -178.278 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -58.21 -35.83 72.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.909 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.1 m -105.38 18.75 21.75 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.24 0.459 . . . . 10.0 112.24 -178.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 65.4 t30 57.91 35.54 25.44 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.636 0.732 . . . . 10.0 111.209 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.428 ' HB2' ' HA ' ' A' ' 72' ' ' ALA . 72.6 mtp -103.19 173.88 6.11 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.839 -0.618 . . . . 10.0 110.035 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 70.7 mm-40 -114.02 157.91 21.88 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.819 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.441 HD13 ' HB3' ' A' ' 68' ' ' LEU . 43.6 tp -124.99 131.51 53.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.195 0.522 . . . . 10.0 110.958 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -115.59 96.37 5.6 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.562 -0.745 . . . . 10.0 109.251 178.644 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.548 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 6.6 t80 -91.45 98.57 11.77 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.097 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.458 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 42.2 m-80 -94.94 11.96 29.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.901 -179.443 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.507 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 45.2 mt -84.12 147.61 51.24 Favored Pre-proline 0 C--N 1.324 -0.523 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.29 -41.86 68.63 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.662 2.241 . . . . 10.0 112.634 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 2.1 m -147.11 170.49 17.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.096 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.548 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 7.0 p-10 -80.82 148.06 30.16 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -123.72 143.24 50.4 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.838 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.28 152.32 36.5 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.524 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.407 HD22 ' O ' ' A' ' 62' ' ' GLY . 0.1 OUTLIER -58.75 136.31 57.7 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.735 0.302 . . . . 10.0 110.245 178.986 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.5 pt -81.48 -27.62 10.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.534 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 138.37 -62.49 0.57 Allowed Glycine 0 CA--C 1.523 0.536 0 C-N-CA 120.217 -0.992 . . . . 10.0 113.282 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -58.61 -15.75 27.03 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 123.02 2.48 . . . . 10.0 113.098 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t -61.81 -36.64 74.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.922 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.52 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.1 m -71.66 -14.71 62.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.87 -0.604 . . . . 10.0 111.723 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -88.3 -1.31 57.95 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.052 0.453 . . . . 10.0 110.523 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.437 HD13 HD12 ' A' ' 108' ' ' LEU . 56.9 mt -101.65 111.77 32.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.771 -0.649 . . . . 10.0 109.371 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.0 m -139.99 97.16 3.19 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.112 0.482 . . . . 10.0 110.564 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.1 t -130.76 157.67 42.2 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.692 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.42 -18.29 30.31 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.462 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.03 113.31 25.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.619 -0.718 . . . . 10.0 110.275 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.436 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 9.8 p -61.14 -31.68 50.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.565 0.221 . . . . 10.0 111.269 -179.774 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -65.93 -41.1 91.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.945 0.402 . . . . 10.0 110.028 179.257 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -66.99 -41.96 85.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.923 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.05 -50.37 72.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.61 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.23 -36.44 79.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.582 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 63.0 m -64.18 -45.76 86.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.852 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -69.78 -39.19 76.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.862 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.437 HD12 HD13 ' A' ' 96' ' ' ILE . 1.7 mp -63.34 -50.29 70.57 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.839 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 11.2 p -62.73 -21.72 66.01 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.696 0.258 . . . . 10.0 111.696 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.51 -48.03 51.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.891 0.376 . . . . 10.0 110.893 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.61 HG13 ' HD1' ' A' ' 112' ' ' TYR . 4.8 p -82.55 -28.48 8.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-O 121.421 0.629 . . . . 10.0 111.186 -179.426 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.61 ' HD1' HG13 ' A' ' 111' ' ' VAL . 3.1 m-85 -81.28 -22.86 38.33 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.658 -0.701 . . . . 10.0 112.798 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.65 -42.64 45.77 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 112.342 0.497 . . . . 10.0 112.342 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.96 -20.01 63.33 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.876 0.37 . . . . 10.0 111.377 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -87.81 -13.31 42.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.187 0.518 . . . . 10.0 109.955 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 130' ' ' PRO . . . 95.61 24.93 14.5 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 115.717 -0.674 . . . . 10.0 112.48 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.459 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 96.5 t -128.27 130.9 69.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.052 0.453 . . . . 10.0 111.378 -179.184 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.6 m -127.54 111.61 13.98 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.236 -0.438 . . . . 10.0 109.979 178.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.433 HG21 ' HB3' ' A' ' 108' ' ' LEU . 3.3 m -102.57 142.39 16.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.077 0.465 . . . . 10.0 111.088 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 15.3 m -150.38 165.53 32.82 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.813 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.532 HG22 HD23 ' A' ' 126' ' ' LEU . 3.4 t -119.64 117.31 53.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 13.8 m -134.6 118.71 17.53 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.639 -0.255 . . . . 10.0 110.659 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 65.05 43.75 3.63 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 123.732 0.645 . . . . 10.0 111.147 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 4.6 t30 59.37 29.67 19.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.116 -0.947 . . . . 10.0 110.619 -179.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -129.77 133.78 47.2 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.29 -0.868 . . . . 10.0 109.056 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.532 HD23 HG22 ' A' ' 121' ' ' VAL . 96.0 mt -87.97 122.01 31.06 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.727 -0.842 . . . . 10.0 108.727 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -113.3 116.0 29.04 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-O 121.207 0.527 . . . . 10.0 111.322 -178.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.458 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 3.2 t -99.33 117.63 44.73 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.077 0 N-CA-C 107.869 -1.159 . . . . 10.0 107.869 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -128.28 131.56 23.85 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-O 120.983 0.42 . . . . 10.0 111.096 -178.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' PRO . . . . . 0.406 ' HA ' ' O ' ' A' ' 116' ' ' GLY . 59.3 Cg_endo -73.77 136.97 24.0 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.365 2.043 . . . . 10.0 110.78 178.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.316 -0.879 0 C-N-CA 120.827 -0.349 . . . . 10.0 110.202 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.9 t80 . . . . . 0 N--CA 1.455 -0.218 0 CA-C-O 121.142 0.496 . . . . 10.0 111.074 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.2 m -86.96 122.87 31.41 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.78 -0.646 . . . . 10.0 110.395 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -89.5 119.84 30.29 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.468 ' HG3' ' OG ' ' A' ' 97' ' ' SER . 1.9 tt0 -152.58 144.56 23.74 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.671 -178.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.51 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -78.16 128.05 33.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.002 178.742 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.462 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 82.5 p -113.71 159.64 34.92 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 116.571 -0.286 . . . . 10.0 110.576 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.462 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 47.1 Cg_endo -69.53 -3.31 11.61 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.459 2.106 . . . . 10.0 112.122 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 45.2 mtt -88.24 -25.14 23.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.362 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -72.22 -58.61 3.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.054 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 86.95 -57.21 4.63 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.77 -0.729 . . . . 10.0 112.895 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.649 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 65.3 p -121.52 172.57 7.98 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.426 0.528 . . . . 10.0 112.426 -179.366 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 25.7 tp -64.19 -48.62 75.22 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.114 -0.948 . . . . 10.0 111.752 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -58.79 -43.99 90.62 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.012 0.434 . . . . 10.0 110.472 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.8 m -66.51 -39.78 88.84 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.485 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 54.7 ttp -66.87 -50.14 63.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.044 0.45 . . . . 10.0 111.055 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 75.1 mt -62.17 -37.71 86.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.276 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -60.49 -41.34 94.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.284 179.07 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -65.78 -47.63 74.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.285 179.139 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 43.5 m0 -58.19 -51.94 67.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.574 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.69 -42.48 99.65 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.784 -0.643 . . . . 10.0 111.515 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.4 -44.77 95.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.727 0.298 . . . . 10.0 111.755 -179.325 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.15 -40.27 95.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.372 -0.376 . . . . 10.0 111.417 -179.035 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.9 m -94.0 6.96 46.83 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.897 -178.844 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 46.9 t30 55.85 49.25 16.43 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.239 0.542 . . . . 10.0 111.272 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.452 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 10.8 mtm -114.68 174.0 6.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.756 -179.621 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 26.6 mp0 -102.15 163.1 12.42 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.68 -179.581 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 45.9 tp -130.88 138.82 49.99 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.179 0.514 . . . . 10.0 111.134 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -124.54 96.23 4.82 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.432 -0.804 . . . . 10.0 109.142 178.487 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.496 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 4.7 t80 -92.31 98.34 11.44 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.427 -0.583 . . . . 10.0 109.427 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 73.9 m-20 -96.89 24.03 6.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.122 0.487 . . . . 10.0 110.589 -179.316 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.496 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 44.4 mt -93.51 142.48 25.24 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.425 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.84 -29.84 58.59 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.898 2.399 . . . . 10.0 112.327 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.2 m -147.46 153.26 39.34 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.587 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.495 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 34.3 t0 -80.68 125.12 29.64 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -100.47 149.8 23.31 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.643 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.649 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 2.0 t -92.84 151.95 19.7 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.7 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -50.59 121.67 6.11 Favored 'General case' 0 C--N 1.337 0.042 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.868 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.0 pt -67.01 -29.57 46.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.562 . . . . 10.0 111.935 -179.388 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 141.72 -68.45 0.46 Allowed Glycine 0 CA--C 1.52 0.344 0 C-N-CA 120.375 -0.916 . . . . 10.0 113.2 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.17 -7.28 3.58 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.639 2.893 . . . . 10.0 113.868 -179.033 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.465 ' HA ' HD12 ' A' ' 96' ' ' ILE . 5.8 t -68.07 -32.79 57.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.239 0.542 . . . . 10.0 110.452 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.51 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.5 m -72.62 -13.73 61.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.938 -0.573 . . . . 10.0 111.436 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -89.5 -0.1 57.26 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.044 0.449 . . . . 10.0 110.562 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.526 HD13 HD12 ' A' ' 108' ' ' LEU . 51.6 mt -97.95 111.0 26.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.584 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.468 ' OG ' ' HG3' ' A' ' 56' ' ' GLN . 2.8 m -134.08 98.78 4.23 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.697 -179.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 12.8 t -129.76 155.69 45.52 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.442 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -90.24 -9.47 47.89 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.798 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.4 t -104.29 123.76 47.95 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.662 0.267 . . . . 10.0 110.908 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.407 HG13 HG11 ' A' ' 121' ' ' VAL . 13.1 p -65.99 -29.7 47.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-O 121.123 0.487 . . . . 10.0 110.104 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -69.93 -41.45 74.58 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.733 179.433 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -68.7 -39.43 80.5 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.83 -48.8 77.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.658 179.059 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.46 -35.38 80.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.324 0.583 . . . . 10.0 110.473 179.401 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 92.8 m -67.34 -47.5 70.28 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.46 -0.791 . . . . 10.0 110.802 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -69.6 -40.89 76.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.881 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' LEU . . . . . 0.526 HD12 HD13 ' A' ' 96' ' ' ILE . 2.5 mp -59.04 -48.28 82.17 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.773 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 59.2 m -59.55 -31.91 69.86 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 111.86 0.318 . . . . 10.0 111.86 -179.566 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.4 -37.42 83.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.375 0.607 . . . . 10.0 110.833 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 2.7 t -87.47 -42.74 15.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.521 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.48 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 13.2 m-30 -64.83 -26.63 68.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.166 -0.925 . . . . 10.0 112.504 -178.467 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -55.37 -31.42 61.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.774 0.321 . . . . 10.0 111.389 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.74 -11.54 59.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.91 0.386 . . . . 10.0 111.198 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 -109.96 -0.28 18.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.566 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 82.36 28.13 41.26 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.95 -0.643 . . . . 10.0 112.855 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.48 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 74.1 t -127.54 143.86 39.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.952 0.406 . . . . 10.0 110.338 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.9 m -142.47 138.83 31.28 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 178.722 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 9.9 m -126.32 143.24 40.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.407 0.623 . . . . 10.0 111.782 -178.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.2 m -150.84 139.85 21.02 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.429 178.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.407 HG11 HG13 ' A' ' 101' ' ' VAL . 2.3 p -102.48 121.0 53.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.3 m -139.91 124.51 18.2 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.767 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.4 48.62 7.63 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 123.537 0.523 . . . . 10.0 111.476 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.452 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 23.6 m120 57.69 33.01 22.7 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.783 -0.644 . . . . 10.0 111.498 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -137.19 129.9 30.24 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.6 -0.519 . . . . 10.0 109.6 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 37.3 mt -87.54 120.73 29.14 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 107.8 -1.185 . . . . 10.0 107.8 178.823 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.71 118.97 37.93 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.103 0.478 . . . . 10.0 111.591 -178.304 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.405 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 3.0 t -104.44 118.36 51.57 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.957 0 N-CA-C 108.187 -1.042 . . . . 10.0 108.187 178.369 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -131.01 131.25 23.09 Favored Pre-proline 0 C--N 1.317 -0.827 0 CA-C-O 120.741 0.305 . . . . 10.0 110.96 -178.258 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -72.14 134.38 23.03 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.467 2.111 . . . . 10.0 111.058 179.102 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.315 -0.912 0 N-CA-C 109.892 -0.41 . . . . 10.0 109.892 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 21.2 t80 . . . . . 0 N--CA 1.449 -0.486 0 CA-C-O 120.75 0.309 . . . . 10.0 110.45 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.6 m -73.92 115.6 13.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.077 0.465 . . . . 10.0 110.358 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.411 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 91.4 m-85 -84.19 105.27 14.92 Favored 'General case' 0 C--N 1.313 -1.022 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -141.05 147.27 38.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.314 -179.606 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.699 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -75.52 117.3 17.16 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.398 -0.593 . . . . 10.0 109.398 178.667 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 61.8 p -101.67 152.49 38.09 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 116.307 -0.406 . . . . 10.0 111.094 -178.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -64.98 -13.86 42.03 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.655 2.237 . . . . 10.0 112.416 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.5 ptp -86.78 -6.27 58.87 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.93 0.395 . . . . 10.0 110.447 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -84.14 -58.49 2.74 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 179.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 86.19 -60.24 4.6 Favored Glycine 0 N--CA 1.445 -0.754 0 CA-C-N 115.649 -0.705 . . . . 10.0 113.319 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 31.9 p -116.48 166.5 12.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.551 0.691 . . . . 10.0 112.705 -178.329 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.93 -46.25 82.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.368 -1.287 . . . . 10.0 111.392 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 29.9 ttmt -58.27 -56.7 18.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.922 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.1 m -56.49 -42.66 78.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.0 -0.546 . . . . 10.0 111.804 -179.231 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 50.2 ttp -59.77 -54.09 50.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.826 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.5 mt -64.81 -36.22 83.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.16 -0.473 . . . . 10.0 111.109 -179.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -60.18 -45.34 93.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.775 0.321 . . . . 10.0 110.323 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -66.3 -38.87 88.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.634 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 39.2 m0 -62.57 -53.74 50.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.325 0.583 . . . . 10.0 109.938 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.439 ' HB2' HD23 ' A' ' 126' ' ' LEU . . . -61.36 -39.88 92.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.225 -0.898 . . . . 10.0 111.637 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.69 -39.86 81.94 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.295 0.48 . . . . 10.0 112.295 -179.009 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -66.11 -36.16 82.43 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.87 0.322 . . . . 10.0 111.87 -178.792 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.423 ' HB2' ' SD ' ' A' ' 77' ' ' MET . 19.7 m -103.01 13.48 34.2 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 111.807 0.299 . . . . 10.0 111.807 -179.007 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 54.67 43.33 30.33 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.414 0.626 . . . . 10.0 111.29 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.459 ' HE1' HD11 ' A' ' 126' ' ' LEU . 64.2 mtp -102.97 160.49 14.57 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.205 -179.647 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -97.41 154.29 17.56 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.261 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 36.7 tp -122.01 133.89 54.81 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.483 0.659 . . . . 10.0 111.438 -179.078 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.451 ' HB2' HD13 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -114.76 95.39 5.21 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.145 -0.934 . . . . 10.0 109.03 179.04 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.504 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 9.8 t80 -99.94 95.79 7.12 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.987 0.422 . . . . 10.0 109.993 -179.427 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 20.8 m-20 -98.83 10.7 40.73 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.752 -179.522 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.504 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 40.4 mt -71.0 142.55 87.81 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.13 179.495 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.36 -39.23 92.63 Favored 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.842 2.361 . . . . 10.0 112.349 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 37.9 m -148.07 171.92 15.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.675 0.274 . . . . 10.0 110.585 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -82.32 135.57 35.18 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -113.17 128.62 56.53 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.999 -0.281 . . . . 10.0 110.279 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.0 OUTLIER -70.51 148.26 48.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.243 179.614 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.36 109.18 0.72 Allowed 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.407 HG12 ' H ' ' A' ' 90' ' ' ILE . 8.4 pt -55.94 -37.05 46.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.417 -0.81 . . . . 10.0 112.503 -178.796 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 151.95 -70.62 0.3 Allowed Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.193 -1.003 . . . . 10.0 112.995 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -55.31 -16.88 14.36 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.544 2.829 . . . . 10.0 113.422 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.488 HG12 ' HB2' ' A' ' 57' ' ' ALA . 21.4 t -59.94 -35.57 61.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.905 179.575 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.699 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.7 OUTLIER -71.4 -8.71 55.55 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.25 0.463 . . . . 10.0 112.25 -179.106 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.15 -1.98 57.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.885 0.374 . . . . 10.0 111.208 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 36.9 mt -93.78 107.05 18.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 109.695 -0.483 . . . . 10.0 109.695 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -133.97 91.54 2.83 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.141 0.496 . . . . 10.0 111.792 -179.257 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.6 t -130.33 155.2 46.73 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.117 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.3 p -87.33 -18.26 30.52 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 121.003 0.43 . . . . 10.0 110.522 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.5 m -88.72 108.53 19.53 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.648 179.462 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.411 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 11.3 p -57.36 -33.52 43.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.632 -178.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -67.72 -39.7 84.31 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -66.61 -42.89 86.13 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.29 -50.6 66.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.344 -0.844 . . . . 10.0 110.338 178.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.45 -35.94 79.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.996 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 48.0 m -64.53 -45.11 88.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.578 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -72.07 -38.07 69.49 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.597 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 62.8 mt -60.14 -50.72 72.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.666 179.318 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 72.2 m -58.34 -28.87 65.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.305 -0.407 . . . . 10.0 112.054 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.42 -37.24 82.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.19 0.519 . . . . 10.0 110.545 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 11.0 t -86.06 -41.01 14.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 121.424 0.63 . . . . 10.0 110.324 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.528 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 14.2 m-30 -66.56 -26.88 67.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.857 -1.065 . . . . 10.0 113.11 -178.371 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.91 -31.21 64.67 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.787 0.292 . . . . 10.0 111.787 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.22 -14.5 60.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.853 0.359 . . . . 10.0 111.232 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -107.83 -10.65 15.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.242 -0.436 . . . . 10.0 111.088 -179.63 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 95.2 31.79 7.41 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.645 -0.788 . . . . 10.0 113.155 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.528 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 69.1 t -131.1 142.43 43.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.871 0.367 . . . . 10.0 110.993 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.409 ' HB2' HG13 ' A' ' 131' ' ' VAL . 0.5 OUTLIER -135.46 138.02 42.77 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 178.517 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' ' 127' ' ' LEU . 14.4 m -130.99 143.72 40.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.143 0.496 . . . . 10.0 111.157 -179.429 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 19.9 m -152.64 153.38 33.21 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.865 179.34 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.441 HG22 ' CD1' ' A' ' 126' ' ' LEU . 5.7 t -106.1 118.16 53.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 68.7 m -140.43 118.46 11.89 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.561 -0.291 . . . . 10.0 111.05 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.88 51.06 4.86 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.607 -0.724 . . . . 10.0 112.021 179.382 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.7 t30 58.49 28.08 16.44 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.262 179.069 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -136.2 135.68 39.32 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.321 -0.4 . . . . 10.0 110.301 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.459 HD11 ' HE1' ' A' ' 77' ' ' MET . 2.5 mm? -88.84 121.71 31.48 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.916 -0.772 . . . . 10.0 108.916 178.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.451 HD13 ' HB2' ' A' ' 80' ' ' SER . 4.6 mm? -102.19 115.74 31.19 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.946 0.403 . . . . 10.0 110.412 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 2.7 t -112.02 118.38 57.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 N-CA-C 108.501 -0.926 . . . . 10.0 108.501 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -136.2 144.68 48.98 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-O 120.814 0.34 . . . . 10.0 111.114 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -75.8 141.63 24.63 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.254 1.969 . . . . 10.0 111.213 178.498 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.409 HG13 ' HB2' ' A' ' 118' ' ' SER . 7.6 m . . . . . 0 C--N 1.323 -0.579 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.504 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.9 t80 . . . . . 0 C--O 1.235 0.306 0 CA-C-O 121.058 0.456 . . . . 10.0 111.038 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.6 m -95.46 120.87 36.46 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.593 -0.731 . . . . 10.0 110.642 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.498 ' CE2' HG22 ' A' ' 101' ' ' VAL . 36.7 m-85 -82.11 112.29 19.02 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.314 -0.624 . . . . 10.0 109.314 179.209 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -153.05 160.33 42.95 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.188 -179.404 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.582 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -76.23 137.63 40.09 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.736 -0.468 . . . . 10.0 109.736 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.433 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 40.0 p -121.9 163.19 32.86 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.426 -178.6 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.433 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 71.7 Cg_endo -79.64 10.39 3.1 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 121.443 1.429 . . . . 10.0 112.15 179.013 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 22.1 mmt -112.62 -12.77 13.38 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 113.518 0.933 . . . . 10.0 113.518 -178.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.47 -66.17 0.66 Allowed 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.336 -0.546 . . . . 10.0 110.54 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.92 -63.73 0.27 Allowed Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 120.995 -0.621 . . . . 10.0 111.734 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 82.1 p -128.93 175.63 8.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.729 0.299 . . . . 10.0 110.893 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 50.7 tp -57.95 -41.96 83.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.526 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -60.0 -51.11 71.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.775 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.01 -41.34 97.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.308 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 41.1 ttp -61.41 -50.87 71.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.761 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 93.6 mt -63.77 -41.34 97.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.784 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -60.06 -41.59 92.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.531 179.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 70' ' ' ARG . 11.6 ttm180 -65.67 -44.62 85.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.465 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 44.9 m0 -58.69 -48.25 81.75 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.458 0.647 . . . . 10.0 110.093 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.93 -46.13 79.32 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.105 -0.952 . . . . 10.0 111.416 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -56.88 -45.32 82.63 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.359 0.503 . . . . 10.0 112.359 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -64.08 -32.1 73.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.147 0.498 . . . . 10.0 110.811 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.9 m -98.41 12.0 36.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.932 -0.577 . . . . 10.0 111.925 -178.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 56.06 43.41 27.06 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.363 0.601 . . . . 10.0 111.204 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 72.2 mtp -117.05 173.85 6.43 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.721 -179.511 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -114.45 166.82 11.29 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.558 -179.7 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.1 tp -136.62 138.65 41.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.961 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.492 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 35.5 m -121.4 96.93 5.28 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.378 -0.828 . . . . 10.0 110.475 179.471 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.49 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 8.0 t80 -89.67 108.17 19.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.033 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -103.84 12.84 33.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.971 0.415 . . . . 10.0 111.578 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.465 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 35.0 mt -87.09 144.97 37.15 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.796 -0.446 . . . . 10.0 109.796 179.835 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -57.69 -46.71 25.09 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.876 2.384 . . . . 10.0 112.845 -179.322 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.0 m -133.65 161.41 34.72 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.474 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.49 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 2.3 p30 -78.08 147.83 34.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.152 -0.476 . . . . 10.0 109.924 179.239 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -120.02 139.38 52.59 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.142 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.57 153.58 31.08 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.542 ' H ' HD22 ' A' ' 89' ' ' LEU . 0.5 OUTLIER -60.33 122.38 14.38 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 179.239 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.7 pt -62.7 -29.8 47.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 113.086 0.773 . . . . 10.0 113.086 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 144.85 -64.77 0.46 Allowed Glycine 0 CA--C 1.517 0.164 0 C-N-CA 120.054 -1.07 . . . . 10.0 112.749 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.419 ' HG2' HG11 ' A' ' 111' ' ' VAL . 33.8 Cg_endo -65.36 0.91 2.39 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.748 2.298 . . . . 10.0 112.847 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.8 t -67.8 -42.75 86.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.049 0.452 . . . . 10.0 110.365 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.582 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.7 OUTLIER -64.59 -15.08 60.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.321 179.096 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -80.31 -7.27 58.97 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.924 0.392 . . . . 10.0 110.573 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 29.8 mt -96.37 110.85 25.37 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 116.051 -0.522 . . . . 10.0 109.879 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.402 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 11.0 m -139.73 95.54 2.93 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.447 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.0 t -131.45 155.97 46.44 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.827 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -88.9 -14.44 36.78 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.086 0.47 . . . . 10.0 110.965 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.3 m -92.84 124.74 37.05 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.513 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.498 HG22 ' CE2' ' A' ' 55' ' ' TYR . 1.2 t -62.22 -46.33 96.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.12 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -60.86 -32.87 72.28 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.467 -0.788 . . . . 10.0 110.907 -179.293 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -71.97 -41.04 68.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.229 -0.441 . . . . 10.0 109.884 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.34 -50.17 75.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.698 -0.683 . . . . 10.0 110.664 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.77 -37.54 87.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.159 0.504 . . . . 10.0 110.694 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 37.4 m -63.76 -49.19 73.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.806 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.34 -40.37 93.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.492 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 47.7 mt -60.57 -51.09 70.89 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.331 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.4 m -58.5 -33.25 69.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.354 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.32 -40.19 93.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.939 0.4 . . . . 10.0 111.048 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.419 HG11 ' HG2' ' A' ' 92' ' ' PRO . 3.9 t -87.78 -39.76 13.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.359 0.6 . . . . 10.0 111.105 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.51 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 12.7 m-30 -66.58 -24.64 66.37 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.36 -0.836 . . . . 10.0 112.711 -178.651 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -51.43 -37.43 48.5 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.889 0.329 . . . . 10.0 111.889 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.66 -9.48 54.4 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.807 0.337 . . . . 10.0 111.592 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -112.35 2.33 16.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.864 0.364 . . . . 10.0 110.188 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 77.92 26.36 60.51 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 115.841 -0.618 . . . . 10.0 113.049 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.51 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 96.3 t -121.85 140.46 45.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.607 0.242 . . . . 10.0 110.734 -179.458 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' SER . . . . . 0.472 ' HB2' HG13 ' A' ' 131' ' ' VAL . 3.4 t -139.21 140.72 37.84 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.563 -0.532 . . . . 10.0 109.563 179.267 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.449 HG12 HG22 ' A' ' 128' ' ' VAL . 9.8 m -131.19 139.81 50.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.897 0.379 . . . . 10.0 110.657 -179.679 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.1 m -142.89 156.83 44.98 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.605 -0.27 . . . . 10.0 110.382 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.53 HG22 ' CD2' ' A' ' 126' ' ' LEU . 5.3 t -109.43 114.44 46.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 108.65 -0.87 . . . . 10.0 108.65 179.053 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 15.8 m -132.83 118.2 18.68 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.668 -178.742 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 63.6 42.33 6.54 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.674 0.609 . . . . 10.0 110.752 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 5.4 t30 61.04 27.81 17.64 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.784 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.492 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 36.5 tttt -130.0 135.54 48.4 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.53 ' CD2' HG22 ' A' ' 121' ' ' VAL . 88.2 mt -88.55 122.63 32.22 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.704 0.288 . . . . 10.0 110.232 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -108.2 125.83 52.09 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.699 -179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.449 HG22 HG12 ' A' ' 119' ' ' VAL . 6.6 t -113.57 119.95 62.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.36 -0.607 . . . . 10.0 109.36 178.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -140.82 148.09 51.11 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.634 0.254 . . . . 10.0 110.51 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -76.89 147.2 26.88 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.378 2.052 . . . . 10.0 111.913 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' VAL . . . . . 0.472 HG13 ' HB2' ' A' ' 118' ' ' SER . 2.8 m . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.922 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.423 ' CD2' ' HB3' ' A' ' 74' ' ' ASP . 13.6 t80 . . . . . 0 C--O 1.234 0.239 0 CA-C-O 120.603 0.24 . . . . 10.0 110.364 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.1 m -79.14 118.49 21.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.284 0.564 . . . . 10.0 111.084 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -83.5 109.31 17.26 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.751 -0.658 . . . . 10.0 110.184 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.42 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 12.0 pt20 -147.36 154.82 41.36 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.829 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.44 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -85.42 124.59 32.18 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.049 0.452 . . . . 10.0 110.0 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.432 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 73.0 p -117.01 158.91 42.94 Favored Pre-proline 0 C--N 1.317 -0.807 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.225 -179.459 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' PRO . . . . . 0.432 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 45.2 Cg_endo -68.23 -7.98 21.55 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 121.997 1.798 . . . . 10.0 111.322 179.061 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 52.3 mtm -82.85 -20.33 35.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.82 179.138 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -75.64 -59.39 2.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.857 -0.61 . . . . 10.0 109.461 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 91.51 -61.98 2.77 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.799 -0.715 . . . . 10.0 112.938 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 49.5 p -124.45 166.29 16.27 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.939 0.399 . . . . 10.0 111.551 -179.186 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.461 HD13 ' HE2' ' A' ' 112' ' ' TYR . 45.2 tp -56.85 -44.73 82.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.492 -0.776 . . . . 10.0 111.217 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.452 ' O ' ' HG3' ' A' ' 69' ' ' GLU . 36.9 ttmt -59.87 -53.62 55.81 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.379 -179.837 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' THR . . . . . 0.559 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 2.3 m -57.49 -43.81 84.46 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.423 -0.353 . . . . 10.0 111.069 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 52.0 ttp -57.63 -51.52 69.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.121 0.486 . . . . 10.0 110.407 179.608 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 77.0 mt -64.95 -36.86 85.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.131 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 22.3 mt-10 -63.86 -41.0 97.88 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 110.261 -0.274 . . . . 10.0 110.261 179.002 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.559 ' HG2' ' O ' ' A' ' 66' ' ' THR . 32.0 mmt180 -69.32 -39.26 78.33 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 179.05 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 37.6 m0 -61.93 -54.77 37.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.734 179.207 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.591 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -59.89 -44.11 94.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.531 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.95 -36.25 83.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.734 0.302 . . . . 10.0 111.541 -179.545 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 70' ' ' ARG . 0.5 OUTLIER -73.28 -12.89 61.01 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.887 0.375 . . . . 10.0 111.424 -179.304 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.5 m -120.58 12.28 11.48 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.437 -0.347 . . . . 10.0 111.312 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 62.2 t30 56.05 51.68 11.6 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.358 0.599 . . . . 10.0 110.619 179.337 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.422 ' HG2' ' OD1' ' A' ' 124' ' ' ASN . 71.1 mtp -124.27 171.17 10.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.984 -0.553 . . . . 10.0 111.029 -179.093 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.411 ' HB2' ' HG3' ' A' ' 125' ' ' LYS . 37.6 mm-40 -101.68 164.87 11.52 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.063 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.7 tp -141.52 142.48 33.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.344 0.593 . . . . 10.0 111.473 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.449 ' HB2' ' HG ' ' A' ' 127' ' ' LEU . 12.9 m -131.12 97.38 4.28 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.13 -0.941 . . . . 10.0 110.525 179.534 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.644 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 15.7 t80 -91.01 103.48 16.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.298 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -93.41 0.99 57.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.766 0.317 . . . . 10.0 111.65 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.644 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 2.1 mm? -74.33 137.13 75.01 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.316 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.56 -26.66 54.12 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.969 2.446 . . . . 10.0 112.577 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 57.2 m -141.19 161.92 36.71 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.946 0.403 . . . . 10.0 111.033 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.402 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 6.6 p-10 -85.91 143.67 28.07 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.974 179.262 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -121.37 134.91 55.13 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.223 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.07 161.37 29.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.57 -0.286 . . . . 10.0 110.371 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.98 107.96 3.33 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.0 pt -47.99 -46.13 12.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.621 -0.718 . . . . 10.0 112.533 -178.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 165.38 -69.33 0.19 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.044 -1.074 . . . . 10.0 112.881 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -56.41 -13.4 10.16 Favored 'Trans proline' 0 N--CA 1.478 0.583 0 C-N-CA 123.661 2.907 . . . . 10.0 113.39 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.421 ' H ' HG23 ' A' ' 93' ' ' VAL . 2.1 t -60.47 -36.31 68.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.246 0.546 . . . . 10.0 110.346 179.692 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.44 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.8 m -69.34 -12.0 61.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.605 -0.725 . . . . 10.0 111.51 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.48 -1.19 53.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.936 0.398 . . . . 10.0 110.921 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.42 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 53.6 mt -98.36 113.72 33.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.801 -0.444 . . . . 10.0 109.801 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.1 m -142.29 95.39 2.79 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.979 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.0 t -131.02 153.58 49.1 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.549 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.09 -8.71 58.54 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.903 0.382 . . . . 10.0 111.315 179.498 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.8 t -100.02 119.18 37.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.578 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 12.8 p -65.78 -30.85 51.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-O 121.024 0.44 . . . . 10.0 110.255 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -69.07 -41.94 76.88 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 52.9 tp60 -66.43 -40.9 89.79 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.597 178.586 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.61 -49.09 78.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.331 179.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.82 -35.96 79.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.169 0.509 . . . . 10.0 110.221 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 95.0 m -66.14 -49.29 67.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.965 179.347 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -65.8 -44.73 84.81 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.028 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 64.1 mt -59.85 -49.24 78.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.676 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 49.4 m -62.38 -23.45 66.82 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.551 0.204 . . . . 10.0 111.551 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.79 -41.43 78.74 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.837 0.351 . . . . 10.0 110.656 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.426 HG13 ' HD1' ' A' ' 112' ' ' TYR . 3.4 p -89.03 -32.63 5.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.408 0.623 . . . . 10.0 111.326 179.583 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.461 ' HE2' HD13 ' A' ' 64' ' ' LEU . 3.5 m-30 -77.67 -23.42 49.6 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.254 0.835 . . . . 10.0 113.254 -178.287 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.08 -49.32 42.28 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 111.78 0.289 . . . . 10.0 111.78 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.85 -22.86 67.07 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.112 0.482 . . . . 10.0 111.441 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -84.89 -15.02 45.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.264 0.554 . . . . 10.0 110.306 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 94.68 25.99 14.16 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.747 -0.739 . . . . 10.0 112.275 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' VAL . . . . . 0.424 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 95.4 t -129.54 138.39 54.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.929 0.395 . . . . 10.0 110.877 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.1 m -138.34 120.98 16.27 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.058 0.456 . . . . 10.0 110.314 178.793 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.512 HG12 HG13 ' A' ' 128' ' ' VAL . 3.9 m -104.78 137.46 33.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.171 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.96 140.47 23.38 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.191 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 1.7 p -107.96 123.2 63.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.186 0.517 . . . . 10.0 109.685 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 56.4 m -143.72 132.99 23.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.578 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 59.1 39.86 22.65 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.317 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ASN . . . . . 0.422 ' OD1' ' HG2' ' A' ' 77' ' ' MET . 18.8 t30 63.81 24.18 13.68 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.488 -0.778 . . . . 10.0 111.048 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.411 ' HG3' ' HB2' ' A' ' 78' ' ' GLN . 41.5 tttt -128.03 133.13 49.08 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.251 -179.605 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.591 HD12 ' HB2' ' A' ' 72' ' ' ALA . 17.2 mt -89.04 121.44 31.38 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.595 -0.891 . . . . 10.0 108.595 178.425 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.449 ' HG ' ' HB2' ' A' ' 80' ' ' SER . 0.3 OUTLIER -117.34 122.95 45.31 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.174 0.511 . . . . 10.0 110.876 -179.358 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.531 ' CG1' HD21 ' A' ' 83' ' ' LEU . 1.8 t -111.26 121.03 63.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.632 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -134.94 146.05 57.09 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.076 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -76.54 150.77 32.09 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.316 2.011 . . . . 10.0 111.676 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.323 -0.576 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.659 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.8 t80 . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 109.931 -0.396 . . . . 10.0 109.931 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.8 m -76.95 122.81 25.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.728 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' TYR . . . . . 0.465 ' O ' ' HA ' ' A' ' 97' ' ' SER . 95.2 m-85 -89.96 121.99 32.56 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.562 -0.744 . . . . 10.0 109.979 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.415 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 19.8 pt20 -152.21 153.06 33.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.688 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ALA . . . . . 0.446 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -86.17 121.26 28.52 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 52.2 p -111.54 154.41 43.86 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-O 120.69 0.281 . . . . 10.0 111.322 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.92 -10.54 27.26 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.726 2.284 . . . . 10.0 111.83 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 21.4 mmt -82.4 -18.54 41.61 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.189 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -79.35 -52.78 7.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.694 -0.685 . . . . 10.0 109.575 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 92.82 -67.35 1.85 Allowed Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.464 -0.789 . . . . 10.0 112.855 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' THR . . . . . 0.498 HG21 ' OD2' ' A' ' 86' ' ' ASP . 28.4 p -118.58 169.39 9.83 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.79 0.329 . . . . 10.0 111.512 -179.19 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.525 HD13 ' CE2' ' A' ' 112' ' ' TYR . 41.2 tp -59.35 -36.43 75.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.679 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -61.16 -58.3 8.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.527 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.39 -33.31 75.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.161 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.448 ' HB2' ' O ' ' A' ' 63' ' ' THR . 4.4 tmm? -63.03 -54.8 32.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.733 -0.667 . . . . 10.0 111.166 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.0 mp -68.42 -31.52 70.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.317 -0.401 . . . . 10.0 111.263 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -57.84 -43.5 85.88 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.706 -0.479 . . . . 10.0 109.706 178.564 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -68.47 -42.35 78.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.119 179.483 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 25.4 m0 -55.85 -55.42 32.67 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.624 -0.717 . . . . 10.0 110.683 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.82 -45.54 85.79 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.072 -0.967 . . . . 10.0 111.702 -178.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.95 -40.76 90.07 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.929 0.344 . . . . 10.0 111.929 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -66.24 -27.83 68.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.012 0.434 . . . . 10.0 111.51 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.405 ' HB2' ' SD ' ' A' ' 77' ' ' MET . 4.0 m -108.76 11.65 26.18 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 -178.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 55.55 48.42 18.76 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.589 0.709 . . . . 10.0 110.67 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.405 ' SD ' ' HB2' ' A' ' 75' ' ' SER . 59.1 mtp -114.65 168.09 10.18 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.164 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.424 ' HB3' ' HG3' ' A' ' 125' ' ' LYS . 2.0 mm-40 -99.88 158.99 15.42 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.655 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 26.8 tp -132.83 128.26 36.31 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.571 0.7 . . . . 10.0 110.935 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.418 ' HB2' HD13 ' A' ' 127' ' ' LEU . 69.4 m -114.96 94.75 4.89 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 114.972 -1.013 . . . . 10.0 109.427 178.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.5 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 12.5 t80 -94.45 101.46 13.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.808 -179.164 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -105.23 28.37 7.36 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.99 0.424 . . . . 10.0 111.473 -179.096 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.49 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 34.2 mt -96.01 145.85 30.27 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.052 179.519 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.4 -38.43 89.33 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 123.183 2.589 . . . . 10.0 112.547 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.4 m -150.73 171.09 17.71 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.992 0.425 . . . . 10.0 110.888 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.5 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 8.9 p-10 -83.1 131.56 35.14 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.718 -0.674 . . . . 10.0 109.839 179.323 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -103.79 131.74 50.7 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.747 -179.29 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.65 150.8 48.53 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.441 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LEU . . . . . 0.449 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -58.28 108.86 0.67 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 120.977 0.418 . . . . 10.0 110.09 178.481 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.2 pt -52.57 -37.93 25.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.071 -0.968 . . . . 10.0 112.91 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 141.17 -72.38 0.4 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.291 -0.957 . . . . 10.0 112.071 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -57.07 -17.05 23.3 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 123.039 2.493 . . . . 10.0 112.367 179.568 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 10.2 p -63.8 -32.0 55.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.512 0.672 . . . . 10.0 110.267 178.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.446 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.4 m -72.53 -7.42 49.93 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.153 -0.931 . . . . 10.0 111.08 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.2 -4.72 48.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.315 0.578 . . . . 10.0 110.237 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.415 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 65.1 mt -92.2 112.51 25.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 CA-C-N 115.422 -0.808 . . . . 10.0 109.82 -179.368 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.465 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 1.7 m -142.61 97.9 3.2 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.605 -0.725 . . . . 10.0 109.821 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.1 t -131.38 157.16 44.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.747 0.308 . . . . 10.0 110.888 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.03 -21.79 39.88 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.786 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.2 t -90.16 119.03 30.14 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.771 0.32 . . . . 10.0 110.491 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.0 p -65.04 -31.69 55.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.85 0.357 . . . . 10.0 110.556 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -68.9 -41.24 78.51 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 109.546 -0.539 . . . . 10.0 109.546 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -66.75 -41.43 87.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.845 179.226 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.57 -47.09 76.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.158 178.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.11 -35.21 80.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.295 178.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 86.0 m -65.58 -48.42 72.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.228 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -65.17 -37.56 87.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.089 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.8 mp -63.91 -52.78 58.29 Favored 'General case' 0 C--O 1.219 -0.508 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.22 178.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.6 m -57.91 -29.61 65.24 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.967 0.358 . . . . 10.0 111.967 -179.307 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.2 -45.78 91.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.255 0.55 . . . . 10.0 110.51 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.718 HG13 ' HD1' ' A' ' 112' ' ' TYR . 11.9 p -89.55 -22.65 6.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.756 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' TYR . . . . . 0.718 ' HD1' HG13 ' A' ' 111' ' ' VAL . 3.7 m-85 -83.13 -24.08 32.74 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.143 0.794 . . . . 10.0 113.143 -178.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.63 -40.11 38.23 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.077 0.399 . . . . 10.0 112.077 -179.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.47 -19.49 63.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.103 0.478 . . . . 10.0 111.402 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -93.72 -2.57 53.63 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.398 0.618 . . . . 10.0 109.632 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.22 23.33 52.01 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 115.466 -0.788 . . . . 10.0 112.625 179.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 60.8 t -124.55 140.25 48.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.026 0.441 . . . . 10.0 111.546 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 6.6 m -139.94 122.6 16.34 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.359 -0.608 . . . . 10.0 109.359 178.26 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 10.8 m -114.65 149.35 16.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.143 0.497 . . . . 10.0 111.358 -178.507 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.0 p -152.13 170.47 19.89 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.088 -0.506 . . . . 10.0 109.872 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' VAL . . . . . 0.503 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.5 t -125.7 119.07 53.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.173 -0.677 . . . . 10.0 109.173 179.508 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 15.3 m -128.73 109.62 11.47 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.028 -179.227 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 58.99 57.69 3.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.63 -0.714 . . . . 10.0 112.06 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 19.9 t30 61.13 21.6 12.0 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.569 -0.742 . . . . 10.0 111.782 178.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.424 ' HG3' ' HB3' ' A' ' 78' ' ' GLN . 47.8 tttt -125.54 133.12 52.45 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.984 -0.376 . . . . 10.0 109.984 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.503 ' CD2' HG22 ' A' ' 121' ' ' VAL . 69.6 mt -87.95 122.23 31.31 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.511 -0.551 . . . . 10.0 109.511 179.307 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.418 HD13 ' HB2' ' A' ' 80' ' ' SER . 3.9 mm? -107.93 117.24 33.6 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.533 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 11.5 t -109.05 118.06 55.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 108.515 -0.92 . . . . 10.0 108.515 178.464 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -134.19 141.66 40.24 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-O 120.766 0.317 . . . . 10.0 110.569 -179.036 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -81.31 145.21 14.97 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.313 2.009 . . . . 10.0 111.365 179.026 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 1.7 m . . . . . 0 C--N 1.323 -0.579 0 C-N-CA 120.942 -0.303 . . . . 10.0 110.617 179.381 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.729 0 N-CA-C 111.421 -0.671 . . . . 10.0 111.421 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.5 m -142.44 134.28 27.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.034 0.445 . . . . 10.0 111.157 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -125.64 76.11 1.54 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.732 -0.84 . . . . 10.0 108.732 178.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 17.5 ttt -68.47 110.41 4.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.584 -0.735 . . . . 10.0 110.929 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.52 105.92 5.87 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.793 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -77.57 137.54 63.23 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 109.774 -0.454 . . . . 10.0 109.774 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.11 111.66 0.81 Allowed 'Trans proline' 0 C--O 1.235 0.349 0 C-N-CA 122.835 2.356 . . . . 10.0 112.037 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -120.03 145.79 40.69 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.538 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -79.67 149.78 21.14 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.708 2.272 . . . . 10.0 112.209 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -89.14 171.63 9.67 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.951 -0.388 . . . . 10.0 109.951 179.509 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -125.47 153.6 43.27 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.658 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 148.08 -126.39 2.32 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.847 -0.692 . . . . 10.0 111.846 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -157.02 27.18 0.51 Allowed Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.471 -0.871 . . . . 10.0 112.59 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 34.3 ptt180 -78.06 -30.31 49.69 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.829 0.347 . . . . 10.0 110.773 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 15.5 m95 -72.9 -44.65 61.01 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.569 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.45 -21.69 60.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.17 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -74.6 102.69 4.64 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.154 0.502 . . . . 10.0 110.35 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.2 m -106.69 146.14 13.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 115.376 -0.829 . . . . 10.0 110.648 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -111.93 125.72 54.36 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.385 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 4.9 p-80 -165.11 175.71 9.14 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.011 -0.54 . . . . 10.0 109.906 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -135.58 113.34 10.98 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.919 0.39 . . . . 10.0 111.142 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -86.53 -35.13 19.72 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.606 -0.887 . . . . 10.0 108.606 178.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -98.5 -170.19 1.91 Allowed 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 114.702 -1.135 . . . . 10.0 108.923 178.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.74 143.43 84.63 Favored Pre-proline 0 C--N 1.318 -0.784 0 C-N-CA 120.736 -0.385 . . . . 10.0 110.026 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.38 -59.64 0.73 Allowed 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.61 2.207 . . . . 10.0 112.494 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.5 m -144.92 99.77 3.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.984 0.421 . . . . 10.0 110.873 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -84.84 97.95 10.02 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.302 -0.408 . . . . 10.0 111.066 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 pt -119.96 90.86 44.73 Favored Pre-proline 0 C--N 1.32 -0.699 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.351 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -76.02 52.08 3.32 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 123.452 2.768 . . . . 10.0 112.825 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 18.6 tp -159.79 146.14 16.06 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.383 -0.826 . . . . 10.0 109.651 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -69.51 105.64 2.71 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.675 -0.491 . . . . 10.0 109.675 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.45 129.76 43.59 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.047 -179.327 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.7 m -134.07 103.46 5.8 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.245 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -75.54 130.33 38.68 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.496 -0.774 . . . . 10.0 110.703 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.6 m -85.41 119.03 25.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.219 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -88.64 113.34 24.11 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.022 -0.733 . . . . 10.0 109.022 179.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -153.73 158.57 41.17 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.018 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.52 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -73.85 139.08 44.81 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.817 -0.809 . . . . 10.0 108.817 178.36 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.2 p -126.23 161.82 49.8 Favored Pre-proline 0 C--N 1.319 -0.725 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.353 -177.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -75.53 12.33 1.38 Allowed 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 121.93 1.754 . . . . 10.0 112.326 179.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 16.2 ptt? -111.27 -17.17 13.23 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.426 0.528 . . . . 10.0 112.426 -179.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.17 -61.67 1.87 Allowed 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.17 -0.612 . . . . 10.0 110.669 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.18 -53.59 2.49 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.731 -0.747 . . . . 10.0 112.019 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 61.8 p -126.78 166.44 17.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.727 0.298 . . . . 10.0 111.058 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.401 HD13 ' CE2' ' A' ' 112' ' ' TYR . 62.6 tp -56.23 -45.35 79.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.815 -0.63 . . . . 10.0 111.168 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -56.48 -54.57 44.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.646 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.89 -35.99 78.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.586 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.413 ' HE3' HD21 ' A' ' 108' ' ' LEU . 50.5 ttp -64.03 -50.5 68.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.367 -0.378 . . . . 10.0 110.218 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 71.3 mt -64.76 -34.75 79.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.248 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -60.0 -50.02 75.4 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.163 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -66.43 -40.69 89.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.235 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 31.3 m0 -57.64 -54.3 48.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.152 0.501 . . . . 10.0 110.829 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.92 -42.4 81.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.699 -0.682 . . . . 10.0 111.944 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.42 -40.56 78.6 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.564 0.579 . . . . 10.0 112.564 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -60.5 -39.33 87.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.905 0.383 . . . . 10.0 111.415 -179.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.403 ' HB2' ' HG3' ' A' ' 77' ' ' MET . 8.7 m -97.78 11.98 35.4 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.36 -179.273 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 m120 56.06 39.96 30.35 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.532 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.403 ' HG3' ' HB2' ' A' ' 75' ' ' SER . 5.2 mtm -102.88 164.09 11.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.783 -0.644 . . . . 10.0 109.488 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 -96.82 157.86 15.7 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.565 -0.288 . . . . 10.0 110.953 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 34.0 tp -128.74 138.06 51.91 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.194 0.521 . . . . 10.0 110.649 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.24 96.16 4.98 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.121 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.509 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 16.4 t80 -95.45 98.83 10.84 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.708 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -101.77 37.87 1.74 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.858 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.509 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 44.2 mt -106.01 142.15 24.24 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -61.04 -30.31 89.33 Favored 'Trans proline' 0 CA--C 1.529 0.23 0 C-N-CA 122.764 2.31 . . . . 10.0 113.313 -179.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.2 m -145.69 166.85 24.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.893 0.378 . . . . 10.0 111.494 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.38 124.97 39.68 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.214 -0.662 . . . . 10.0 109.214 179.331 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -110.27 156.7 20.33 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.554 0.216 . . . . 10.0 110.714 -178.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.8 OUTLIER -79.99 177.02 9.22 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.727 179.574 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.98 134.54 41.45 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.41 HG12 ' H ' ' A' ' 90' ' ' ILE . 1.7 pt -65.87 -28.8 44.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 112.517 0.562 . . . . 10.0 112.517 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 138.03 -62.72 0.57 Allowed Glycine 0 CA--C 1.52 0.36 0 C-N-CA 120.296 -0.954 . . . . 10.0 113.618 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.86 7.99 1.47 Allowed 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.534 2.156 . . . . 10.0 113.151 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.9 t -69.41 -45.63 78.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.939 0.4 . . . . 10.0 110.658 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.52 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.0 OUTLIER -65.77 -13.75 60.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.593 179.85 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.68 1.8 47.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.031 0.443 . . . . 10.0 110.875 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.418 HD13 HD12 ' A' ' 108' ' ' LEU . 46.6 mt -107.62 107.2 22.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.181 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.4 97.61 4.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.048 0.451 . . . . 10.0 111.128 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.2 t -130.74 155.95 45.78 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.711 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.12 -6.26 55.6 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.235 0.541 . . . . 10.0 110.816 179.372 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 19.4 t -98.46 116.24 30.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.287 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.15 -31.63 54.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.186 0.517 . . . . 10.0 110.059 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -68.12 -43.47 78.33 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.798 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.6 tp60 -67.77 -41.21 83.63 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.286 -0.416 . . . . 10.0 110.343 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.96 -49.15 72.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.413 179.151 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.16 -36.95 85.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.461 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 98.9 m -63.37 -43.81 96.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.824 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -70.78 -41.36 71.81 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.454 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.418 HD12 HD13 ' A' ' 96' ' ' ILE . 2.0 mp -61.92 -51.17 69.22 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.91 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.7 p -58.31 -25.52 61.96 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.172 0.434 . . . . 10.0 112.172 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.36 -43.65 66.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.029 0.443 . . . . 10.0 111.149 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.439 HG13 ' HD1' ' A' ' 112' ' ' TYR . 10.5 p -87.56 -24.5 6.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.203 0.525 . . . . 10.0 111.291 -179.325 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.439 ' HD1' HG13 ' A' ' 111' ' ' VAL . 8.0 m-85 -79.79 -24.28 41.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.795 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.485 ' O ' HG21 ' A' ' 133' ' ' VAL . . . -51.28 -36.43 42.27 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.438 -0.346 . . . . 10.0 111.643 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.65 -27.09 68.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.959 0.409 . . . . 10.0 111.664 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -91.97 -11.98 34.61 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.715 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.449 ' HA2' HG23 ' A' ' 131' ' ' VAL . . . 93.45 27.46 13.13 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.622 -0.799 . . . . 10.0 112.107 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 57.8 t -124.53 125.67 70.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.798 0.332 . . . . 10.0 111.076 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.4 m -122.67 113.87 19.82 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.188 178.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 16.4 m -105.39 142.33 18.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.801 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 41.6 m -152.46 166.27 32.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.015 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.504 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.5 t -117.73 128.4 74.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 110.111 -0.329 . . . . 10.0 110.111 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.6 m -147.6 120.86 8.94 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.728 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 61.68 43.13 10.11 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 123.636 0.585 . . . . 10.0 111.559 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 19.1 m120 62.33 26.61 15.91 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.727 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -130.31 132.8 46.04 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.61 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.504 ' CD2' HG22 ' A' ' 121' ' ' VAL . 97.4 mt -88.61 122.72 32.36 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 108.62 -0.882 . . . . 10.0 108.62 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -112.79 122.76 48.59 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.331 0.586 . . . . 10.0 111.234 -178.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.2 t -108.17 119.21 57.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.269 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -128.45 138.49 33.16 Favored Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 110.032 -0.358 . . . . 10.0 110.032 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.425 ' HA ' ' O ' ' A' ' 116' ' ' GLY . 69.4 Cg_endo -77.96 135.02 13.66 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 121.98 1.786 . . . . 10.0 111.855 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.449 HG23 ' HA2' ' A' ' 116' ' ' GLY . 3.2 m -108.65 145.0 30.71 Favored Pre-proline 0 C--N 1.319 -0.727 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.347 179.521 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -77.99 103.21 1.67 Allowed 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.465 2.11 . . . . 10.0 112.251 -179.496 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.485 HG21 ' O ' ' A' ' 113' ' ' ALA . 2.5 m -136.71 26.33 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.591 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 7.7 m -89.75 -24.19 21.59 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.911 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 14.1 m -150.08 101.01 2.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.931 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -79.79 -18.37 73.0 Favored Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.937 -0.574 . . . . 10.0 112.789 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -118.26 43.37 2.48 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.105 0.479 . . . . 10.0 110.657 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.3 pptp? -87.06 170.09 11.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.103 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 14.7 tp . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.641 -0.695 . . . . 10.0 109.6 179.504 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.718 0 N-CA-C 111.682 -0.567 . . . . 10.0 111.682 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.5 m -58.94 113.63 2.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.696 0.284 . . . . 10.0 110.421 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 31.1 t-80 -111.56 102.46 10.8 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.025 0.44 . . . . 10.0 110.51 -179.323 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 34.8 tpp -96.96 91.97 5.87 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.073 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 0.2 OUTLIER -86.71 -36.42 18.69 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.807 179.857 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 24' ' ' THR . 13.1 mmtm 68.67 134.77 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.278 0 O-C-N 124.044 0.84 . . . . 10.0 111.504 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -64.17 109.33 1.12 Allowed 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 122.55 2.167 . . . . 10.0 111.866 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -129.83 142.28 44.79 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.638 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -66.19 117.58 4.8 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.639 2.226 . . . . 10.0 111.457 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -70.23 -61.14 1.89 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.371 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -153.04 175.76 12.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.064 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -92.58 41.52 2.75 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.977 -0.63 . . . . 10.0 112.087 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -86.95 -74.45 1.28 Allowed Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.723 -0.751 . . . . 10.0 112.233 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.4 tpp85 63.93 23.49 13.35 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.098 0.559 . . . . 10.0 111.606 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 50.4 m95 59.57 80.41 0.2 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.094 0.473 . . . . 10.0 110.855 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -76.33 82.55 3.09 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.377 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -105.47 81.18 1.66 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.54 -0.754 . . . . 10.0 109.062 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -145.95 119.49 2.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.384 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -146.81 116.54 7.17 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.0 p-80 -95.56 121.71 37.54 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.338 0.589 . . . . 10.0 111.241 -178.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -145.82 146.44 31.16 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.189 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -147.31 131.16 17.07 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.245 0.545 . . . . 10.0 110.301 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -136.2 166.54 23.18 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.676 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -139.6 141.85 29.67 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.87 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.73 65.11 6.7 Favored 'Trans proline' 0 N--CA 1.464 -0.234 0 C-N-CA 122.7 2.267 . . . . 10.0 112.489 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.8 m -80.81 97.4 7.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.016 0.436 . . . . 10.0 111.198 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -119.32 144.47 46.82 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.0 pt -133.62 79.71 58.54 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-O 120.957 0.408 . . . . 10.0 111.003 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -72.13 106.11 1.97 Allowed 'Trans proline' 0 N--CA 1.462 -0.372 0 C-N-CA 122.564 2.176 . . . . 10.0 111.831 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 38.1 tp -126.64 144.99 50.74 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.166 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -107.43 133.54 51.78 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.512 -0.551 . . . . 10.0 109.512 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.78 132.95 52.52 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.926 0.393 . . . . 10.0 111.183 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 10.0 m -138.6 94.48 2.85 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.652 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -68.92 126.18 28.98 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.313 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 30.4 m -75.36 121.29 22.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.831 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -86.47 116.54 24.68 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.408 -0.814 . . . . 10.0 109.088 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -145.85 147.74 32.13 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.187 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.797 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -74.77 112.14 10.68 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.733 -0.469 . . . . 10.0 109.733 178.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.425 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 26.2 p -107.55 157.26 36.21 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.799 -179.143 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.425 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 37.3 Cg_endo -65.99 -11.21 30.03 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.348 2.032 . . . . 10.0 111.255 178.562 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 51.3 mtt -77.74 -29.42 51.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.64 -0.709 . . . . 10.0 109.891 179.034 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -75.88 -51.67 12.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.221 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 81.2 -63.14 4.37 Favored Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.478 -0.783 . . . . 10.0 113.64 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 43.8 p -113.1 169.33 9.01 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.881 0.372 . . . . 10.0 111.67 -178.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.495 HD13 ' HE2' ' A' ' 112' ' ' TYR . 66.9 tp -63.46 -47.42 81.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.64 -0.709 . . . . 10.0 111.227 -179.468 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 34.1 ttmt -56.11 -55.99 26.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.222 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.0 m -61.37 -32.45 72.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.845 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 55.9 ttp -68.99 -51.19 41.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.938 0.399 . . . . 10.0 110.35 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.1 mt -62.35 -35.66 79.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.703 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -61.44 -40.94 96.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.558 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -68.66 -40.55 80.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.278 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.441 ' CZ3' ' HB1' ' A' ' 104' ' ' ALA . 43.7 m0 -64.13 -50.01 69.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.447 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.547 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -60.48 -37.14 80.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.199 179.376 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.45 -34.71 77.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.567 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.06 -41.32 95.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.331 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.76 7.69 45.59 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.33 0.492 . . . . 10.0 112.33 -177.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 60.72 53.22 4.04 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.59 0.71 . . . . 10.0 109.856 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.487 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 22.0 mtm -124.43 171.22 10.12 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.831 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -106.24 171.11 7.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.468 -0.333 . . . . 10.0 110.585 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.3 tp -133.27 133.53 42.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.149 0.5 . . . . 10.0 111.578 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -119.24 95.9 4.99 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.467 -0.788 . . . . 10.0 109.506 178.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.467 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 6.7 t80 -88.98 98.52 11.8 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.697 -0.683 . . . . 10.0 109.394 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.419 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 64.3 m-80 -101.81 37.09 1.9 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.283 0.563 . . . . 10.0 110.898 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.437 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 33.7 mt -101.21 145.44 30.44 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.816 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -62.35 -40.29 41.06 Favored 'Trans proline' 0 N--CA 1.464 -0.232 0 C-N-CA 122.617 2.211 . . . . 10.0 111.531 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -138.72 141.85 38.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.727 -0.669 . . . . 10.0 110.083 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.467 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 15.1 t70 -78.56 131.31 36.72 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.741 -0.466 . . . . 10.0 109.741 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -100.58 148.19 25.09 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.111 0.482 . . . . 10.0 111.532 -178.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.9 m -81.84 147.52 29.31 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.494 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -54.31 123.81 14.02 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 121.097 0.475 . . . . 10.0 111.372 179.345 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.46 HD12 ' HG2' ' A' ' 92' ' ' PRO . 24.2 pt -80.99 -164.28 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.508 -0.769 . . . . 10.0 110.733 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -77.18 -68.84 1.46 Allowed Glycine 0 CA--C 1.522 0.511 0 C-N-CA 120.836 -0.697 . . . . 10.0 113.304 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.46 ' HG2' HD12 ' A' ' 90' ' ' ILE . 13.8 Cg_endo -56.96 -14.55 14.55 Favored 'Trans proline' 0 N--CA 1.477 0.517 0 C-N-CA 123.592 2.861 . . . . 10.0 115.267 -178.111 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.413 HG22 ' HB2' ' A' ' 57' ' ' ALA . 12.6 p -68.93 -40.49 81.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.303 0.573 . . . . 10.0 110.406 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.797 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 2.1 m -67.82 -12.52 60.78 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.556 -0.747 . . . . 10.0 111.379 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.06 1.84 56.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.298 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 54.4 mt -96.69 111.39 26.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.254 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.7 m -130.11 100.67 5.5 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.675 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 15.4 t -129.72 155.46 45.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.785 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.64 10.09 38.0 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.085 0.402 . . . . 10.0 112.085 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.6 t -125.55 127.49 46.47 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.679 0.276 . . . . 10.0 110.71 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 6.0 p -66.4 -28.59 43.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.252 0.548 . . . . 10.0 110.249 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -70.72 -44.83 66.08 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.565 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -66.63 -38.62 87.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.871 -0.604 . . . . 10.0 109.902 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.441 ' HB1' ' CZ3' ' A' ' 71' ' ' TRP . . . -56.6 -50.42 72.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.864 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.48 -29.93 71.13 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.265 0.555 . . . . 10.0 110.551 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 36.9 m -69.03 -50.85 44.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.67 -0.695 . . . . 10.0 110.972 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -67.73 -36.96 81.53 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.055 -0.52 . . . . 10.0 111.652 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 26.7 mt -59.51 -50.01 75.57 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.704 0.288 . . . . 10.0 110.814 179.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.6 m -60.52 -27.76 67.87 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.356 -0.384 . . . . 10.0 111.937 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.89 -41.67 77.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.825 0.345 . . . . 10.0 111.144 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.8 p -87.48 -35.55 8.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.037 0.446 . . . . 10.0 111.585 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.495 ' HE2' HD13 ' A' ' 64' ' ' LEU . 4.0 m-30 -71.49 -22.19 61.83 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -178.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.45 ' O ' HG21 ' A' ' 133' ' ' VAL . . . -55.39 -22.61 20.55 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.614 0.245 . . . . 10.0 111.334 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.07 -31.04 71.69 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.958 0.409 . . . . 10.0 110.615 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -94.46 -24.11 17.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.314 0.578 . . . . 10.0 109.964 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 106.77 34.37 3.06 Favored Glycine 0 N--CA 1.444 -0.77 0 CA-C-N 115.613 -0.721 . . . . 10.0 112.484 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.447 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 75.8 t -124.44 135.96 62.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.743 0.306 . . . . 10.0 110.298 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.1 m -136.1 132.22 35.82 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.108 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 7.5 m -120.73 149.29 23.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.275 0.56 . . . . 10.0 111.87 -178.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 58.3 m -155.21 154.45 32.26 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.668 179.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 1.7 p -110.83 119.55 59.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.981 0.419 . . . . 10.0 109.896 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.0 m -137.14 128.47 28.14 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.221 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 58.49 43.6 19.21 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 123.692 0.62 . . . . 10.0 111.447 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.487 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 9.8 m-20 58.27 39.28 25.8 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.902 0.858 . . . . 10.0 110.193 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 69.5 tttt -145.3 128.94 17.14 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.892 -1.049 . . . . 10.0 109.239 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.547 HD12 ' HB2' ' A' ' 72' ' ' ALA . 20.7 mt -88.01 121.73 30.76 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 108.265 -1.013 . . . . 10.0 108.265 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.38 123.93 51.23 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.163 0.506 . . . . 10.0 111.428 -178.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.419 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 2.9 t -102.11 120.82 52.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.223 179.065 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -129.91 133.33 24.88 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.112 -179.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.23 131.9 9.99 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.113 1.875 . . . . 10.0 111.993 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 4.5 m -99.66 139.75 21.08 Favored Pre-proline 0 C--N 1.318 -0.803 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.18 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -80.27 94.12 1.02 Allowed 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.637 2.225 . . . . 10.0 111.377 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.45 HG21 ' O ' ' A' ' 113' ' ' ALA . 6.0 m -126.49 24.55 2.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 121.249 0.547 . . . . 10.0 111.177 -179.188 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.52 -23.05 19.22 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.772 -179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.84 166.2 29.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.218 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -90.62 -73.34 1.27 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.873 -0.68 . . . . 10.0 112.069 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -145.42 96.7 2.87 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.943 0.401 . . . . 10.0 110.535 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 9.9 ptmt -126.48 166.59 16.95 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.478 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 31.0 tp . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.579 -0.724 . . . . 10.0 109.719 179.467 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.691 0 N-CA-C 111.957 -0.457 . . . . 10.0 111.957 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.9 m -105.33 154.39 20.34 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -64.92 135.67 55.96 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.091 -0.337 . . . . 10.0 110.091 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.5 mmt -76.48 -78.45 0.12 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.82 0.343 . . . . 10.0 110.742 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 t -156.04 144.15 19.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.157 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 37.4 mtpt -104.98 140.66 21.3 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.476 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -64.07 108.76 1.0 Allowed 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.801 2.334 . . . . 10.0 112.019 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.37 141.5 23.6 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.451 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -64.1 123.66 12.24 Favored 'Trans proline' 0 C--O 1.237 0.435 0 C-N-CA 122.509 2.14 . . . . 10.0 111.681 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.79 -178.67 7.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.773 -0.649 . . . . 10.0 111.063 -179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -127.33 154.1 45.37 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.444 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -116.59 172.26 14.15 Favored Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.936 -0.65 . . . . 10.0 111.786 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.55 15.0 59.09 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.948 -0.644 . . . . 10.0 111.988 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 33' ' ' ARG . 73.1 mtt180 -81.22 -14.12 57.85 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.992 0.425 . . . . 10.0 110.704 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 74.0 m95 -106.91 24.07 13.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.988 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.6 mtmp? -87.95 69.78 9.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.877 0.37 . . . . 10.0 110.995 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -88.83 85.13 6.69 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.694 -0.484 . . . . 10.0 109.694 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.2 m -140.25 141.24 33.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.446 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -145.23 118.01 8.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.006 0.431 . . . . 10.0 110.552 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -84.25 59.53 5.41 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.18 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -78.32 119.37 21.57 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.581 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -97.64 117.99 33.17 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.871 -0.604 . . . . 10.0 109.991 179.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -85.35 144.11 28.25 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.879 0.371 . . . . 10.0 111.13 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -157.38 143.49 12.89 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.428 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -70.72 117.22 5.02 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.487 2.125 . . . . 10.0 112.008 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.2 m -76.43 115.16 15.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.553 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -71.13 113.03 7.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.121 0.486 . . . . 10.0 110.618 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.7 pt -129.01 87.05 55.6 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.984 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_exo -70.85 81.91 1.04 Allowed 'Trans proline' 0 N--CA 1.464 -0.262 0 C-N-CA 123.127 2.551 . . . . 10.0 111.656 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 49' ' ' LEU . 0.3 OUTLIER -137.28 101.94 4.67 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.652 -0.704 . . . . 10.0 109.918 -179.876 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -99.5 149.4 23.26 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.646 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.8 107.49 0.71 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.134 0.492 . . . . 10.0 111.009 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 9.8 m -146.94 88.25 1.73 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.959 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -65.15 129.4 39.59 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.815 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.1 m -82.63 120.85 26.08 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.682 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -86.81 113.14 22.38 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.11 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -152.07 151.39 31.04 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.476 -0.783 . . . . 10.0 109.721 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -85.33 125.84 33.26 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.889 -0.412 . . . . 10.0 109.889 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.7 p -105.31 149.56 37.88 Favored Pre-proline 0 C--N 1.321 -0.646 0 C-N-CA 120.885 -0.326 . . . . 10.0 110.704 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -64.69 -12.29 33.15 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.643 2.228 . . . . 10.0 111.951 179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 40.1 mtt -85.25 -14.15 47.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.456 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -78.77 -48.64 14.47 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.259 -0.645 . . . . 10.0 109.259 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.58 -64.18 4.34 Favored Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.324 -0.853 . . . . 10.0 113.612 178.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 28.0 p -113.3 168.4 9.76 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 112.212 0.449 . . . . 10.0 112.212 -178.057 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 47.2 tp -66.01 -43.21 88.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.723 -0.671 . . . . 10.0 111.797 -179.143 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -55.25 -54.43 43.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.978 0.418 . . . . 10.0 110.42 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.1 m -64.75 -38.99 92.85 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.712 -0.676 . . . . 10.0 111.52 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.413 ' HB2' ' O ' ' A' ' 63' ' ' THR . 9.5 tmm? -61.89 -48.4 80.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.976 0.417 . . . . 10.0 111.164 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 57.6 mt -68.12 -31.35 70.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.319 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -62.24 -42.17 99.08 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.728 -0.471 . . . . 10.0 109.728 179.015 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' A' ' 74' ' ' ASP . 17.1 mmm-85 -60.6 -42.57 97.04 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.214 178.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 37.1 m0 -60.13 -55.29 35.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.59 -0.732 . . . . 10.0 111.07 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.49 -47.37 84.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.907 -179.278 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.46 -35.75 80.29 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -178.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.482 ' HB2' ' O ' ' A' ' 70' ' ' ARG . 0.4 OUTLIER -73.4 -23.97 60.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.756 0.312 . . . . 10.0 111.805 -179.211 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.4 t -108.63 7.15 26.45 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.854 -0.339 . . . . 10.0 111.555 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 65.2 t30 62.18 38.84 13.33 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.606 0.717 . . . . 10.0 110.374 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 68.3 mtp -111.08 173.6 6.26 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.219 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.405 ' HB2' ' HG3' ' A' ' 125' ' ' LYS . 88.6 mm-40 -108.15 158.72 17.18 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.531 -0.304 . . . . 10.0 110.252 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.7 tp -133.07 136.91 46.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.984 0.421 . . . . 10.0 110.891 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.578 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 3.9 m -124.12 97.64 5.43 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.709 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.544 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 4.6 t80 -86.06 97.41 10.28 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.742 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -104.65 29.35 6.25 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.943 0.401 . . . . 10.0 111.03 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.544 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 57.4 mt -89.12 146.87 37.23 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.45 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -57.64 -35.85 98.7 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.637 2.225 . . . . 10.0 111.856 179.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.0 m -151.31 155.98 39.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.904 -0.589 . . . . 10.0 109.924 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.417 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 37.7 t0 -77.84 130.83 37.14 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.603 -0.518 . . . . 10.0 109.603 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -104.73 140.04 38.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.03 0.443 . . . . 10.0 111.349 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 2.9 m -81.27 149.04 29.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.34 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.436 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -55.28 112.81 1.18 Allowed 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.872 0.368 . . . . 10.0 110.817 179.564 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 11.0 pt -65.19 -36.72 78.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.862 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 149.36 -71.5 0.3 Allowed Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.38 -0.914 . . . . 10.0 113.335 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -50.78 -17.74 3.47 Favored 'Trans proline' 0 N--CA 1.48 0.694 0 C-N-CA 123.775 2.984 . . . . 10.0 113.832 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.412 HG23 ' H ' ' A' ' 93' ' ' VAL . 0.4 OUTLIER -60.91 -37.26 76.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.118 0.485 . . . . 10.0 110.882 179.499 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.0 -9.08 57.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.494 -179.596 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -92.11 -0.93 57.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.164 0.507 . . . . 10.0 110.561 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.407 HD13 HD12 ' A' ' 108' ' ' LEU . 56.7 mt -100.34 116.39 43.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.962 -0.563 . . . . 10.0 109.525 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -142.49 95.48 2.8 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.736 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 11.9 t -130.91 154.32 48.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.449 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.02 -13.9 43.1 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.223 -0.444 . . . . 10.0 111.117 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.0 m -91.65 116.1 28.6 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.358 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.6 p -60.82 -36.48 71.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.351 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -67.56 -38.06 83.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.125 0.488 . . . . 10.0 109.893 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -67.35 -42.63 83.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.885 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.62 -47.73 81.37 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.348 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.31 -34.05 76.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.482 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 81.8 m -68.58 -50.91 48.13 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.078 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -64.04 -40.77 97.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.3 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.407 HD12 HD13 ' A' ' 96' ' ' ILE . 2.1 mp -63.56 -49.28 74.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.581 -0.281 . . . . 10.0 110.513 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.4 m -61.38 -29.19 69.76 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.499 0.185 . . . . 10.0 111.499 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.15 -42.39 98.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.906 0.384 . . . . 10.0 110.785 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.6 p -88.61 -37.67 10.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.38 0.61 . . . . 10.0 111.245 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.555 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.5 m-30 -72.65 -23.13 60.86 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 113.994 1.109 . . . . 10.0 113.994 -177.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.29 -36.93 33.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.568 0.223 . . . . 10.0 111.216 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.95 -32.23 70.38 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.948 0.404 . . . . 10.0 110.534 179.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -79.92 -9.85 59.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.439 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.445 ' HA2' HG23 ' A' ' 131' ' ' VAL . . . 89.28 26.77 24.87 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.827 -0.624 . . . . 10.0 112.33 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.555 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 76.3 t -125.28 129.67 73.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.986 0.422 . . . . 10.0 111.053 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 8.0 t -127.46 113.07 15.7 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.288 -0.634 . . . . 10.0 109.288 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 2.6 m -102.28 135.72 37.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.168 0.509 . . . . 10.0 110.564 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -147.43 141.1 25.6 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.857 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.481 ' HB ' HD23 ' A' ' 126' ' ' LEU . 2.4 p -106.09 124.18 61.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-O 121.249 0.547 . . . . 10.0 109.68 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 64.5 m -142.47 123.12 14.18 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.72 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.4 51.33 5.39 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.811 -0.631 . . . . 10.0 111.48 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.6 m-20 57.41 28.87 16.04 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.815 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.578 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 50.5 tttt -136.29 131.82 34.91 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.321 -0.4 . . . . 10.0 109.991 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.481 HD23 ' HB ' ' A' ' 121' ' ' VAL . 37.7 mt -88.08 120.96 29.93 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.824 -0.806 . . . . 10.0 108.824 178.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -107.32 115.42 30.13 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.381 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.409 HG12 HD21 ' A' ' 83' ' ' LEU . 2.2 t -100.64 116.57 44.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 107.834 -1.173 . . . . 10.0 107.834 177.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -122.47 131.51 24.38 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 116.484 -0.325 . . . . 10.0 110.916 -177.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.434 ' HA ' ' O ' ' A' ' 116' ' ' GLY . 73.8 Cg_endo -79.07 131.85 10.13 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.122 1.881 . . . . 10.0 111.496 178.79 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.445 HG23 ' HA2' ' A' ' 116' ' ' GLY . 8.5 m -106.0 145.14 30.33 Favored Pre-proline 0 C--N 1.317 -0.847 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.424 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -78.83 106.57 2.12 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.664 2.243 . . . . 10.0 111.807 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.451 ' HB ' ' H ' ' A' ' 134' ' ' SER . 1.8 m -135.27 -162.09 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.539 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.451 ' H ' ' HB ' ' A' ' 133' ' ' VAL . 3.7 m -125.82 30.89 5.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.817 0.341 . . . . 10.0 110.574 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.5 m 61.45 34.49 18.1 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.917 -0.583 . . . . 10.0 111.809 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 88.32 48.89 3.88 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.613 -0.803 . . . . 10.0 112.728 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -140.26 122.67 16.04 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.681 0.277 . . . . 10.0 110.478 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -116.1 103.12 10.24 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.356 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 77.4 mt . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.613 -0.708 . . . . 10.0 110.118 179.638 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.788 0 N-CA-C 111.608 -0.597 . . . . 10.0 111.608 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 17.9 m -79.27 74.34 5.86 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.316 0.579 . . . . 10.0 110.921 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.7 t-80 -115.74 141.44 48.08 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.623 -0.717 . . . . 10.0 109.517 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.3 ttt -66.21 -50.73 62.83 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.782 0.325 . . . . 10.0 110.359 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.79 89.49 2.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.267 178.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.482 ' HD2' ' O ' ' A' ' 84' ' ' PRO . 28.3 ttpp -97.31 107.79 40.69 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.848 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.13 140.92 46.33 Favored 'Trans proline' 0 C--O 1.236 0.397 0 C-N-CA 122.455 2.103 . . . . 10.0 111.993 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.455 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . . . -104.61 127.87 28.07 Favored Pre-proline 0 C--N 1.319 -0.72 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.845 -179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 5.5 Cg_exo -74.98 61.32 5.63 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.852 2.368 . . . . 10.0 111.874 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -83.48 170.53 14.34 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.658 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -128.48 100.7 5.88 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.543 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -70.5 -49.77 29.46 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.054 -0.593 . . . . 10.0 112.513 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -88.33 70.35 2.65 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.649 -0.786 . . . . 10.0 112.095 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 56.3 mtm180 -78.92 -167.88 1.27 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.365 0.126 . . . . 10.0 110.689 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 64.0 m95 63.54 31.1 14.99 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.192 0.52 . . . . 10.0 110.786 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -102.01 9.82 40.12 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.811 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -86.64 94.94 9.61 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.883 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.1 m -127.56 -26.36 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.122 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.8 t30 53.01 45.7 28.28 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.56 0.695 . . . . 10.0 110.586 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 5.9 t-160 -87.27 80.42 8.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.188 -0.914 . . . . 10.0 109.966 -179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -146.06 113.75 6.4 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.875 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.04 -42.65 9.31 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.484 -0.326 . . . . 10.0 111.024 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -166.5 170.3 12.96 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.489 -0.323 . . . . 10.0 110.152 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.61 149.71 83.56 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.765 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -58.47 -36.2 97.74 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.934 2.422 . . . . 10.0 112.137 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 m -137.11 127.17 26.01 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.944 -0.571 . . . . 10.0 109.951 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.42 ' H ' ' CD ' ' A' ' 46' ' ' GLU . 1.8 pm0 -79.71 72.48 6.41 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.738 0.78 . . . . 10.0 110.983 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 17.6 pt -131.61 153.59 81.58 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.081 -0.963 . . . . 10.0 109.906 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -75.72 74.42 4.37 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.472 2.114 . . . . 10.0 111.429 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.08 106.86 11.16 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.385 -179.511 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -123.14 114.33 20.18 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.791 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.48 123.9 21.3 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.959 0.409 . . . . 10.0 110.707 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -114.69 82.02 1.66 Allowed 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.272 -0.64 . . . . 10.0 109.272 179.03 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -82.79 131.76 35.19 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.455 -0.793 . . . . 10.0 111.08 -178.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.0 m -81.0 106.22 12.84 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.819 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -77.46 100.11 5.89 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.24 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.448 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 3.0 tt0 -141.86 142.35 33.11 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.98 -1.009 . . . . 10.0 110.223 -178.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.462 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -74.96 122.09 22.94 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.149 -0.685 . . . . 10.0 109.149 178.331 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 22.1 p -94.33 141.37 23.45 Favored Pre-proline 0 C--N 1.318 -0.802 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.723 -179.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -70.26 0.72 5.61 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 122.63 2.22 . . . . 10.0 112.104 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 60.9 mtt -104.71 -6.3 20.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.737 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.54 ' OD1' ' HB ' ' A' ' 66' ' ' THR . 10.9 t70 -72.47 -69.57 0.4 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.831 0.348 . . . . 10.0 110.827 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.446 ' O ' HG22 ' A' ' 88' ' ' THR . . . 113.09 -42.35 1.98 Allowed Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.485 -0.865 . . . . 10.0 114.008 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 72.0 p -135.99 168.64 18.97 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 118.454 1.127 . . . . 10.0 113.664 -177.393 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.461 HD13 ' HE2' ' A' ' 112' ' ' TYR . 60.2 tp -69.67 -48.29 60.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.048 -0.978 . . . . 10.0 111.121 179.278 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.55 ' HD3' ' CD1' ' A' ' 81' ' ' TYR . 25.6 tptp -58.37 -50.16 74.64 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.82 -0.627 . . . . 10.0 111.293 -178.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.54 ' HB ' ' OD1' ' A' ' 61' ' ' ASP . 62.8 m -60.48 -40.77 92.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.705 0.288 . . . . 10.0 110.906 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 47.7 ttp -61.55 -48.04 82.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.951 0.405 . . . . 10.0 110.213 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 79.6 mt -63.87 -37.53 87.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.496 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -62.04 -44.03 97.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.561 178.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.83 -43.89 97.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.392 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.417 ' CZ3' HD11 ' A' ' 108' ' ' LEU . 44.4 m0 -63.76 -50.79 67.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.461 -0.79 . . . . 10.0 111.078 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.564 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -63.41 -47.86 80.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.561 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.25 -41.38 88.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.693 0.282 . . . . 10.0 111.427 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -64.96 -37.57 88.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.951 0.405 . . . . 10.0 111.366 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 7.4 p -91.04 5.59 48.28 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.642 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 63.1 t30 60.47 32.73 20.59 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.629 0.728 . . . . 10.0 110.219 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.44 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 17.4 mtm -107.08 168.57 9.11 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.42 -179.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 -98.46 165.87 11.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.488 -0.324 . . . . 10.0 110.206 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 24.4 tp -133.86 131.23 38.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.123 0.487 . . . . 10.0 111.335 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -116.6 97.1 5.82 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.509 179.138 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.599 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 25.2 t80 -92.07 98.05 11.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.641 -0.708 . . . . 10.0 110.421 -179.034 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -101.23 20.95 14.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.907 0.384 . . . . 10.0 111.122 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.599 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 31.4 mt -80.94 143.21 53.07 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.036 179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.482 ' O ' ' HD2' ' A' ' 25' ' ' LYS . 14.1 Cg_endo -57.3 -45.4 35.15 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.674 2.249 . . . . 10.0 112.448 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.1 m -135.93 168.26 19.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.982 0.42 . . . . 10.0 110.884 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.424 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 0.4 OUTLIER -79.57 135.03 36.5 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.593 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -115.62 162.89 16.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.878 0.37 . . . . 10.0 111.153 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.446 HG22 ' O ' ' A' ' 62' ' ' GLY . 1.2 p -108.37 172.61 6.74 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.658 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.48 114.51 14.11 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.4 pt -62.41 -37.37 78.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.685 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 155.24 -71.73 0.26 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.551 -0.833 . . . . 10.0 112.805 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.33 -2.13 1.21 Allowed 'Trans proline' 0 N--CA 1.481 0.782 0 C-N-CA 123.649 2.899 . . . . 10.0 113.922 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.412 ' H ' HG23 ' A' ' 93' ' ' VAL . 2.3 t -65.8 -44.12 93.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.892 0.377 . . . . 10.0 110.451 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.462 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.7 OUTLIER -65.17 -8.96 19.45 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.028 -0.533 . . . . 10.0 112.053 179.421 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.67 -10.95 54.95 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.063 0.459 . . . . 10.0 110.496 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.448 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 23.8 mt -90.16 107.56 18.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -136.21 91.96 2.73 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.029 0.443 . . . . 10.0 111.088 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.0 t -132.33 155.76 47.81 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.58 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -90.75 -5.63 55.45 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.285 0.564 . . . . 10.0 110.567 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.6 t -95.67 115.58 27.63 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.508 HG13 HG11 ' A' ' 121' ' ' VAL . 13.9 p -64.1 -30.07 49.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.896 0.379 . . . . 10.0 110.405 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -68.71 -43.17 76.57 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.678 178.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -65.3 -42.62 92.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.989 178.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.66 -50.48 73.02 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.846 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.61 -35.2 77.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.235 0.54 . . . . 10.0 110.357 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 99.4 m -66.01 -49.72 66.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.74 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -63.32 -40.57 97.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.487 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.417 HD11 ' CZ3' ' A' ' 71' ' ' TRP . 83.5 mt -61.33 -49.86 75.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.568 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.2 m -59.29 -27.7 66.09 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.48 -42.57 78.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.972 0.415 . . . . 10.0 111.232 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -87.98 -29.6 5.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.971 0.415 . . . . 10.0 111.874 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.541 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.6 m-30 -81.07 -22.69 39.04 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 114.0 1.111 . . . . 10.0 114.0 -177.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.27 -30.23 11.37 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 111.74 0.274 . . . . 10.0 111.74 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.76 -39.6 73.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.056 0.455 . . . . 10.0 110.739 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 -74.91 -24.09 58.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.112 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.433 ' HA2' HG23 ' A' ' 131' ' ' VAL . . . 103.86 35.11 3.57 Favored Glycine 0 N--CA 1.445 -0.739 0 CA-C-N 115.515 -0.766 . . . . 10.0 112.381 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.541 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 94.8 t -131.35 129.54 62.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.08 0.467 . . . . 10.0 111.116 -179.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.1 m -130.0 118.84 22.21 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.462 ' CG1' HG13 ' A' ' 128' ' ' VAL . 9.2 m -112.44 136.83 47.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.224 0.535 . . . . 10.0 112.04 -177.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 73.1 m -145.0 140.12 27.94 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.798 -0.637 . . . . 10.0 109.723 179.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.508 HG11 HG13 ' A' ' 101' ' ' VAL . 2.5 p -102.05 128.83 54.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.856 -0.424 . . . . 10.0 109.856 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.1 m -151.12 130.88 13.18 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.223 -0.444 . . . . 10.0 111.06 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 59.33 45.63 13.71 Favored 'General case' 0 C--O 1.235 0.298 0 O-C-N 123.684 0.615 . . . . 10.0 111.842 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.44 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 92.4 m-20 59.7 33.85 21.97 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.505 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.94 131.44 27.02 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.26 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.564 HD12 ' HB2' ' A' ' 72' ' ' ALA . 18.6 mt -89.53 120.97 31.3 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 107.587 -1.264 . . . . 10.0 107.587 177.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.86 119.91 40.95 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.306 0.574 . . . . 10.0 111.179 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.462 HG13 ' CG1' ' A' ' 119' ' ' VAL . 3.2 t -106.42 118.57 54.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-N 115.246 -0.888 . . . . 10.0 108.827 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -131.17 138.3 32.59 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-O 120.768 0.318 . . . . 10.0 110.782 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.49 138.71 13.95 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.2 1.933 . . . . 10.0 111.68 178.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.433 HG23 ' HA2' ' A' ' 116' ' ' GLY . 0.2 OUTLIER -102.83 152.42 38.47 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 110.041 -0.355 . . . . 10.0 110.041 179.285 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -67.22 106.22 1.15 Allowed 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.037 2.491 . . . . 10.0 112.658 -179.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 2.5 m -145.66 28.11 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.104 -0.498 . . . . 10.0 110.567 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 3.8 m -83.61 -10.24 58.37 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.126 -179.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.8 m -61.17 -43.48 98.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.909 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -89.23 50.81 3.66 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.928 -0.654 . . . . 10.0 111.665 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.68 -26.83 67.96 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -68.6 127.66 33.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.123 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 76.1 mt . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.444 -0.789 . . . . 10.0 110.278 -179.565 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.75 0 N-CA-C 112.197 -0.361 . . . . 10.0 112.197 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.2 t -85.55 127.55 34.48 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.868 -0.419 . . . . 10.0 109.868 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -158.89 135.48 9.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.492 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.1 mtt -115.38 150.66 36.0 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.205 -0.452 . . . . 10.0 109.888 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.0 t -84.25 132.76 34.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.131 0.491 . . . . 10.0 110.012 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.7 mttm -119.25 97.18 50.38 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.361 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_exo -71.87 93.54 0.71 Allowed 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 122.84 2.36 . . . . 10.0 111.311 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -67.7 147.34 98.64 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.434 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.48 103.45 0.46 Allowed 'Trans proline' 0 C--O 1.236 0.415 0 C-N-CA 122.599 2.2 . . . . 10.0 112.02 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -112.15 -164.58 0.93 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.967 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -97.88 34.45 1.9 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.099 0.476 . . . . 10.0 110.687 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -88.86 90.34 1.65 Allowed Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.822 -0.626 . . . . 10.0 111.681 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 97.69 51.49 1.53 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.944 -0.646 . . . . 10.0 111.949 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 42.0 ttt180 -102.49 -25.32 13.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.776 0.322 . . . . 10.0 111.057 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 41.6 m95 -84.77 70.84 10.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.111 0.481 . . . . 10.0 110.635 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -116.33 18.76 15.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.802 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -85.99 83.15 7.86 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.92 -0.4 . . . . 10.0 109.92 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -134.67 106.96 8.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.17 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -163.44 152.09 14.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.891 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -134.78 83.61 2.04 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.98 0.419 . . . . 10.0 110.829 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -90.78 83.19 5.7 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.454 0.645 . . . . 10.0 110.024 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -131.17 109.61 10.56 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.483 -0.781 . . . . 10.0 110.143 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -141.94 156.53 45.48 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.718 0.294 . . . . 10.0 110.378 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -162.44 144.81 8.44 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.559 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -67.69 94.99 0.39 Allowed 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 122.364 2.042 . . . . 10.0 111.204 179.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.1 m -113.41 100.23 8.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.845 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.7 150.78 39.19 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.192 -0.458 . . . . 10.0 109.906 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.7 pt -144.92 150.52 46.35 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.668 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.75 146.35 95.78 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.902 2.401 . . . . 10.0 112.27 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.8 tt -131.62 85.4 2.25 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.437 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -113.47 93.9 4.61 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.747 -0.834 . . . . 10.0 108.747 178.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -55.42 107.57 0.34 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.856 -0.611 . . . . 10.0 111.983 -178.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.4 m -125.78 96.74 4.87 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.57 -0.741 . . . . 10.0 109.415 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -94.94 132.67 39.52 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.762 -179.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.9 m -75.1 110.93 9.83 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 121.194 0.521 . . . . 10.0 110.233 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -89.31 98.87 12.01 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.188 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -134.56 147.14 50.2 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.006 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.41 ' HB2' ' SD ' ' A' ' 67' ' ' MET . . . -74.77 121.0 21.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.74 0.305 . . . . 10.0 110.418 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.425 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 81.3 p -107.1 158.47 32.89 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.354 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.425 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 50.6 Cg_endo -68.54 -4.14 12.46 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.286 1.991 . . . . 10.0 112.036 179.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 61.6 mtt -92.28 -18.66 23.08 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.825 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -73.12 -55.64 6.2 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.419 0.628 . . . . 10.0 109.686 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 88.71 -64.21 3.46 Favored Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.595 -0.73 . . . . 10.0 113.347 178.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 15.7 p -117.57 165.59 13.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.04 0.447 . . . . 10.0 112.088 -178.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.523 HD13 ' CE2' ' A' ' 112' ' ' TYR . 55.0 tp -57.89 -42.32 84.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.118 -0.946 . . . . 10.0 110.565 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.4 ' O ' ' HG3' ' A' ' 69' ' ' GLU . 58.0 tttt -60.89 -57.84 10.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.847 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.18 -38.38 73.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.165 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.41 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 51.7 ttp -63.52 -51.67 64.51 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.628 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 98.6 mt -64.2 -36.96 85.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.091 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 51.9 mt-10 -63.5 -38.86 92.76 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.206 0.526 . . . . 10.0 110.087 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? -71.65 -32.13 67.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.216 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 38.6 m0 -70.98 -55.12 9.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.754 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.05 -28.5 69.64 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.711 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.13 -35.57 81.2 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.024 0.379 . . . . 10.0 112.024 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -68.79 -37.81 79.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.86 0.362 . . . . 10.0 111.195 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.431 ' HB2' ' HG3' ' A' ' 77' ' ' MET . 0.1 OUTLIER -95.29 6.77 48.13 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.471 -179.284 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 63.9 t30 55.58 46.7 22.36 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.591 0.71 . . . . 10.0 110.577 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.431 ' HG3' ' HB2' ' A' ' 75' ' ' SER . 22.1 mtm -111.1 165.67 11.7 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.324 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -98.81 154.47 17.98 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.32 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.9 tp -124.72 131.42 53.46 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.312 0.577 . . . . 10.0 110.5 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 61.8 m -113.03 96.21 5.82 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.104 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.506 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 15.9 t80 -91.31 98.47 11.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.695 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -101.37 30.76 4.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.98 0.419 . . . . 10.0 111.175 -179.052 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.506 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 43.8 mt -97.43 146.96 32.28 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.048 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -56.43 -41.63 74.13 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.943 2.429 . . . . 10.0 112.633 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 30.4 m -143.45 167.6 21.8 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.697 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.472 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 12.5 p-10 -83.9 129.04 34.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.012 -0.54 . . . . 10.0 109.636 179.111 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -105.27 136.98 43.79 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.775 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 1.3 p -76.09 155.4 34.77 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.999 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -56.74 116.43 3.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.511 -0.313 . . . . 10.0 110.179 178.865 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.2 pt -63.06 -33.88 63.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.711 -179.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 142.73 -67.48 0.46 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.471 -0.871 . . . . 10.0 113.157 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.71 -2.93 1.22 Allowed 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.838 3.025 . . . . 10.0 114.137 -179.256 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.436 HG23 ' H ' ' A' ' 93' ' ' VAL . 0.3 OUTLIER -68.7 -36.74 75.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.299 0.571 . . . . 10.0 110.274 179.577 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 22.8 m -72.64 -9.04 58.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.825 -0.625 . . . . 10.0 111.559 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.22 -1.35 56.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.499 0.666 . . . . 10.0 109.917 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.518 HD13 HD12 ' A' ' 108' ' ' LEU . 19.6 mt -106.07 105.56 18.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.261 -0.881 . . . . 10.0 109.931 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -124.95 89.59 3.09 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.148 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.9 t -121.98 153.78 38.08 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.969 0.414 . . . . 10.0 111.089 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -92.94 -7.22 46.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.722 179.321 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.1 m -103.78 116.66 32.71 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.022 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.1 p -60.59 -32.5 51.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.712 -0.222 . . . . 10.0 111.352 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -67.1 -40.79 86.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.857 0.36 . . . . 10.0 110.176 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -65.06 -41.2 95.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.11 -0.495 . . . . 10.0 109.939 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.42 -51.45 66.83 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.581 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.51 -32.47 73.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.197 0.522 . . . . 10.0 110.813 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 88.3 m -66.83 -49.21 66.49 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.575 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -69.73 -37.23 76.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.947 -0.57 . . . . 10.0 111.353 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.518 HD12 HD13 ' A' ' 96' ' ' ILE . 3.4 mp -61.47 -49.41 76.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.962 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.0 m -59.22 -30.28 68.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.556 -0.293 . . . . 10.0 111.706 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.73 -47.05 79.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.901 0.381 . . . . 10.0 111.178 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.54 HG13 ' HD1' ' A' ' 112' ' ' TYR . 3.9 p -82.26 -35.89 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.139 0.495 . . . . 10.0 111.339 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.54 ' HD1' HG13 ' A' ' 111' ' ' VAL . 3.3 m-30 -72.06 -23.9 61.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.934 -0.575 . . . . 10.0 112.469 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -51.27 -31.33 20.77 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.892 0.33 . . . . 10.0 111.892 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.81 -20.9 57.84 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.144 0.497 . . . . 10.0 111.268 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -94.69 -7.98 39.13 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.416 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 90.57 24.82 27.28 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-N 115.686 -0.688 . . . . 10.0 112.364 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.424 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 56.1 t -126.43 141.89 44.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.751 0.31 . . . . 10.0 111.0 -179.258 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 29.2 m -141.61 138.88 32.89 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 9.0 m -127.92 152.93 36.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.191 0.52 . . . . 10.0 111.872 -178.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.0 m -154.01 158.82 41.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.237 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.517 HG22 ' CD2' ' A' ' 126' ' ' LEU . 5.5 t -113.42 114.86 48.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.538 -0.912 . . . . 10.0 108.538 178.748 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 13.7 m -132.34 116.03 16.35 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.597 -0.274 . . . . 10.0 111.124 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.45 51.68 5.12 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.848 -0.614 . . . . 10.0 111.121 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.8 m120 54.95 38.09 29.89 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.05 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -141.5 132.14 25.56 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.509 -0.769 . . . . 10.0 109.164 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.517 ' CD2' HG22 ' A' ' 121' ' ' VAL . 89.8 mt -88.96 121.61 31.49 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 109.303 -0.629 . . . . 10.0 109.303 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -108.03 115.76 30.72 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.947 -179.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.8 t -102.98 118.65 50.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 N-CA-C 108.321 -0.992 . . . . 10.0 108.321 178.138 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -133.78 138.4 30.82 Favored Pre-proline 0 C--N 1.317 -0.809 0 CA-C-O 120.841 0.353 . . . . 10.0 110.539 -178.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.06 146.39 25.56 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.212 1.942 . . . . 10.0 111.683 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -105.03 151.62 39.51 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 109.736 -0.468 . . . . 10.0 109.736 179.269 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -77.86 63.52 8.11 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.759 2.306 . . . . 10.0 113.329 -178.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 27.8 m -127.23 153.8 36.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.486 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 1.5 p -157.57 121.62 4.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.718 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 16.1 m -65.43 115.85 6.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.476 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 69.82 27.78 72.78 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 121.033 -0.603 . . . . 10.0 112.179 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 56.98 36.11 27.33 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.321 0.581 . . . . 10.0 110.924 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -98.45 118.02 34.19 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.804 -0.634 . . . . 10.0 110.612 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 29.8 tp . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.533 -0.746 . . . . 10.0 109.842 179.711 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.868 0 N-CA-C 112.242 -0.343 . . . . 10.0 112.242 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 11.9 m -82.5 148.7 27.97 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -156.57 167.9 29.03 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.619 -0.264 . . . . 10.0 110.345 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.7 mmt -72.73 99.16 2.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.47 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -95.93 92.67 6.61 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.107 0.479 . . . . 10.0 110.251 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -127.99 121.41 21.82 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.488 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -72.6 146.37 43.66 Favored 'Trans proline' 0 C--O 1.237 0.471 0 C-N-CA 122.748 2.298 . . . . 10.0 111.832 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 70.86 156.11 0.16 Allowed Pre-proline 0 C--O 1.235 0.306 0 O-C-N 123.724 0.64 . . . . 10.0 111.2 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -61.09 170.57 4.77 Favored 'Trans proline' 0 C--O 1.237 0.466 0 C-N-CA 122.675 2.25 . . . . 10.0 113.04 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -73.5 174.2 8.56 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.514 -0.767 . . . . 10.0 111.221 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -111.12 140.53 45.59 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.905 -0.588 . . . . 10.0 110.342 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 154.62 -27.52 0.67 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.844 -0.693 . . . . 10.0 111.907 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -136.02 32.92 2.45 Favored Glycine 0 N--CA 1.445 -0.728 0 N-CA-C 111.393 -0.683 . . . . 10.0 111.393 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 43.3 ttt180 -91.23 -8.18 49.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.113 0.483 . . . . 10.0 110.687 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -124.86 41.92 3.4 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.166 0.507 . . . . 10.0 110.894 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -93.96 88.26 5.65 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.963 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -87.34 92.93 9.25 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.811 -0.631 . . . . 10.0 109.378 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.3 m -130.61 102.59 6.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.209 0.528 . . . . 10.0 111.321 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 20.2 p-10 -161.59 179.91 7.81 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.567 -0.742 . . . . 10.0 109.678 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -67.37 145.71 54.79 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.345 -0.243 . . . . 10.0 110.345 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -75.72 -76.45 0.15 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.611 -0.268 . . . . 10.0 111.372 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -155.82 133.21 10.9 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.755 0.312 . . . . 10.0 110.97 -179.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -134.84 157.27 47.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.987 0.422 . . . . 10.0 110.63 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -112.2 149.07 40.41 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.39 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.51 114.56 2.94 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.671 2.247 . . . . 10.0 111.98 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 61.6 m -73.62 103.25 4.15 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.926 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -123.04 80.51 1.77 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.674 179.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 33.8 pt -98.46 149.02 35.32 Favored Pre-proline 0 C--N 1.32 -0.713 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.97 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.4 125.09 14.39 Favored 'Trans proline' 0 C--O 1.236 0.382 0 C-N-CA 122.676 2.251 . . . . 10.0 111.998 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 63.5 tp -116.24 105.5 12.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.331 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -78.68 123.59 27.3 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.297 -0.631 . . . . 10.0 109.297 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.22 107.21 0.72 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.025 0.44 . . . . 10.0 110.643 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.2 m -127.73 85.38 2.35 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.945 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.9 t80 -86.07 118.45 25.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.719 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 60.4 m -72.66 113.8 10.1 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.216 0.531 . . . . 10.0 109.959 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -81.14 114.0 19.68 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.091 -0.959 . . . . 10.0 109.627 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -148.17 154.68 40.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.185 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.55 107.82 14.62 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.702 -0.481 . . . . 10.0 109.702 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.472 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 21.4 p -100.1 158.21 32.44 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.96 -178.64 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.472 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 40.5 Cg_endo -66.6 -8.43 21.0 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.904 2.403 . . . . 10.0 112.421 179.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 26.4 mmt -90.97 -7.62 51.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.035 0.445 . . . . 10.0 110.507 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -87.9 -58.78 2.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.391 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.31 -58.4 4.91 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.418 -0.896 . . . . 10.0 113.275 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 28.9 p -121.49 168.16 12.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.044 0.449 . . . . 10.0 111.801 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.444 HD22 ' HE2' ' A' ' 112' ' ' TYR . 59.4 tp -61.81 -37.41 84.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.251 -0.886 . . . . 10.0 110.712 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -61.7 -55.12 33.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.198 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.26 -41.96 90.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.074 0.464 . . . . 10.0 111.109 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 47.8 ttp -61.0 -53.2 60.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.811 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 87.6 mt -63.67 -36.23 83.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.029 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.438 ' OE2' HD23 ' A' ' 79' ' ' LEU . 44.2 mm-40 -59.29 -44.86 92.46 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.985 -0.376 . . . . 10.0 109.985 178.807 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -63.81 -45.29 90.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.36 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 42.8 m0 -57.41 -49.08 77.37 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.54 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.87 -50.01 58.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.446 -0.797 . . . . 10.0 111.761 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.29 -45.55 87.73 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.273 0.471 . . . . 10.0 112.273 -178.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -64.17 -35.68 81.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.026 0.441 . . . . 10.0 111.237 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.6 m -90.67 5.14 49.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.044 -0.525 . . . . 10.0 111.57 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 59.75 41.4 18.37 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.093 0.473 . . . . 10.0 111.218 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.479 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 24.0 mtm -117.94 173.18 6.92 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.655 -0.702 . . . . 10.0 109.913 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -105.13 161.0 14.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.626 -0.261 . . . . 10.0 110.795 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.438 HD23 ' OE2' ' A' ' 69' ' ' GLU . 20.1 tp -132.15 134.61 45.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.375 0.607 . . . . 10.0 111.22 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 19.7 m -118.57 96.14 5.15 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.054 -0.975 . . . . 10.0 110.07 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.455 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 17.8 t80 -89.96 97.78 11.39 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.128 -0.693 . . . . 10.0 109.128 179.65 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -107.19 48.44 0.84 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.556 0.693 . . . . 10.0 110.53 -179.056 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.455 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 38.5 mt -108.31 153.96 41.66 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.206 -0.906 . . . . 10.0 109.329 179.258 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -59.33 -38.19 86.21 Favored 'Trans proline' 0 CA--C 1.529 0.239 0 C-N-CA 122.568 2.179 . . . . 10.0 112.465 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.8 m -152.15 169.67 21.86 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.08 -0.341 . . . . 10.0 110.08 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.422 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 7.7 p-10 -78.4 143.51 36.74 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.816 -0.439 . . . . 10.0 109.816 178.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -121.15 138.72 54.07 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.466 -0.334 . . . . 10.0 111.017 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.7 OUTLIER -81.61 158.93 24.18 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.394 179.301 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.62 133.77 55.37 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.047 -0.353 . . . . 10.0 110.047 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.0 pt -78.35 -29.82 15.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 112.437 0.532 . . . . 10.0 112.437 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 144.34 -64.92 0.46 Allowed Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.043 -1.075 . . . . 10.0 113.74 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -68.16 6.78 0.76 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 123.227 2.618 . . . . 10.0 113.762 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.429 ' HA ' HD12 ' A' ' 96' ' ' ILE . 2.9 t -76.88 -38.23 28.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.105 0.479 . . . . 10.0 110.115 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 41.8 m -67.69 -15.72 63.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.141 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -79.71 -9.83 59.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.149 0.499 . . . . 10.0 110.329 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.429 HD12 ' HA ' ' A' ' 93' ' ' VAL . 28.8 mt -94.78 113.51 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.8 m -139.13 93.89 2.74 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.93 -179.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 15.3 t -131.21 155.67 46.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.481 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.88 -6.34 54.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.169 0.509 . . . . 10.0 111.101 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.4 m -100.68 114.95 29.12 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.559 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.1 p -62.37 -30.92 50.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.183 -178.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -68.17 -40.85 82.17 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -67.03 -39.38 86.98 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.359 -0.608 . . . . 10.0 109.359 178.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.18 -50.33 74.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.266 178.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.63 -33.54 74.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.15 0.5 . . . . 10.0 110.396 179.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 97.8 m -64.5 -50.61 66.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.404 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -66.03 -44.15 85.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.85 -0.613 . . . . 10.0 110.173 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -54.2 -54.24 42.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.633 -0.712 . . . . 10.0 110.953 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.7 m -62.06 -34.71 76.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.415 -0.357 . . . . 10.0 111.74 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.73 -37.1 80.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.151 0.501 . . . . 10.0 111.133 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 16.0 t -87.87 -49.29 14.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.2 0.524 . . . . 10.0 111.023 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.445 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.4 m-30 -62.25 -23.89 66.94 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.598 0.962 . . . . 10.0 113.598 -178.09 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.535 ' O ' HG21 ' A' ' 133' ' ' VAL . . . -54.96 -22.99 16.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.743 0.306 . . . . 10.0 111.14 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.06 -37.36 75.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.133 0.492 . . . . 10.0 110.474 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 -85.62 -23.1 27.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.46 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 107.54 30.73 3.96 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.63 -0.795 . . . . 10.0 113.034 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.445 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 86.9 t -125.09 135.5 63.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.776 0.322 . . . . 10.0 110.5 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 5.2 m -131.38 132.18 44.22 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.222 -0.444 . . . . 10.0 109.891 178.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 11.7 m -122.77 140.97 44.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.052 -178.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.0 m -145.41 163.47 34.52 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.408 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.473 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.3 t -118.59 127.75 75.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.551 -0.536 . . . . 10.0 109.551 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 20.3 m -145.58 119.33 9.23 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.7 -0.227 . . . . 10.0 111.061 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 58.39 48.6 12.07 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.206 0.602 . . . . 10.0 112.146 179.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.479 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 89.3 m-20 60.1 38.33 20.51 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.804 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -145.85 135.35 23.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.718 -0.674 . . . . 10.0 109.58 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.473 ' CD2' HG22 ' A' ' 121' ' ' VAL . 75.2 mt -92.27 123.34 35.53 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.189 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -106.38 116.9 32.73 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.297 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.9 t -105.73 119.67 55.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 179.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -134.78 140.14 34.39 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.824 -178.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -80.44 140.41 13.49 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 122.235 1.956 . . . . 10.0 111.275 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 3.9 m -108.64 145.55 31.85 Favored Pre-proline 0 C--N 1.323 -0.574 0 C-N-CA 120.96 -0.296 . . . . 10.0 110.935 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -78.71 89.07 1.39 Allowed 'Trans proline' 0 C--O 1.236 0.405 0 C-N-CA 122.906 2.404 . . . . 10.0 112.082 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.535 HG21 ' O ' ' A' ' 113' ' ' ALA . 19.7 m -134.56 176.9 7.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.294 -179.263 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.2 m -154.39 138.77 16.72 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.764 0.316 . . . . 10.0 110.845 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 47.1 m -89.48 -16.07 31.62 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.004 0.431 . . . . 10.0 110.475 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 155.46 -67.38 0.3 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.816 -0.707 . . . . 10.0 112.08 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -148.52 -51.44 0.17 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.892 0.377 . . . . 10.0 110.763 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 21.7 ttmm -95.74 159.01 15.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.397 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.187 0 CA-C-O 117.959 -1.02 . . . . 10.0 109.682 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.795 0 N-CA-C 111.98 -0.448 . . . . 10.0 111.98 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.5 m -84.55 94.3 8.55 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.983 0.421 . . . . 10.0 110.337 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 9.2 p80 -100.62 70.12 1.43 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.406 0.622 . . . . 10.0 110.475 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 64.8 mtt -96.23 85.26 3.93 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.703 -0.681 . . . . 10.0 110.366 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.45 130.44 41.92 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.686 -0.688 . . . . 10.0 111.24 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -126.56 90.78 49.01 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.99 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -68.67 111.06 2.47 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.233 1.955 . . . . 10.0 111.914 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -69.15 148.22 97.6 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.204 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -62.54 111.1 1.23 Allowed 'Trans proline' 0 N--CA 1.462 -0.352 0 C-N-CA 122.412 2.075 . . . . 10.0 112.026 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -76.86 -24.65 52.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.431 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -78.16 75.34 4.69 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.043 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -169.72 110.3 0.37 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 121.005 -0.617 . . . . 10.0 111.704 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.9 30.31 76.84 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 121.248 -0.501 . . . . 10.0 112.335 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.1 mpt_? -103.22 -39.25 6.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.228 0.537 . . . . 10.0 111.033 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 70.6 m95 -78.83 2.42 20.02 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.25 -178.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -92.62 -1.59 56.77 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.502 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -67.28 142.44 56.87 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.472 -0.331 . . . . 10.0 110.172 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -146.43 158.41 11.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.944 -179.478 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -108.12 -18.7 13.71 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.166 179.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -150.24 135.32 17.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.621 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -85.76 -32.71 21.7 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.998 0.427 . . . . 10.0 110.971 -179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -121.95 116.01 23.57 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.287 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -118.07 154.29 32.31 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.698 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -165.5 147.51 6.39 Favored Pre-proline 0 N--CA 1.44 -0.953 0 CA-C-N 115.576 -0.738 . . . . 10.0 109.881 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -61.76 93.3 0.12 Allowed 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.883 2.388 . . . . 10.0 112.144 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.6 m -83.75 94.04 8.07 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.13 0.491 . . . . 10.0 110.836 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -107.75 94.76 5.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.303 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 pt -121.4 111.72 33.24 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.618 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -69.8 101.3 0.9 Allowed 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 122.485 2.123 . . . . 10.0 111.74 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.432 HD22 ' HA ' ' A' ' 49' ' ' LEU . 0.5 OUTLIER -141.05 111.01 6.56 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.835 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -98.79 140.25 33.26 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.247 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.05 121.74 16.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.969 0.414 . . . . 10.0 110.876 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 49.5 m -154.91 104.11 2.46 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.277 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -72.93 124.63 25.82 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.199 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 13.2 m -77.24 123.11 26.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.495 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -92.15 117.4 29.82 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -158.61 165.61 34.05 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.595 -179.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.817 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -78.56 124.48 28.2 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.717 -0.846 . . . . 10.0 108.717 177.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.431 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 44.8 p -104.86 163.48 17.1 Favored Pre-proline 0 C--N 1.313 -0.982 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.748 -178.097 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.431 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 95.6 Cg_endo -80.53 12.26 2.63 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 121.787 1.658 . . . . 10.0 112.074 178.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 21.4 ptm -112.32 -18.35 12.52 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.76 -62.89 1.19 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.835 0.35 . . . . 10.0 111.517 -179.022 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.0 -49.37 1.4 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.511 -0.852 . . . . 10.0 112.129 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 32.5 p -130.74 168.92 16.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 117.028 0.414 . . . . 10.0 110.511 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.55 HD13 ' HE2' ' A' ' 112' ' ' TYR . 59.8 tp -57.49 -44.77 85.23 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.271 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -59.23 -53.49 57.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.835 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -33.32 71.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.482 -0.326 . . . . 10.0 111.677 -179.299 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 51.3 ttp -69.23 -49.96 51.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.101 0.477 . . . . 10.0 110.042 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.4 mt -65.11 -33.9 77.12 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.655 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -61.34 -39.77 91.79 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 178.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -65.89 -42.14 90.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.005 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 43.0 m0 -62.46 -51.85 65.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.174 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.441 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -63.0 -44.99 94.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.57 -0.741 . . . . 10.0 111.838 -179.618 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.02 -47.83 84.6 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 111.796 0.295 . . . . 10.0 111.796 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.04 -20.23 62.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.912 0.387 . . . . 10.0 111.36 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.5 t -96.93 -1.81 45.0 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.317 -0.402 . . . . 10.0 110.738 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 9.8 m120 60.44 41.39 16.03 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.525 0.679 . . . . 10.0 110.172 -179.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 26.8 mtm -121.17 168.82 11.16 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.303 -0.862 . . . . 10.0 110.453 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -98.42 160.52 14.23 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.084 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 34.5 tp -129.44 134.15 47.68 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.78 0.324 . . . . 10.0 110.577 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.475 ' HB2' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -121.14 97.37 5.49 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.027 179.157 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.574 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 20.6 t80 -84.12 98.22 9.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.556 -0.747 . . . . 10.0 109.587 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.51 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 84.8 m-20 -100.38 37.54 1.66 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.073 0.463 . . . . 10.0 110.462 -179.156 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.574 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 26.6 mt -103.42 150.83 38.4 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 116.062 -0.517 . . . . 10.0 109.868 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -64.65 -34.48 51.25 Favored 'Trans proline' 0 CA--C 1.531 0.326 0 C-N-CA 122.579 2.186 . . . . 10.0 112.939 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.9 m -148.05 172.68 13.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.666 0.27 . . . . 10.0 110.752 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -83.88 130.99 34.9 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.273 -0.64 . . . . 10.0 109.273 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -114.78 149.84 36.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.964 0.411 . . . . 10.0 111.309 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.96 169.46 11.2 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.219 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.62 129.7 38.21 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 178.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 pt -67.1 -28.55 43.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 112.084 0.401 . . . . 10.0 112.084 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 145.8 -70.75 0.36 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.525 -0.845 . . . . 10.0 112.905 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.92 5.14 0.68 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.237 2.625 . . . . 10.0 113.435 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 3.8 t -67.68 -39.23 81.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.034 0.445 . . . . 10.0 110.185 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.817 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 9.1 m -68.19 -11.06 58.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.375 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -88.77 -6.68 57.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.889 0.376 . . . . 10.0 110.628 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 42.1 mt -93.93 107.52 19.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 N-CA-C 109.156 -0.683 . . . . 10.0 109.156 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.0 m -141.17 104.74 4.69 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.4 t -132.42 157.2 45.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.107 -0.497 . . . . 10.0 109.785 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.78 -11.71 47.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.848 0.356 . . . . 10.0 111.613 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.6 m -98.38 118.57 35.34 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.212 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.46 -32.69 54.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.748 0.309 . . . . 10.0 111.342 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -66.93 -43.2 83.88 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -66.91 -40.31 87.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.769 179.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.08 -46.72 75.48 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.364 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.01 -36.36 84.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.166 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 39.0 m -64.85 -50.64 65.84 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.886 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -66.12 -44.43 84.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.398 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.439 ' HB3' ' CG2' ' A' ' 119' ' ' VAL . 3.2 tp -58.07 -48.1 81.17 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 120.945 0.402 . . . . 10.0 110.165 179.201 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 70.4 m -61.46 -31.2 71.16 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.686 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.4 -39.45 94.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.15 0.5 . . . . 10.0 110.953 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.1 t -86.91 -34.91 7.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.926 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.55 ' HE2' HD13 ' A' ' 64' ' ' LEU . 3.6 m-30 -79.75 -23.87 41.95 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 113.576 0.954 . . . . 10.0 113.576 -177.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.484 ' O ' HG21 ' A' ' 133' ' ' VAL . . . -49.46 -42.23 42.56 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.059 0.392 . . . . 10.0 112.059 -179.555 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.36 -21.91 62.84 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.032 0.444 . . . . 10.0 111.336 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -87.83 -12.83 43.81 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.591 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 96.46 18.71 29.83 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.954 -0.641 . . . . 10.0 112.392 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.462 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 57.6 t -123.52 137.37 56.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.881 0.372 . . . . 10.0 111.005 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.1 m -138.52 122.3 17.61 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.543 -0.539 . . . . 10.0 109.543 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.439 ' CG2' ' HB3' ' A' ' 108' ' ' LEU . 6.0 m -107.16 139.56 28.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.941 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 37.2 m -149.58 144.02 25.95 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.409 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 2.1 p -106.08 122.24 59.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 44.7 m -140.4 124.34 17.4 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.415 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 62.73 46.58 5.16 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.68 0.613 . . . . 10.0 110.839 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 20.3 m-20 54.02 40.78 31.97 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.823 0.821 . . . . 10.0 110.394 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.472 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 57.2 tttt -143.08 129.06 19.57 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.809 -1.087 . . . . 10.0 108.929 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.441 HD12 ' HB2' ' A' ' 72' ' ' ALA . 21.7 mt -88.45 122.22 31.69 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.475 HD22 ' HB2' ' A' ' 80' ' ' SER . 14.8 mt -114.25 134.18 55.11 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 120.971 0.415 . . . . 10.0 110.52 -178.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.51 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 2.5 t -111.39 119.03 58.88 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 108.293 -1.003 . . . . 10.0 108.293 178.115 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -125.63 135.88 27.57 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-O 120.776 0.322 . . . . 10.0 110.969 -178.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -79.72 134.83 11.12 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.194 1.929 . . . . 10.0 111.682 178.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.8 m -106.1 147.1 34.22 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.61 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -77.86 94.15 1.08 Allowed 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 122.693 2.262 . . . . 10.0 112.783 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.484 HG21 ' O ' ' A' ' 113' ' ' ALA . 4.6 m -135.49 31.52 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.107 0.48 . . . . 10.0 110.804 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 70.6 m -116.04 37.41 3.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.299 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 3.4 m -79.4 -29.84 42.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.008 0.432 . . . . 10.0 110.36 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -109.66 -48.18 0.81 Allowed Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.951 -0.642 . . . . 10.0 112.057 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -87.82 171.84 10.08 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.417 0.151 . . . . 10.0 110.604 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -161.68 132.81 5.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.767 -0.197 . . . . 10.0 110.555 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 27.7 tp . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.566 -0.73 . . . . 10.0 110.411 179.566 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.713 0 N-CA-C 111.709 -0.556 . . . . 10.0 111.709 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 7.6 m -69.95 147.8 49.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.007 0.432 . . . . 10.0 111.164 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 67.7 m80 -125.63 157.22 37.78 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.607 -179.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.3 ttt -86.99 70.37 10.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.074 0.464 . . . . 10.0 110.11 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.5 t -173.57 149.55 1.67 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.957 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 70.7 tttt -138.75 126.13 13.29 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.582 -0.281 . . . . 10.0 110.889 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.67 167.88 23.37 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.662 2.241 . . . . 10.0 111.949 179.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 68.59 156.82 0.15 Allowed Pre-proline 0 N--CA 1.465 0.318 0 O-C-N 123.794 0.684 . . . . 10.0 111.331 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -78.94 56.45 6.01 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.419 2.079 . . . . 10.0 112.416 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -71.22 -42.3 69.11 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.864 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -77.51 -4.58 46.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.891 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.43 -126.46 8.38 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.997 -0.62 . . . . 10.0 111.816 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 91.41 10.18 62.37 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.628 -0.796 . . . . 10.0 112.569 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.4 ' HD3' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -75.94 -30.43 58.7 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.768 -0.456 . . . . 10.0 109.768 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 42.6 m95 -71.5 -33.18 69.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.791 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.6 ptpt -86.1 -7.43 58.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.207 -0.451 . . . . 10.0 111.017 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 4.4 t-160 -83.54 85.79 7.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.22 0.533 . . . . 10.0 109.761 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 17.8 m -133.15 161.3 41.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.352 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -97.77 128.01 44.12 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.95 0.405 . . . . 10.0 110.048 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.8 t-80 -89.4 59.65 4.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.354 0.597 . . . . 10.0 110.143 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -137.05 115.17 11.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.993 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -82.94 97.55 8.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.405 -179.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -149.22 163.2 38.33 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.014 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.16 142.38 63.72 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.46 -0.337 . . . . 10.0 110.387 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -66.79 -33.86 32.85 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.482 2.121 . . . . 10.0 111.526 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.7 m -116.89 82.95 1.89 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.006 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -68.64 110.24 4.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.663 -0.699 . . . . 10.0 111.218 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.416 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 22.8 pt -112.44 137.62 21.66 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 115.839 -0.619 . . . . 10.0 109.949 179.045 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 47' ' ' ILE . 23.4 Cg_exo -64.9 150.23 88.41 Favored 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 122.484 2.123 . . . . 10.0 111.824 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 18.0 tp -112.75 79.43 1.23 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.328 0.585 . . . . 10.0 110.453 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -75.45 125.03 28.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.531 -0.759 . . . . 10.0 109.864 179.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.33 118.2 9.67 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.999 0.428 . . . . 10.0 111.738 -179.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 4.7 m -141.89 77.9 1.61 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.459 0.647 . . . . 10.0 109.713 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -75.36 135.24 40.84 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.104 -0.953 . . . . 10.0 111.039 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.5 m -87.1 117.73 26.02 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.414 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -83.3 123.53 29.71 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.385 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -155.53 149.76 25.8 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.047 -0.524 . . . . 10.0 109.969 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.476 ' HB2' ' SD ' ' A' ' 67' ' ' MET . . . -84.8 130.22 34.71 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.786 0.327 . . . . 10.0 110.529 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 48.0 p -107.74 153.72 41.35 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.052 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.55 5.92 2.18 Favored 'Trans proline' 0 CA--C 1.53 0.308 0 C-N-CA 122.386 2.058 . . . . 10.0 111.819 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.3 mtt -105.97 -12.42 15.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.752 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -69.05 -52.04 32.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.019 0.437 . . . . 10.0 110.505 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 97.74 -68.46 0.75 Allowed Glycine 0 N--CA 1.444 -0.806 0 C-N-CA 120.511 -0.852 . . . . 10.0 112.816 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.433 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 67.6 p -126.83 170.34 12.3 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.084 0.469 . . . . 10.0 112.199 -178.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 54.1 tp -57.38 -43.06 83.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.898 -1.046 . . . . 10.0 110.764 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -59.94 -52.44 65.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.945 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -43.05 91.5 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.256 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.476 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 50.8 ttp -63.36 -52.33 62.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.69 -0.686 . . . . 10.0 111.117 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.426 ' HB3' HD13 ' A' ' 79' ' ' LEU . 74.9 mt -62.51 -36.78 83.65 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.31 -0.404 . . . . 10.0 111.24 -179.495 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -60.01 -44.01 94.84 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.7 ttm180 -65.27 -41.76 93.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.467 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 42.7 m0 -61.48 -50.2 73.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.567 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -68.41 -36.6 79.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.702 -179.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.1 -41.1 87.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.518 -0.31 . . . . 10.0 111.813 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -56.28 -39.56 72.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.572 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.415 ' HB2' ' HG3' ' A' ' 77' ' ' MET . 67.7 m -101.8 14.09 32.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.447 -0.342 . . . . 10.0 111.792 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 54.99 38.08 29.94 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.068 0.461 . . . . 10.0 111.252 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.415 ' HG3' ' HB2' ' A' ' 75' ' ' SER . 11.8 mtm -95.88 173.15 7.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.931 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.465 ' HB2' ' HG3' ' A' ' 125' ' ' LYS . 14.0 mt-30 -103.88 156.42 17.85 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.945 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.426 HD13 ' HB3' ' A' ' 68' ' ' LEU . 23.8 tp -128.52 132.79 48.31 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.089 0.471 . . . . 10.0 110.186 178.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.44 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 75.6 m -120.16 97.16 5.46 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.398 -0.819 . . . . 10.0 110.852 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.564 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 9.0 t80 -87.03 98.5 11.31 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.848 -0.614 . . . . 10.0 110.283 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.531 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 37.0 m-80 -99.83 21.97 11.77 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.07 0.462 . . . . 10.0 110.701 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.564 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 41.8 mt -90.27 141.5 27.66 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.672 179.354 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -61.88 -34.1 82.7 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.695 2.264 . . . . 10.0 112.82 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -138.95 165.63 26.59 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.872 0.368 . . . . 10.0 110.951 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.433 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 6.5 m-20 -86.44 136.62 33.04 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -119.22 140.03 50.9 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.252 -0.579 . . . . 10.0 111.496 -179.155 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.433 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.8 OUTLIER -79.92 158.13 26.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.06 179.405 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.45 122.63 15.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.988 0.423 . . . . 10.0 110.313 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.7 pt -62.5 -30.77 49.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.788 -0.642 . . . . 10.0 111.878 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 140.64 -65.76 0.51 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.452 -0.88 . . . . 10.0 113.152 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -60.88 -5.55 4.84 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.37 2.713 . . . . 10.0 113.604 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.431 ' H ' HG23 ' A' ' 93' ' ' VAL . 1.6 t -64.16 -39.26 84.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.277 0.561 . . . . 10.0 109.91 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 66.0 m -71.72 -6.14 39.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.419 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.2 -8.42 39.36 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.27 0.557 . . . . 10.0 110.156 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.512 HD13 HD12 ' A' ' 108' ' ' LEU . 56.2 mt -92.74 109.49 21.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.16 -0.682 . . . . 10.0 109.16 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -131.72 95.37 3.71 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.016 -178.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.8 t -131.1 156.25 45.56 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.869 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.49 -10.52 43.35 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 121.13 0.49 . . . . 10.0 110.311 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 29.6 t -96.01 118.54 32.81 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.351 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 11.0 p -64.22 -30.23 49.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.088 0.47 . . . . 10.0 110.295 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -69.77 -44.62 69.76 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.49 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -63.18 -41.62 99.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.868 179.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.46 -49.38 76.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.607 179.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.28 -37.26 84.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.069 0.461 . . . . 10.0 110.488 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 91.1 m -64.94 -48.79 72.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.544 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -64.63 -40.76 96.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.934 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.512 HD12 HD13 ' A' ' 96' ' ' ILE . 3.0 mp -60.71 -53.97 50.93 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 116.153 -0.476 . . . . 10.0 109.85 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.8 m -55.85 -30.83 62.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.579 0.228 . . . . 10.0 111.54 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.32 -44.12 92.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.767 0.318 . . . . 10.0 111.098 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.475 HG13 ' HD1' ' A' ' 112' ' ' TYR . 8.7 p -90.15 -21.85 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 121.008 0.432 . . . . 10.0 111.929 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.475 ' HD1' HG13 ' A' ' 111' ' ' VAL . 6.3 m-85 -82.41 -25.04 34.05 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.461 0.541 . . . . 10.0 112.461 -179.283 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.481 ' O ' HG21 ' A' ' 133' ' ' VAL . . . -52.68 -33.7 48.55 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.119 0.414 . . . . 10.0 112.119 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.422 ' HB3' ' NE2' ' A' ' 115' ' ' GLN . . . -65.48 -25.64 67.58 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.811 0.339 . . . . 10.0 111.383 179.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' GLN . . . . . 0.422 ' NE2' ' HB3' ' A' ' 114' ' ' ALA . 3.6 mp0 -92.07 -19.9 21.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.191 0.519 . . . . 10.0 109.682 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.82 30.27 6.17 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.496 -0.775 . . . . 10.0 112.428 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 94.4 t -125.83 140.05 49.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.899 0.381 . . . . 10.0 110.753 -179.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 9.5 m -137.03 131.8 33.34 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.16 -0.473 . . . . 10.0 109.821 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 127' ' ' LEU . 6.4 m -122.95 140.01 47.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.014 0.435 . . . . 10.0 111.165 -178.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.6 m -144.69 163.55 33.66 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.504 -0.316 . . . . 10.0 110.517 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.525 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.2 t -116.65 115.19 48.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.414 -0.588 . . . . 10.0 109.414 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 19.9 m -136.39 116.65 13.55 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.608 -0.269 . . . . 10.0 110.728 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 59.0 54.25 5.12 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.716 -0.675 . . . . 10.0 111.768 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 55.42 33.53 21.11 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.763 -0.653 . . . . 10.0 111.569 179.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.465 ' HG3' ' HB2' ' A' ' 78' ' ' GLN . 19.4 tttt -138.83 130.79 27.96 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.382 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.525 ' CD2' HG22 ' A' ' 121' ' ' VAL . 91.1 mt -89.6 121.82 32.16 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.873 -0.788 . . . . 10.0 108.873 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.425 ' O ' ' HA ' ' A' ' 119' ' ' VAL . 4.0 mm? -103.01 115.68 31.07 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.872 -178.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.531 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 3.6 t -105.93 117.82 52.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 107.57 -1.27 . . . . 10.0 107.57 177.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -136.42 142.83 40.95 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-O 120.699 0.285 . . . . 10.0 111.186 -178.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -81.54 130.56 7.0 Favored 'Trans proline' 0 N--CA 1.451 -0.981 0 C-N-CA 122.269 1.979 . . . . 10.0 111.028 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.466 ' HA ' ' HD3' ' A' ' 132' ' ' PRO . 1.7 m -97.68 141.5 23.09 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.547 -179.586 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 131' ' ' VAL . 3.5 Cg_exo -76.87 74.02 5.11 Favored 'Trans proline' 0 N--CA 1.461 -0.408 0 C-N-CA 122.784 2.323 . . . . 10.0 110.886 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.481 HG21 ' O ' ' A' ' 113' ' ' ALA . 15.6 m -109.41 166.05 5.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.299 -179.009 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -152.51 44.4 0.69 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.478 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -74.45 162.5 28.77 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.945 -1.025 . . . . 10.0 110.717 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 76.31 25.24 66.41 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.858 -0.687 . . . . 10.0 112.204 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -112.13 -35.45 5.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.034 0.445 . . . . 10.0 110.654 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -103.36 -10.18 18.85 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.448 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.098 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.534 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.696 0 N-CA-C 112.162 -0.375 . . . . 10.0 112.162 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.9 m -88.09 144.94 26.21 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.891 -0.411 . . . . 10.0 109.891 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -77.04 76.71 3.59 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.874 -0.417 . . . . 10.0 109.874 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 40.1 ttm -101.21 114.29 28.12 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.468 -179.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 13.7 t -99.29 -2.56 36.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.14 -0.482 . . . . 10.0 111.086 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? -124.79 106.11 29.44 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.229 -179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -68.11 133.02 27.59 Favored 'Trans proline' 0 C--O 1.236 0.388 0 C-N-CA 122.566 2.177 . . . . 10.0 112.265 -179.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -125.79 142.86 43.36 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.578 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -75.49 165.83 29.82 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.621 2.214 . . . . 10.0 111.838 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -72.24 148.32 45.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.622 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -79.71 -15.34 57.7 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.166 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -178.93 -133.16 1.87 Allowed Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 121.036 -0.602 . . . . 10.0 111.702 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -142.84 54.86 0.59 Allowed Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.801 -0.714 . . . . 10.0 111.572 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.0 ptt180 -67.1 -25.28 66.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.065 0.459 . . . . 10.0 110.357 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 26.2 m95 -82.35 -5.97 58.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.372 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -120.28 62.14 0.85 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.956 -0.565 . . . . 10.0 109.727 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -84.12 107.93 16.74 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.02 -179.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.2 m -142.92 118.07 4.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.539 -0.755 . . . . 10.0 109.712 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -85.77 112.09 20.76 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 116.071 -0.513 . . . . 10.0 112.101 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 18.3 p80 -147.66 -34.8 0.24 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.362 -0.835 . . . . 10.0 109.758 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -153.95 55.05 0.72 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 179.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.07 -16.22 61.04 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.205 -0.907 . . . . 10.0 111.237 -178.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -98.26 170.47 8.85 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.088 -179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -161.47 147.08 10.71 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.518 -0.765 . . . . 10.0 109.665 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -62.1 -47.57 10.08 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.449 2.099 . . . . 10.0 111.734 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.3 m -136.71 106.09 6.08 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.24 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -130.36 116.73 18.71 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.129 0.49 . . . . 10.0 110.038 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 13.3 pt -134.45 139.16 31.88 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.792 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -67.38 102.52 0.7 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.597 2.198 . . . . 10.0 112.04 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.492 HD23 ' HA ' ' A' ' 49' ' ' LEU . 5.7 mt -133.68 105.5 6.87 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.079 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -104.44 110.45 22.72 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.573 -0.528 . . . . 10.0 109.573 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.65 117.95 9.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.497 -0.774 . . . . 10.0 111.341 -179.602 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 37.6 m -151.76 107.33 3.34 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.224 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -80.07 126.57 31.23 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.412 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.5 m -77.24 115.56 17.12 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.568 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.51 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 93.0 m-85 -85.87 115.72 23.68 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.915 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.415 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 10.7 pt20 -146.36 160.32 42.2 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.52 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.427 ' HB2' ' SD ' ' A' ' 67' ' ' MET . . . -92.7 114.81 27.47 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.158 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.9 p -97.09 153.91 38.33 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 116.408 -0.36 . . . . 10.0 110.836 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -65.42 -16.43 54.18 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.399 2.066 . . . . 10.0 111.638 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 19.0 ptt? -86.2 -6.5 58.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.701 -0.681 . . . . 10.0 110.682 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -79.44 -56.99 3.92 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.187 -0.671 . . . . 10.0 109.187 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 92.86 -69.07 1.69 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.849 -0.691 . . . . 10.0 113.229 178.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 35.5 p -118.91 166.22 13.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.179 0.514 . . . . 10.0 111.993 -178.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.523 HD13 ' CE2' ' A' ' 112' ' ' TYR . 61.4 tp -56.64 -40.69 75.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.852 -1.067 . . . . 10.0 111.06 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -61.53 -51.98 66.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.716 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.97 -40.29 95.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.004 0.43 . . . . 10.0 111.318 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.427 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 54.4 ttp -62.2 -53.67 51.89 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.131 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.7 mt -63.82 -33.65 76.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.024 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.11 -43.24 91.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.327 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.3 ttm-85 -67.7 -44.31 78.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.481 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 40.2 m0 -56.65 -52.3 65.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.037 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.77 -45.42 82.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.555 -179.268 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.92 -40.54 93.56 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.736 0.303 . . . . 10.0 111.62 -179.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -60.62 -41.85 95.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.163 -0.472 . . . . 10.0 111.425 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 20.0 m -98.94 12.32 36.25 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.229 0.455 . . . . 10.0 112.229 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 57.66 41.14 25.88 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.371 0.605 . . . . 10.0 111.389 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 60.3 mtp -104.27 173.48 6.29 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.023 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -104.94 158.06 16.79 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.511 -0.313 . . . . 10.0 110.769 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 19.8 tp -129.5 136.24 49.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.412 0.625 . . . . 10.0 111.577 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.463 ' HB2' ' HG ' ' A' ' 127' ' ' LEU . 1.8 m -124.22 95.34 4.51 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.036 -0.984 . . . . 10.0 109.525 179.153 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.524 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 12.6 t80 -91.79 97.88 11.27 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.537 -0.542 . . . . 10.0 109.537 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 38.9 m-80 -101.26 31.33 3.73 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.149 0.499 . . . . 10.0 111.065 -178.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.524 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 64.2 mt -96.03 140.54 22.32 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.59 -30.83 93.13 Favored 'Trans proline' 0 N--CA 1.466 -0.137 0 C-N-CA 122.778 2.319 . . . . 10.0 112.187 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 17.0 m -149.88 170.5 18.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.224 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.463 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 4.9 p-10 -87.06 147.28 25.75 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.953 -0.567 . . . . 10.0 109.699 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -124.55 141.22 52.25 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.71 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -83.9 151.15 25.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.093 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -56.05 120.77 8.0 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.125 178.985 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 pt -67.96 -29.62 45.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 112.567 0.58 . . . . 10.0 112.567 -179.201 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.421 ' H ' HG23 ' A' ' 93' ' ' VAL . . . 140.35 -65.27 0.52 Allowed Glycine 0 CA--C 1.521 0.427 0 C-N-CA 120.577 -0.82 . . . . 10.0 112.789 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.59 -0.85 2.72 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.913 2.409 . . . . 10.0 112.89 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.421 HG23 ' H ' ' A' ' 91' ' ' GLY . 2.0 t -67.34 -38.21 80.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.118 0.485 . . . . 10.0 109.907 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 74.3 m -68.83 -11.69 60.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.543 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -84.16 -6.75 59.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.164 0.507 . . . . 10.0 110.064 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.415 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 34.8 mt -94.76 105.25 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-N 115.782 -0.645 . . . . 10.0 109.6 179.617 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.0 m -139.5 96.02 3.02 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.374 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.0 t -131.32 156.32 45.69 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.59 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.54 -13.41 51.89 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.085 0.469 . . . . 10.0 110.753 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.9 t -94.49 114.69 26.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.105 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.51 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 9.3 p -65.07 -30.99 52.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.993 0.425 . . . . 10.0 109.943 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -67.78 -43.27 80.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.79 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -66.79 -40.38 88.1 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.272 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.92 -50.81 67.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.751 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.93 -31.51 72.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.918 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 54.4 m -66.69 -45.42 78.89 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.156 0.503 . . . . 10.0 110.395 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -71.23 -41.33 70.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.714 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 19.2 mt -58.07 -48.66 79.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 10.0 111.391 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.434 ' O ' ' HB2' ' A' ' 113' ' ' ALA . 4.9 p -62.83 -22.79 66.9 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.038 0.384 . . . . 10.0 112.038 -179.003 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.77 -43.71 45.14 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.282 0.563 . . . . 10.0 110.494 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 13.6 t -78.96 -32.52 15.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 121.58 0.705 . . . . 10.0 110.707 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.523 ' CE2' HD13 ' A' ' 64' ' ' LEU . 3.1 m-85 -81.16 -21.94 39.33 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.28 -0.873 . . . . 10.0 112.574 -178.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.434 ' HB2' ' O ' ' A' ' 109' ' ' SER . . . -52.84 -27.95 20.63 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.772 0.286 . . . . 10.0 111.772 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.4 -21.36 61.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.073 0.463 . . . . 10.0 111.123 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -95.44 -25.99 16.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.981 -0.554 . . . . 10.0 109.691 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 107.41 34.06 2.99 Favored Glycine 0 N--CA 1.448 -0.539 0 CA-C-N 115.62 -0.718 . . . . 10.0 112.291 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.472 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 72.2 t -128.87 128.07 67.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.682 0.277 . . . . 10.0 111.104 -179.443 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.4 m -123.47 104.29 8.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.21 0.529 . . . . 10.0 110.179 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.47 HG12 HG13 ' A' ' 128' ' ' VAL . 5.2 m -94.23 139.7 17.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.924 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -147.11 152.49 38.56 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.045 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.433 HG22 ' CD2' ' A' ' 126' ' ' LEU . 2.9 t -110.12 120.69 61.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 17.5 m -136.91 115.87 12.32 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.544 -0.298 . . . . 10.0 111.103 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 63.21 48.56 3.64 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.669 -0.696 . . . . 10.0 111.523 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 16.0 t30 60.73 23.54 13.42 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.082 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 40.9 tttt -126.74 131.0 51.43 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.475 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.433 ' CD2' HG22 ' A' ' 121' ' ' VAL . 95.2 mt -88.09 121.62 30.71 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 108.822 -0.807 . . . . 10.0 108.822 179.315 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.463 ' HG ' ' HB2' ' A' ' 80' ' ' SER . 0.3 OUTLIER -117.46 119.52 35.31 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.201 0.524 . . . . 10.0 111.035 -179.031 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.515 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 2.8 t -102.89 119.67 51.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 CA-C-N 115.644 -0.707 . . . . 10.0 109.104 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -127.66 132.99 24.62 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-O 120.909 0.385 . . . . 10.0 110.815 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.53 132.44 12.22 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 122.7 2.266 . . . . 10.0 112.554 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 1.1 m -96.61 148.3 34.23 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.053 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -79.76 72.72 6.37 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 122.57 2.18 . . . . 10.0 112.62 -179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 27.5 m -127.34 162.91 31.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.291 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 2.2 m -89.41 107.15 18.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.777 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.54 -21.96 65.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.309 0.576 . . . . 10.0 110.729 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -152.88 -160.82 9.88 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 111.043 -0.823 . . . . 10.0 111.043 179.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -71.84 84.46 0.93 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.932 0.396 . . . . 10.0 110.456 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -137.73 156.53 47.89 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.727 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 28.1 tp . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.577 -0.725 . . . . 10.0 110.093 179.962 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.534 0 N-CA-C 111.681 -0.568 . . . . 10.0 111.681 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 m -61.19 -47.27 86.9 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.688 0.28 . . . . 10.0 111.242 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 -78.54 86.2 4.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.673 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 65.2 mtt -71.84 147.16 47.44 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.601 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.5 t -164.65 150.58 10.37 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.083 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -142.09 108.67 5.85 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-O 120.969 0.414 . . . . 10.0 110.743 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -75.02 128.7 11.68 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.555 2.17 . . . . 10.0 112.233 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -136.08 155.68 77.44 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.049 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.16 102.7 0.19 Allowed 'Trans proline' 0 C--O 1.235 0.36 0 C-N-CA 122.609 2.206 . . . . 10.0 112.147 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -99.22 -57.11 2.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.401 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -164.48 127.14 2.36 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.812 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -76.6 -76.06 0.85 Allowed Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.724 -0.75 . . . . 10.0 112.735 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 64.97 54.21 29.27 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.807 -0.711 . . . . 10.0 111.578 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -100.48 -176.98 3.36 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 51.8 m95 59.76 42.77 16.26 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.324 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -98.31 -173.12 2.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.607 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 57.68 67.93 0.91 Allowed 'General case' 0 C--O 1.233 0.204 0 O-C-N 123.897 0.748 . . . . 10.0 109.81 -179.167 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -144.76 118.09 2.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.676 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.7 t30 -152.33 125.28 8.52 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.918 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -128.56 16.23 6.48 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.432 0.634 . . . . 10.0 109.598 179.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -89.66 97.28 11.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.642 -0.708 . . . . 10.0 110.129 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -131.08 75.55 1.66 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.004 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -157.39 159.85 37.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.442 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -110.8 149.9 41.04 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.561 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -62.09 -53.9 1.77 Allowed 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.308 2.005 . . . . 10.0 111.036 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.4 m -111.87 94.88 5.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.876 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -79.98 -37.82 33.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.309 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.465 HD13 ' H ' ' A' ' 47' ' ' ILE . 0.2 OUTLIER -65.86 152.02 94.0 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.794 -179.847 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -52.28 114.61 1.73 Allowed 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.017 2.478 . . . . 10.0 111.998 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 31.3 tp -95.34 93.57 7.34 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.907 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -84.36 124.83 31.71 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.78 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.75 105.52 0.31 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.06 0.457 . . . . 10.0 111.713 -179.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.4 m -132.49 90.43 2.78 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.636 -0.711 . . . . 10.0 109.436 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -71.15 129.61 39.38 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.497 -0.774 . . . . 10.0 111.235 -179.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.8 m -87.72 113.79 23.73 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.093 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -80.47 108.55 14.19 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.095 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.444 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 16.6 pt20 -141.99 159.56 41.98 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.886 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.637 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -92.92 126.97 38.26 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.03 -0.532 . . . . 10.0 109.842 178.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.404 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 16.2 p -118.31 158.86 45.57 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 116.115 -0.493 . . . . 10.0 109.972 -179.567 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.404 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 56.1 Cg_endo -72.04 -0.96 9.3 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 122.183 1.922 . . . . 10.0 111.495 178.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 68.5 mtm -90.31 -26.83 19.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.444 -0.798 . . . . 10.0 110.259 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -65.79 -50.08 66.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.964 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.43 -66.11 1.77 Allowed Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.589 -0.815 . . . . 10.0 113.153 178.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 29.9 p -125.35 173.93 8.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.143 0.497 . . . . 10.0 111.86 -178.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 46.1 tp -62.75 -41.22 99.1 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.006 -0.997 . . . . 10.0 110.491 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -61.31 -54.74 40.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.841 -179.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.92 -42.09 84.04 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.402 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 57.3 ttp -61.2 -51.5 68.73 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.488 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 86.4 mt -64.03 -38.04 89.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.116 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -60.34 -44.8 95.17 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 120.853 0.359 . . . . 10.0 110.311 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.0 mtp85 -68.98 -42.16 76.9 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.44 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 31.2 m0 -55.69 -48.54 74.92 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.43 0.633 . . . . 10.0 109.863 178.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.504 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -68.55 -51.84 38.52 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.158 -0.928 . . . . 10.0 111.613 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.27 -46.28 72.63 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.057 0.391 . . . . 10.0 112.057 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -60.75 -40.19 91.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.94 0.4 . . . . 10.0 111.571 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.4 m -93.14 9.71 34.8 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.887 -178.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 56.14 48.25 17.86 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.482 0.658 . . . . 10.0 110.45 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 81.1 mtp -116.2 173.54 6.53 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.047 -0.979 . . . . 10.0 109.88 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -108.83 160.74 15.74 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.433 -0.348 . . . . 10.0 110.228 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 19.9 tp -133.71 143.0 48.23 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.291 0.567 . . . . 10.0 110.773 -179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.474 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 31.7 m -127.91 96.06 4.38 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.042 -0.981 . . . . 10.0 109.595 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.521 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 13.8 t80 -93.02 98.16 11.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.441 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -98.64 22.07 10.45 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.075 0.464 . . . . 10.0 111.159 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.521 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 48.0 mt -88.01 143.59 33.37 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 109.565 -0.532 . . . . 10.0 109.565 179.324 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -61.71 -30.79 85.66 Favored 'Trans proline' 0 N--CA 1.465 -0.162 0 C-N-CA 122.633 2.222 . . . . 10.0 112.881 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.3 m -148.27 167.73 24.39 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.608 -0.269 . . . . 10.0 110.576 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.451 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 3.8 p-10 -83.47 146.16 28.55 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.57 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -129.16 149.56 50.91 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 110.241 -0.281 . . . . 10.0 110.241 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.58 169.95 11.28 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.79 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -74.19 144.28 44.84 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.813 -0.44 . . . . 10.0 109.813 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.7 pt -83.64 -36.15 12.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.337 -0.392 . . . . 10.0 111.71 -179.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 155.07 -67.92 0.3 Allowed Glycine 0 N--CA 1.453 -0.19 0 C-N-CA 120.297 -0.954 . . . . 10.0 113.13 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.5 -12.13 13.11 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 123.395 2.73 . . . . 10.0 113.468 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.402 HG23 ' H ' ' A' ' 93' ' ' VAL . 2.9 t -63.75 -39.49 85.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.028 0.442 . . . . 10.0 110.357 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.637 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.3 m -69.08 -7.53 36.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.843 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.99 -3.28 48.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.035 0.445 . . . . 10.0 110.604 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.444 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 52.2 mt -95.79 113.47 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.74 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.0 m -141.98 91.52 2.36 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.34 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 11.9 t -129.97 155.8 45.5 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.299 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.81 -10.77 54.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.037 0.446 . . . . 10.0 111.071 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.5 t -93.54 113.26 25.34 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.776 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.25 -28.94 45.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.054 0.454 . . . . 10.0 110.439 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 61.7 mt-30 -70.51 -39.64 73.98 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.013 -0.539 . . . . 10.0 109.81 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLN . . . . . 0.427 ' O ' ' HB ' ' A' ' 106' ' ' THR . 53.7 tp60 -69.99 -41.0 74.96 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.047 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.99 -50.03 73.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.51 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.47 -30.75 71.82 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.367 179.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.427 ' HB ' ' O ' ' A' ' 103' ' ' GLN . 55.5 m -64.34 -51.07 65.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.824 -0.625 . . . . 10.0 110.811 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -68.09 -39.75 82.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.153 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.449 ' HB3' HG21 ' A' ' 119' ' ' VAL . 1.6 mp -60.95 -50.9 71.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.126 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 13.0 p -63.54 -31.93 73.24 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.102 -0.239 . . . . 10.0 111.247 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.23 -40.79 98.44 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.146 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.587 HG13 ' HD1' ' A' ' 112' ' ' TYR . 12.0 p -89.28 -24.31 5.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 120.945 0.403 . . . . 10.0 111.942 -179.233 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.587 ' HD1' HG13 ' A' ' 111' ' ' VAL . 3.4 m-30 -83.35 -24.26 32.15 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.575 0.954 . . . . 10.0 113.575 -179.07 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.04 -32.62 15.91 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.64 -18.94 62.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.903 0.382 . . . . 10.0 111.386 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -98.03 -0.26 44.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.021 0.439 . . . . 10.0 110.182 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.85 21.25 56.25 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.975 -0.631 . . . . 10.0 112.887 179.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 92.5 t -121.49 128.64 75.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.805 0.336 . . . . 10.0 110.554 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.9 m -126.96 104.17 7.86 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.982 0.42 . . . . 10.0 110.728 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.659 HG12 HG13 ' A' ' 128' ' ' VAL . 27.7 m -94.59 148.26 5.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.012 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 18.9 m -154.62 175.89 13.09 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.887 -0.783 . . . . 10.0 108.887 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 13.9 p -142.62 125.77 14.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 121.526 0.679 . . . . 10.0 110.268 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 19.6 m -113.25 108.31 17.09 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.246 -0.888 . . . . 10.0 109.36 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 64.57 -89.61 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 O-C-N 123.755 0.66 . . . . 10.0 111.346 -179.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.9 m-20 -132.76 23.96 4.31 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.188 0.518 . . . . 10.0 109.843 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.474 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 38.6 tttt -125.72 127.91 46.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.032 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.504 HD12 ' HB2' ' A' ' 72' ' ' ALA . 36.0 mt -87.31 122.28 30.87 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.463 -0.939 . . . . 10.0 108.463 178.701 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -107.12 115.58 30.43 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.179 0.514 . . . . 10.0 111.121 -178.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.659 HG13 HG12 ' A' ' 119' ' ' VAL . 5.7 t -112.4 117.91 56.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 108.268 -1.012 . . . . 10.0 108.268 178.324 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -137.66 143.33 40.13 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-O 120.602 0.239 . . . . 10.0 110.456 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -81.03 142.53 13.76 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.519 2.146 . . . . 10.0 111.932 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.405 HG23 HG22 ' A' ' 133' ' ' VAL . 3.3 m -108.63 143.27 27.19 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.14 179.184 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -76.61 73.21 5.3 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.708 2.272 . . . . 10.0 112.695 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.405 HG22 HG23 ' A' ' 131' ' ' VAL . 25.7 m -126.91 169.77 17.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.573 -0.739 . . . . 10.0 110.084 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 12.9 m -81.06 98.1 7.82 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.138 0.495 . . . . 10.0 111.094 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -93.18 -43.91 8.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.942 -0.572 . . . . 10.0 109.997 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 162.72 179.29 37.2 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.679 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.96 120.49 13.7 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.833 0.349 . . . . 10.0 111.412 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -102.26 -29.27 11.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.75 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.434 HD13 ' HA ' ' A' ' 139' ' ' LEU . 2.4 mm? . . . . . 0 C--O 1.248 0.977 0 CA-C-O 118.527 -0.749 . . . . 10.0 110.261 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.733 0 N-CA-C 111.859 -0.496 . . . . 10.0 111.859 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.25 -29.23 70.26 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.909 0.385 . . . . 10.0 111.209 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 47.7 m80 -125.5 157.2 37.61 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.013 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -74.9 99.13 3.72 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.805 -0.443 . . . . 10.0 109.805 179.611 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.83 89.72 2.34 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.009 0.433 . . . . 10.0 111.306 -179.534 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 44.9 tttp -91.22 125.18 59.27 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.374 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -70.63 105.83 1.7 Allowed 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.666 2.244 . . . . 10.0 111.561 179.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.95 138.8 72.91 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.745 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -80.81 36.56 0.63 Allowed 'Trans proline' 0 N--CA 1.462 -0.356 0 C-N-CA 122.758 2.305 . . . . 10.0 111.514 179.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -86.1 93.38 8.99 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.429 -0.805 . . . . 10.0 110.309 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -151.99 76.78 1.19 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.22 0.533 . . . . 10.0 111.065 -179.535 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -113.13 131.11 9.85 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.793 -0.718 . . . . 10.0 111.515 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 97.3 49.66 1.83 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.486 -0.864 . . . . 10.0 111.936 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 33' ' ' ARG . 13.4 ttt180 -64.73 -39.59 93.89 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.201 0.524 . . . . 10.0 109.666 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 11.3 p-90 -141.58 134.1 28.32 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.834 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.1 pttp -153.8 81.67 1.15 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.47 0.652 . . . . 10.0 110.578 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -98.6 96.67 8.11 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.321 -0.854 . . . . 10.0 109.697 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -141.92 122.79 12.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.252 -179.347 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -161.38 128.99 4.15 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.656 178.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -151.93 87.66 1.36 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.358 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -153.94 75.09 1.01 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.289 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -93.39 92.89 7.86 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.039 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -116.52 153.38 32.28 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.601 -179.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.84 149.5 9.35 Favored Pre-proline 0 C--N 1.317 -0.827 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.151 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -57.89 103.43 0.14 Allowed 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.854 2.37 . . . . 10.0 111.931 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 8.1 m -75.77 103.1 5.71 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.958 -179.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -139.17 114.1 9.38 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.286 0.565 . . . . 10.0 110.84 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.0 pt -134.85 68.44 71.17 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.694 179.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -68.77 130.92 21.52 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.657 2.238 . . . . 10.0 112.027 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.81 71.58 0.77 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.94 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -115.43 117.01 29.2 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.61 125.61 24.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.646 0.26 . . . . 10.0 110.653 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.9 m -144.38 105.67 4.23 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.127 0.489 . . . . 10.0 111.063 -179.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -78.38 123.57 27.14 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 178.327 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.6 m -79.83 121.02 24.88 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.86 0.362 . . . . 10.0 111.032 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -90.99 111.64 23.19 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.631 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -146.08 147.83 32.0 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.847 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.493 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -81.7 115.25 20.86 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.362 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 73.2 p -96.61 152.23 38.43 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.24 -0.436 . . . . 10.0 109.873 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.93 -18.38 64.66 Favored 'Trans proline' 0 CA--C 1.527 0.159 0 C-N-CA 122.225 1.95 . . . . 10.0 112.041 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.0 ptt? -89.6 2.92 54.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.515 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.604 ' HA ' ' NH1' ' A' ' 70' ' ' ARG . 28.9 m-20 -82.09 -52.21 7.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.262 0.553 . . . . 10.0 109.808 178.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.08 -66.98 2.97 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.534 -0.757 . . . . 10.0 113.697 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.5 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 24.4 p -122.34 165.92 15.51 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.663 0.616 . . . . 10.0 112.663 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.518 HD13 ' CE2' ' A' ' 112' ' ' TYR . 33.2 tp -62.42 -42.05 99.16 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.819 -1.082 . . . . 10.0 111.143 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 51.8 tttt -57.99 -55.37 35.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.739 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.6 m -59.63 -41.22 89.96 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.155 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 57.6 ttp -63.54 -52.53 60.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.856 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 70.8 mt -62.1 -40.24 95.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.369 -0.378 . . . . 10.0 111.286 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -60.54 -43.39 97.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.312 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.604 ' NH1' ' HA ' ' A' ' 61' ' ' ASP . 97.2 mtt180 -66.85 -42.5 85.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.225 179.287 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -58.83 -54.13 50.58 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.605 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.96 -40.16 96.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.687 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.11 -40.74 94.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.771 0.32 . . . . 10.0 111.311 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.69 -21.14 64.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.408 -179.471 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.408 ' HB2' ' SD ' ' A' ' 77' ' ' MET . 1.5 m -109.35 7.09 24.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.526 -0.306 . . . . 10.0 111.706 -179.079 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 61.4 t30 56.46 48.22 17.26 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.837 0.827 . . . . 10.0 110.655 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.408 ' SD ' ' HB2' ' A' ' 75' ' ' SER . 72.7 mtp -116.89 173.19 6.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.16 -0.927 . . . . 10.0 110.128 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.424 ' HB3' ' HE3' ' A' ' 125' ' ' LYS . 29.3 mm-40 -106.1 159.48 16.04 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.969 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.7 tp -134.8 138.77 44.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.319 0.581 . . . . 10.0 111.669 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.426 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 1.4 m -123.74 96.59 5.02 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.08 179.159 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.625 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 8.7 t80 -91.65 102.82 15.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.864 -178.828 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.482 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 37.1 m-80 -104.85 33.49 3.59 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.009 0.433 . . . . 10.0 110.908 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.528 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 55.6 mt -102.94 146.88 33.23 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.018 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.97 -34.54 94.98 Favored 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.735 2.29 . . . . 10.0 112.321 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.3 m -152.5 166.59 31.51 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.36 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.625 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 9.5 p-10 -84.92 128.75 34.76 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 178.511 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -100.39 136.99 39.42 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.18 -178.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.5 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.9 OUTLIER -72.59 154.99 40.5 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.518 179.181 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.11 114.84 3.34 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 179.267 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.3 pt -59.74 -32.83 50.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -178.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 149.26 -70.75 0.31 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.578 -0.82 . . . . 10.0 112.66 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.14 -4.69 3.21 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.511 2.807 . . . . 10.0 113.48 -179.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.414 HG23 ' H ' ' A' ' 93' ' ' VAL . 2.9 t -64.97 -36.04 76.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.308 0.575 . . . . 10.0 110.236 179.349 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.493 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.7 OUTLIER -67.22 -14.14 62.63 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.544 -0.753 . . . . 10.0 111.677 -179.342 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -87.67 1.56 53.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.876 0.37 . . . . 10.0 111.1 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 40.3 mt -98.51 110.28 25.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.1 t -141.12 93.99 2.65 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.543 -178.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.8 t -132.19 156.78 45.83 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.511 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -89.5 -13.69 36.91 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.052 0.453 . . . . 10.0 110.791 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.5 114.06 26.34 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.336 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.5 p -62.2 -33.83 60.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.832 0.348 . . . . 10.0 110.854 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -64.18 -39.38 93.87 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.122 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -72.53 -42.1 65.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.305 -0.407 . . . . 10.0 109.999 179.176 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.77 -51.09 66.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.91 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.74 -33.08 74.85 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.958 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 95.9 m -67.59 -47.12 70.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.669 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.406 ' O ' HG23 ' A' ' 111' ' ' VAL . 14.4 mt-10 -66.26 -40.08 89.9 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.262 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.402 ' O ' ' HB2' ' A' ' 112' ' ' TYR . 30.7 mt -61.24 -49.6 76.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.934 179.243 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.429 ' O ' ' HB2' ' A' ' 113' ' ' ALA . 4.6 p -64.17 -22.14 66.82 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 111.765 0.283 . . . . 10.0 111.765 -179.217 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.49 -46.82 52.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.09 0.471 . . . . 10.0 110.311 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 107' ' ' GLU . 4.7 t -75.78 -47.74 32.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.678 0.752 . . . . 10.0 110.334 179.72 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.518 ' CE2' HD13 ' A' ' 64' ' ' LEU . 3.6 m-30 -64.33 -21.11 66.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.928 -1.033 . . . . 10.0 113.254 -178.635 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.447 ' O ' HG21 ' A' ' 133' ' ' VAL . . . -52.18 -28.55 18.64 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.806 0.298 . . . . 10.0 111.806 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.12 -23.72 54.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.148 0.499 . . . . 10.0 111.101 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 17.8 mp0 -89.75 -6.92 55.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.298 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 89.11 27.38 23.53 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.72 -0.752 . . . . 10.0 111.994 -179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.453 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 97.0 t -127.8 134.51 65.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.849 0.357 . . . . 10.0 110.605 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 14.4 m -136.16 105.15 5.91 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.267 0.556 . . . . 10.0 110.614 179.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.518 HG12 HG13 ' A' ' 128' ' ' VAL . 13.2 m -97.45 150.09 4.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.522 -0.763 . . . . 10.0 111.145 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 15.1 m -155.66 170.82 21.13 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.366 -0.605 . . . . 10.0 109.366 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.432 HG22 ' CD2' ' A' ' 126' ' ' LEU . 2.8 t -120.96 129.47 75.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 179.158 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 25.3 m -145.25 117.32 8.32 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.717 0.294 . . . . 10.0 111.268 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.56 50.68 5.59 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.551 -0.749 . . . . 10.0 111.901 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 30.5 t30 59.48 25.86 14.72 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.394 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.426 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 56.7 tttt -131.54 137.64 48.57 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.432 ' CD2' HG22 ' A' ' 121' ' ' VAL . 97.3 mt -87.91 122.16 31.2 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.116 -0.698 . . . . 10.0 109.116 179.4 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -103.91 115.76 31.05 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.317 -178.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.518 HG13 HG12 ' A' ' 119' ' ' VAL . 10.6 t -108.54 118.22 55.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 N-CA-C 108.552 -0.907 . . . . 10.0 108.552 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -137.71 139.64 27.41 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.436 -178.65 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -79.13 154.4 25.29 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.736 2.29 . . . . 10.0 112.098 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.0 m -121.99 144.61 41.62 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.074 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -82.72 85.78 1.57 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 122.821 2.347 . . . . 10.0 111.803 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.447 HG21 ' O ' ' A' ' 113' ' ' ALA . 16.0 m -124.89 175.97 6.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.156 -178.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.32 164.19 31.51 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.21 179.388 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.4 m -76.17 -34.9 59.36 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.71 0.291 . . . . 10.0 111.277 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -75.56 102.53 1.51 Allowed Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.736 -0.745 . . . . 10.0 112.561 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -92.55 -29.5 16.15 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.007 0.432 . . . . 10.0 110.85 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.92 173.8 8.03 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.292 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 93.6 mt . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.479 -0.772 . . . . 10.0 110.127 179.387 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 111.924 -0.47 . . . . 10.0 111.924 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.8 m -82.67 122.63 28.39 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.759 0.314 . . . . 10.0 110.403 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 9.6 m170 -106.51 159.35 16.24 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.378 -0.373 . . . . 10.0 110.706 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 8.4 ptt? -123.98 168.61 12.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.49 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.18 145.87 28.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.081 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.03 142.95 14.7 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.4 -179.767 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -77.74 -171.27 1.14 Allowed 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.771 2.314 . . . . 10.0 112.42 -179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.89 142.88 18.36 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.571 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -59.03 119.95 7.51 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.534 2.156 . . . . 10.0 112.25 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -81.49 169.64 16.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.606 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -127.31 158.04 38.28 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.025 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 177.61 133.15 1.8 Allowed Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.275 -0.964 . . . . 10.0 112.575 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -76.57 82.22 1.07 Allowed Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 111.704 -0.558 . . . . 10.0 111.704 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.51 -2.58 18.81 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.772 0.32 . . . . 10.0 111.148 -179.366 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -96.04 -1.7 48.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.333 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.6 mttp -80.48 89.96 5.65 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.805 -0.443 . . . . 10.0 109.805 179.354 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -86.96 98.83 11.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.268 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -141.12 135.93 32.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.137 0.494 . . . . 10.0 111.029 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -85.13 -49.51 8.19 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.117 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 34.0 m-70 -149.04 163.76 36.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.179 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -93.88 70.03 3.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.203 0.525 . . . . 10.0 109.92 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -78.54 104.2 8.98 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.107 -179.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -86.04 -30.73 22.42 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.6 -0.519 . . . . 10.0 109.6 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -159.6 153.79 20.06 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.6 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.96 -30.93 92.82 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.377 2.052 . . . . 10.0 112.098 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 10.5 t -174.39 161.18 3.34 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.314 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -117.06 79.02 1.27 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.201 0.524 . . . . 10.0 110.065 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 29.0 pt -110.88 152.46 43.6 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.678 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.85 141.67 59.93 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.159 1.906 . . . . 10.0 110.601 178.345 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.68 110.05 21.98 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.176 0.513 . . . . 10.0 110.105 -179.544 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -99.33 130.17 45.59 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.523 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.99 141.84 31.8 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.954 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 16.1 m -136.54 97.26 3.52 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.203 0.525 . . . . 10.0 109.772 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -79.02 127.99 32.68 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.586 -0.734 . . . . 10.0 111.329 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.7 m -84.39 117.74 23.81 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.143 178.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.437 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 93.0 m-85 -84.99 116.18 23.24 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.006 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -153.08 146.88 25.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.142 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.407 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -81.11 136.63 35.94 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.904 -0.406 . . . . 10.0 109.904 179.169 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 80.3 p -119.52 157.91 50.52 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 116.341 -0.391 . . . . 10.0 110.354 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -68.61 -8.16 22.43 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.405 2.07 . . . . 10.0 111.802 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 60.3 mtt -84.72 -17.36 38.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.496 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -73.27 -49.21 28.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.47 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.62 -61.64 4.54 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.871 -0.68 . . . . 10.0 112.413 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.438 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 24.4 p -121.55 170.37 9.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.872 0.368 . . . . 10.0 111.085 -179.658 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.437 ' O ' HD22 ' A' ' 64' ' ' LEU . 1.7 tm? -67.15 -39.09 86.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.226 179.431 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.41 -55.14 38.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.129 179.517 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.9 m -65.09 -27.47 68.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.238 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.403 ' HB2' ' O ' ' A' ' 63' ' ' THR . 9.7 tmm? -69.78 -55.27 10.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.371 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 43.0 mt -64.53 -32.74 74.52 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.669 0.271 . . . . 10.0 111.087 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -60.5 -39.06 86.38 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.636 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 59.7 ttp85 -70.18 -41.73 73.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.434 . . . . 10.0 110.222 179.636 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 29.1 m0 -58.02 -48.72 79.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.473 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.505 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -68.97 -42.46 76.59 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.553 -0.749 . . . . 10.0 111.626 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.42 -40.76 79.04 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -178.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -63.13 -38.23 90.37 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.854 0.316 . . . . 10.0 111.854 -179.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 10.2 m -98.75 11.63 38.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.435 -0.348 . . . . 10.0 111.817 -178.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 60.5 t30 58.14 30.1 18.86 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.482 0.658 . . . . 10.0 110.762 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 73.1 mtp -92.9 169.67 10.27 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.698 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -106.71 151.09 25.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.043 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 41.9 tp -116.08 126.54 53.89 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.288 0.566 . . . . 10.0 111.117 179.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.412 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 0.5 OUTLIER -108.97 95.87 5.94 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 178.725 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.564 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 7.7 t80 -93.41 101.82 14.04 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.088 -179.056 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.7 m-80 -100.68 31.07 3.65 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.326 0.584 . . . . 10.0 110.452 -179.469 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.536 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 32.1 mt -105.57 151.24 39.75 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.606 -0.725 . . . . 10.0 109.716 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.74 -27.68 21.47 Favored 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 122.542 2.161 . . . . 10.0 112.918 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.0 m -153.75 167.24 30.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.646 0.26 . . . . 10.0 110.76 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.564 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 6.6 p-10 -93.04 146.3 23.73 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.43 -0.581 . . . . 10.0 109.43 178.441 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.428 ' HE2' HD13 ' A' ' 83' ' ' LEU . 9.2 m-85 -124.78 157.93 34.57 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.416 -0.356 . . . . 10.0 110.237 -179.229 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.438 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.6 OUTLIER -81.76 163.79 22.15 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.087 179.702 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.46 119.35 15.49 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 179.373 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.4 pt -57.41 -34.92 47.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 112.439 0.533 . . . . 10.0 112.439 -179.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 152.31 -72.84 0.27 Allowed Glycine 0 CA--C 1.518 0.279 0 C-N-CA 120.06 -1.067 . . . . 10.0 113.261 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -61.54 -3.25 3.21 Favored 'Trans proline' 0 N--CA 1.478 0.588 0 C-N-CA 123.374 2.716 . . . . 10.0 113.903 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.1 t -61.62 -41.24 89.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.237 0.541 . . . . 10.0 110.64 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.407 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.9 OUTLIER -73.09 -7.11 49.87 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.613 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.09 2.28 56.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.927 0.394 . . . . 10.0 111.017 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 32.5 mt -104.6 113.76 42.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.558 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.4 m -138.34 99.47 3.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.004 0.431 . . . . 10.0 111.868 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.8 t -131.52 156.24 46.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.535 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.56 -13.12 43.78 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.043 0.449 . . . . 10.0 110.903 178.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 17.0 t -93.13 116.82 29.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.219 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.437 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 14.6 p -65.1 -30.38 50.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.921 0.391 . . . . 10.0 110.206 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -68.44 -42.35 79.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.954 -0.567 . . . . 10.0 109.825 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -68.75 -43.37 75.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.937 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.02 -48.34 73.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.626 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.72 -39.61 92.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.573 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 62.2 m -65.69 -48.0 73.53 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.807 -0.633 . . . . 10.0 111.0 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -65.75 -38.71 89.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.045 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.411 ' HA ' HD23 ' A' ' 108' ' ' LEU . 16.7 mt -62.54 -48.89 77.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.749 -0.463 . . . . 10.0 109.749 178.638 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.8 m -58.95 -33.01 70.13 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.854 -0.612 . . . . 10.0 111.227 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.25 -40.51 94.3 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.933 0.396 . . . . 10.0 110.999 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.85 -40.72 15.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.49 0.662 . . . . 10.0 110.852 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.433 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 8.3 m-30 -69.64 -25.46 63.93 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.249 -0.887 . . . . 10.0 112.647 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.576 ' O ' HG21 ' A' ' 133' ' ' VAL . . . -50.05 -42.27 49.42 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.295 0.48 . . . . 10.0 112.295 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.37 -23.84 67.43 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -95.1 -3.79 47.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.839 0.352 . . . . 10.0 110.928 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 88.62 23.8 35.22 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.715 -0.755 . . . . 10.0 113.237 179.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.433 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 88.6 t -126.33 139.76 50.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.965 0.412 . . . . 10.0 110.578 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.0 m -142.28 140.84 32.33 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 110.068 -0.345 . . . . 10.0 110.068 178.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.437 HG12 HG22 ' A' ' 128' ' ' VAL . 11.0 m -126.5 134.23 66.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.103 0.478 . . . . 10.0 111.55 -178.725 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.8 m -140.1 143.71 36.41 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 179.093 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.468 ' HB ' HD23 ' A' ' 126' ' ' LEU . 3.1 p -107.75 127.58 63.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-O 121.275 0.559 . . . . 10.0 110.039 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.4 m -145.99 130.53 17.83 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.153 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.32 39.51 18.77 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.564 0.54 . . . . 10.0 111.089 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 14.4 m120 62.67 28.84 16.76 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.65 -0.705 . . . . 10.0 110.986 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.412 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 66.7 tttt -130.81 132.25 45.13 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.867 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.505 HD12 ' HB2' ' A' ' 72' ' ' ALA . 48.9 mt -87.88 122.11 31.11 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.298 -1.001 . . . . 10.0 108.298 179.097 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.14 115.52 27.65 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.062 0.458 . . . . 10.0 111.286 -178.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.437 HG22 HG12 ' A' ' 119' ' ' VAL . 3.2 t -97.17 119.91 45.82 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 N-CA-C 108.742 -0.836 . . . . 10.0 108.742 178.534 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -132.6 128.48 20.98 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 109.943 -0.392 . . . . 10.0 109.943 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.23 131.22 16.23 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.311 2.008 . . . . 10.0 112.087 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -89.85 149.55 42.14 Favored Pre-proline 0 C--N 1.318 -0.771 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.315 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -79.26 73.34 6.06 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 122.843 2.362 . . . . 10.0 113.263 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.576 HG21 ' O ' ' A' ' 113' ' ' ALA . 16.2 m -129.03 132.0 67.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 120.877 0.37 . . . . 10.0 110.7 179.757 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 9.0 m -164.03 159.53 20.72 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.007 -0.542 . . . . 10.0 109.789 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.75 115.39 3.95 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.224 0.328 . . . . 10.0 110.669 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 105.01 93.36 2.3 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.933 -0.651 . . . . 10.0 111.582 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -120.43 99.6 6.66 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.79 0.328 . . . . 10.0 110.528 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -81.22 78.06 8.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.383 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' A' ' 139' ' ' LEU . 1.5 mm? . . . . . 0 C--O 1.247 0.939 0 CA-C-O 118.578 -0.725 . . . . 10.0 109.968 179.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.79 0 N-CA-C 111.816 -0.514 . . . . 10.0 111.816 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.3 m -126.48 103.08 7.41 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.914 0.388 . . . . 10.0 110.662 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 24.1 p-80 -69.41 148.3 49.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.707 179.546 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.8 ptt? -157.71 153.02 25.97 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.374 -0.376 . . . . 10.0 110.532 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 4.9 m -137.46 113.68 10.01 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.643 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -121.61 82.89 41.14 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.511 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -95.61 172.99 1.14 Allowed 'Trans proline' 0 N--CA 1.452 -0.916 0 C-N-CA 123.116 2.544 . . . . 10.0 111.904 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -136.39 139.83 30.81 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-O 120.657 0.265 . . . . 10.0 110.506 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -75.47 122.91 7.26 Favored 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 122.716 2.277 . . . . 10.0 112.28 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -104.41 162.35 13.3 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.175 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -137.65 66.85 1.44 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.266 0.555 . . . . 10.0 109.97 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -71.42 116.57 6.23 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.532 -0.758 . . . . 10.0 111.662 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 115.13 15.84 7.57 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.747 -0.739 . . . . 10.0 111.724 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -75.54 -17.1 60.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.056 0.455 . . . . 10.0 110.533 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 74.9 m95 -99.57 6.5 45.76 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.966 179.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.0 mmtt -82.34 12.96 3.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.219 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -72.35 121.89 20.25 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.843 -0.429 . . . . 10.0 109.843 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 7.0 m -134.41 155.0 38.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.662 179.576 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -154.23 110.43 3.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.091 0.472 . . . . 10.0 111.076 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 35.5 m80 -121.99 98.66 6.05 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 179.232 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 21.4 p90 -104.96 33.14 3.76 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.033 -0.531 . . . . 10.0 111.025 -178.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -74.15 109.8 7.93 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.677 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -140.52 178.17 7.5 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.583 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.51 146.03 97.51 Favored Pre-proline 0 C--N 1.319 -0.734 0 N-CA-C 110.147 -0.316 . . . . 10.0 110.147 179.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.98 -13.97 42.67 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.825 2.35 . . . . 10.0 112.451 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 15.2 t -169.94 162.7 9.34 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.72 -0.673 . . . . 10.0 109.576 179.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -121.34 88.31 2.91 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.019 0.438 . . . . 10.0 110.432 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.6 pt -127.26 76.11 76.62 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.305 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.42 111.16 3.22 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.644 2.229 . . . . 10.0 112.494 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -130.72 100.54 5.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.178 0.513 . . . . 10.0 110.006 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -127.35 86.82 2.54 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.745 -0.661 . . . . 10.0 110.378 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -113.98 118.17 33.39 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.994 0.426 . . . . 10.0 111.334 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 12.8 m -147.85 91.05 1.89 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.099 -0.704 . . . . 10.0 109.099 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -68.39 125.97 28.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.808 -0.633 . . . . 10.0 111.467 -179.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.4 m -86.19 122.21 29.86 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.76 -0.655 . . . . 10.0 110.4 179.332 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.425 ' OH ' ' HB3' ' A' ' 75' ' ' SER . 67.4 m-85 -87.68 114.12 24.0 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.741 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -146.64 145.18 29.96 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.91 -0.586 . . . . 10.0 109.994 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -79.18 123.54 27.49 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 178.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.449 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 50.6 p -111.06 158.16 36.68 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-O 120.66 0.267 . . . . 10.0 111.04 -178.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.449 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 35.6 Cg_endo -64.25 -20.19 66.57 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.431 2.087 . . . . 10.0 111.321 178.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -66.28 -35.1 79.54 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -75.11 -56.07 5.1 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.484 -0.932 . . . . 10.0 108.484 178.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.63 -56.13 3.39 Favored Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.309 -0.86 . . . . 10.0 113.536 178.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 63.5 p -108.04 166.03 11.03 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.062 0.458 . . . . 10.0 111.883 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 31.6 tp -61.92 -48.12 81.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.143 -0.935 . . . . 10.0 111.553 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -58.09 -54.55 45.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.77 -0.195 . . . . 10.0 111.133 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.3 m -58.41 -37.84 76.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.98 0.419 . . . . 10.0 111.497 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 10.1 tmm? -68.84 -52.29 31.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.002 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 26.8 mt -63.64 -34.13 77.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.519 -0.309 . . . . 10.0 111.09 -179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -62.24 -43.38 98.97 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 -64.48 -43.04 95.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.076 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 21.3 m0 -60.03 -54.48 45.53 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.719 -0.673 . . . . 10.0 110.985 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.562 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -62.94 -36.82 84.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.982 -0.554 . . . . 10.0 111.655 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.83 -44.05 97.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.811 0.339 . . . . 10.0 111.158 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.04 -34.56 77.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.55 -179.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.425 ' HB3' ' OH ' ' A' ' 55' ' ' TYR . 4.7 p -91.51 0.77 57.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.415 -0.357 . . . . 10.0 111.551 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 56.29 46.41 21.18 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.569 0.699 . . . . 10.0 109.705 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.508 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 21.9 mtm -115.37 168.07 10.3 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.698 -179.481 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -93.79 150.08 20.69 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.125 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 22.4 tp -124.06 134.66 53.35 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.92 0.39 . . . . 10.0 110.174 179.576 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.62 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 1.6 m -121.46 95.98 4.9 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.987 179.092 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.512 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 11.6 t80 -90.83 96.78 10.81 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.273 -0.64 . . . . 10.0 109.273 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -98.92 22.52 10.09 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.258 0.552 . . . . 10.0 110.841 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.512 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 63.5 mt -87.56 138.33 31.81 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.537 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -61.44 -35.78 81.15 Favored 'Trans proline' 0 C--O 1.235 0.332 0 C-N-CA 123.08 2.52 . . . . 10.0 113.122 -179.023 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.8 m -137.51 168.71 19.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.143 0.497 . . . . 10.0 111.037 -179.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -82.78 143.81 30.59 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.574 178.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.461 ' CE2' HD13 ' A' ' 83' ' ' LEU . 48.4 m-85 -124.12 145.43 49.28 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.482 -0.326 . . . . 10.0 110.193 179.651 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 1.5 m -97.82 151.57 20.06 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.882 -179.413 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.54 112.73 1.7 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 120.875 0.369 . . . . 10.0 110.126 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -62.64 -33.8 61.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 112.68 0.622 . . . . 10.0 112.68 -178.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 151.02 -64.78 0.38 Allowed Glycine 0 CA--C 1.519 0.332 0 C-N-CA 120.172 -1.013 . . . . 10.0 113.455 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.56 -13.98 28.45 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.883 2.389 . . . . 10.0 113.16 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.441 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.4 t -64.91 -35.5 75.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.862 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.93 -11.48 60.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.427 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.12 2.95 55.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.341 -0.39 . . . . 10.0 111.392 -179.438 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.599 HD13 HD12 ' A' ' 108' ' ' LEU . 39.3 mt -98.0 108.36 21.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.533 -0.303 . . . . 10.0 110.273 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.72 100.43 5.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.755 -179.196 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.2 t -132.54 155.59 48.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.579 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -91.05 -1.63 57.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.846 0.355 . . . . 10.0 111.484 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.4 t -109.01 121.44 45.13 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.467 -0.333 . . . . 10.0 110.279 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.58 -30.78 51.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.83 0.348 . . . . 10.0 110.733 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -68.88 -46.28 68.8 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 179.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -65.12 -36.38 84.08 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.329 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.34 -51.12 70.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.229 178.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.81 -33.38 75.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.632 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 51.5 m -66.91 -46.32 75.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.775 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -70.99 -36.81 72.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.277 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.599 HD12 HD13 ' A' ' 96' ' ' ILE . 2.9 mp -62.75 -47.61 82.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.751 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.1 p -62.45 -29.84 70.81 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 116.734 -0.212 . . . . 10.0 111.281 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.04 -35.74 81.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.166 0.508 . . . . 10.0 110.791 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 45.6 t -84.94 -41.65 15.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.409 0.624 . . . . 10.0 110.264 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.531 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 12.1 m-30 -68.3 -26.75 65.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.166 -0.924 . . . . 10.0 112.273 -178.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -51.02 -44.69 61.05 Favored 'General case' 0 C--N 1.33 -0.279 0 O-C-N 123.07 0.231 . . . . 10.0 111.468 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.62 -23.4 65.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.891 0.377 . . . . 10.0 111.265 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -89.38 -12.46 40.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.786 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 96.13 22.28 20.45 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.604 -0.808 . . . . 10.0 112.809 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.531 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 90.3 t -127.61 145.41 35.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.872 0.367 . . . . 10.0 110.052 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.2 m -139.44 117.92 12.14 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.996 0.427 . . . . 10.0 110.269 178.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.469 HG12 HG13 ' A' ' 128' ' ' VAL . 28.0 m -108.48 144.98 16.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.778 -0.647 . . . . 10.0 111.46 -179.536 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 48.5 m -155.47 142.46 19.12 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.885 -0.783 . . . . 10.0 108.885 178.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.516 ' HB ' HD23 ' A' ' 126' ' ' LEU . 2.6 p -104.44 117.39 49.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 16.6 m -132.52 118.93 19.87 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.252 -178.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.28 51.93 5.19 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 123.916 0.76 . . . . 10.0 112.402 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.508 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 78.3 m-20 60.44 33.89 20.59 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.059 -0.518 . . . . 10.0 111.594 179.159 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.62 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 64.2 tttt -143.69 129.28 19.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.789 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.562 HD12 ' HB2' ' A' ' 72' ' ' ALA . 36.7 mt -88.26 121.22 30.4 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.604 -0.888 . . . . 10.0 108.604 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 127' ' ' LEU . 2.3 mm? -103.39 116.54 32.6 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.667 -179.062 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.469 HG13 HG12 ' A' ' 119' ' ' VAL . 2.8 t -111.43 118.01 56.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 N-CA-C 108.64 -0.874 . . . . 10.0 108.64 178.66 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -143.39 148.43 44.03 Favored Pre-proline 0 C--N 1.322 -0.625 0 CA-C-O 120.686 0.279 . . . . 10.0 111.144 -178.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -79.06 143.58 18.04 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.552 2.168 . . . . 10.0 110.911 178.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.85 155.19 36.74 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.202 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.31 72.14 3.56 Favored 'Trans proline' 0 CA--C 1.531 0.367 0 C-N-CA 122.771 2.314 . . . . 10.0 112.387 -179.546 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 21.2 m -137.94 -179.1 2.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.485 -0.779 . . . . 10.0 109.613 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 48.8 m -148.38 100.96 3.2 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.959 0.409 . . . . 10.0 110.586 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.04 121.43 26.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.867 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 84.41 46.57 5.76 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.6 -0.81 . . . . 10.0 111.778 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.54 94.7 8.11 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.994 0.426 . . . . 10.0 110.422 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -77.21 138.7 39.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.559 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 31.1 mt . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.283 -0.865 . . . . 10.0 110.116 179.747 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.685 0 N-CA-C 111.981 -0.448 . . . . 10.0 111.981 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 m -90.13 -25.88 20.48 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.763 0.316 . . . . 10.0 110.848 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -155.91 167.71 29.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.203 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.7 ptt? -83.43 -2.01 54.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.398 -0.365 . . . . 10.0 111.212 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.79 100.49 5.49 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.908 0.385 . . . . 10.0 111.029 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.8 mmtt -98.9 154.98 37.11 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.245 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -71.94 70.29 2.92 Favored 'Trans proline' 0 C--O 1.236 0.394 0 C-N-CA 122.594 2.196 . . . . 10.0 112.186 179.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.28 151.46 21.34 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.056 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.87 -158.86 0.07 OUTLIER 'Trans proline' 0 CA--C 1.532 0.382 0 C-N-CA 122.481 2.12 . . . . 10.0 112.413 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -75.25 -173.13 1.93 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.763 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -58.42 -41.57 85.29 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.99 0.424 . . . . 10.0 110.458 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -120.78 166.53 13.9 Favored Glycine 0 N--CA 1.442 -0.922 0 N-CA-C 111.123 -0.791 . . . . 10.0 111.123 179.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 76.39 75.23 0.89 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.624 -0.798 . . . . 10.0 111.358 -179.338 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -84.46 -170.84 3.3 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.487 0.184 . . . . 10.0 110.987 -179.275 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 77.0 m95 64.51 39.42 6.82 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.394 0.616 . . . . 10.0 110.081 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -127.94 29.28 5.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.451 -0.795 . . . . 10.0 109.963 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 20.3 t-80 -85.43 89.7 7.76 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.191 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.58 99.37 4.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.683 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.2 p-10 -150.56 8.25 0.59 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.998 -0.547 . . . . 10.0 110.636 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 69.7 t60 -74.48 99.79 3.67 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.081 0.467 . . . . 10.0 110.19 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -92.62 136.01 33.6 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.639 -0.709 . . . . 10.0 110.664 -179.522 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -117.6 -12.76 10.29 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.623 0.725 . . . . 10.0 109.176 178.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -64.11 143.93 57.5 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 114.688 -1.142 . . . . 10.0 110.689 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -157.08 150.97 19.4 Favored Pre-proline 0 C--N 1.313 -1.018 0 CA-C-N 115.415 -0.811 . . . . 10.0 110.161 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.32 96.65 0.11 Allowed 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 122.574 2.183 . . . . 10.0 111.731 179.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 7.4 m -93.92 84.93 4.63 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.286 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -107.93 90.7 3.38 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.212 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 32.2 pt -104.38 140.04 20.68 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.166 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -62.17 110.4 1.02 Allowed 'Trans proline' 0 N--CA 1.464 -0.243 0 C-N-CA 122.504 2.136 . . . . 10.0 111.38 179.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mt -120.74 59.5 0.92 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.048 -0.524 . . . . 10.0 111.078 -179.377 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -67.52 116.53 8.36 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.498 -0.556 . . . . 10.0 109.498 179.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.11 111.64 1.4 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.482 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.4 m -132.23 97.91 4.26 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.168 0.508 . . . . 10.0 110.869 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -75.58 114.41 14.12 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.207 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 13.9 m -69.0 114.96 7.76 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.343 0.592 . . . . 10.0 110.256 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.501 ' O ' ' HA ' ' A' ' 97' ' ' SER . 52.0 m-85 -79.59 115.49 19.24 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.526 -0.761 . . . . 10.0 110.865 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -150.69 148.94 29.19 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.73 179.064 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.34 119.3 24.92 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.258 -0.645 . . . . 10.0 109.258 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.8 p -104.32 153.5 38.99 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.833 -179.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -64.42 -13.11 36.56 Favored 'Trans proline' 0 N--CA 1.465 -0.149 0 C-N-CA 122.67 2.246 . . . . 10.0 111.701 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 24.7 mmt -79.35 -21.96 45.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.313 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -75.31 -51.56 12.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.386 -0.598 . . . . 10.0 109.386 179.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.94 -65.25 2.95 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.918 -0.658 . . . . 10.0 112.846 178.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.473 HG22 HG23 ' A' ' 88' ' ' THR . 30.0 p -117.22 169.73 9.23 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.018 0.437 . . . . 10.0 111.666 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.403 HD13 ' CE2' ' A' ' 112' ' ' TYR . 60.4 tp -62.85 -38.87 92.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.453 -0.794 . . . . 10.0 110.821 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -61.42 -52.17 65.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.474 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.24 -35.47 81.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.273 -0.422 . . . . 10.0 111.546 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.0 tmm? -68.06 -50.62 54.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.849 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 88.2 mt -63.23 -35.85 81.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.842 0.353 . . . . 10.0 110.229 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -61.53 -38.13 86.28 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 178.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.433 HH11 ' HD3' ' A' ' 70' ' ' ARG . 3.8 tpp180 -68.17 -46.27 71.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.037 179.129 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 32.5 m0 -57.33 -50.94 71.33 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.827 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.52 -41.77 83.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.892 -0.594 . . . . 10.0 111.858 -179.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.83 -41.03 96.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.82 0.343 . . . . 10.0 111.668 -179.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -68.75 -34.07 74.96 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.316 -0.402 . . . . 10.0 111.266 -179.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.9 m -94.01 2.9 55.98 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.316 -0.402 . . . . 10.0 111.802 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 67.2 t30 57.74 55.26 5.61 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.366 0.603 . . . . 10.0 110.4 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 19.5 mtm -129.59 173.13 10.89 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.034 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -98.72 155.12 17.49 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.553 -0.294 . . . . 10.0 110.264 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.0 tp -132.2 135.57 46.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.919 0.39 . . . . 10.0 110.997 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.608 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 1.1 m -122.74 96.78 5.16 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.523 179.183 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.514 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 27.7 t80 -88.16 98.88 11.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.745 -0.662 . . . . 10.0 109.534 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -107.72 33.45 4.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.779 0.323 . . . . 10.0 111.463 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.449 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 39.4 mt -88.06 150.28 47.13 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 110.322 -0.251 . . . . 10.0 110.322 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -63.14 -29.56 74.4 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.577 2.185 . . . . 10.0 112.262 179.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.1 m -152.36 166.28 32.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.412 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.514 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 0.6 OUTLIER -87.97 140.44 29.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.507 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -120.98 144.94 48.24 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.935 0.398 . . . . 10.0 111.231 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.473 HG23 HG22 ' A' ' 63' ' ' THR . 0.2 OUTLIER -84.73 161.13 20.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.242 179.766 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -57.09 117.81 4.39 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.138 0.495 . . . . 10.0 110.573 179.125 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.6 pt -61.68 -35.97 70.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.407 -0.815 . . . . 10.0 112.162 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 137.87 -69.01 0.5 Allowed Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.633 -0.794 . . . . 10.0 112.285 -179.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.27 -13.12 36.25 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.718 2.278 . . . . 10.0 112.389 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.36 -32.46 53.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.631 0.729 . . . . 10.0 110.196 178.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.68 -10.58 59.84 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.834 -1.075 . . . . 10.0 111.261 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -92.32 -1.19 57.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.059 0.456 . . . . 10.0 110.715 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 56.9 mt -98.24 113.36 32.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.567 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.501 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 1.6 m -140.66 96.72 3.07 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.753 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.7 t -127.02 155.72 42.78 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.698 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.46 -5.05 52.71 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.356 -0.383 . . . . 10.0 111.972 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 62.3 m -100.27 119.38 38.31 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.906 -0.405 . . . . 10.0 109.906 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.4 HG22 ' HE2' ' A' ' 55' ' ' TYR . 0.8 OUTLIER -56.72 -49.29 78.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.136 -0.484 . . . . 10.0 111.913 -178.979 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -62.07 -33.52 74.56 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.776 -0.647 . . . . 10.0 111.403 -178.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -73.36 -39.76 64.91 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.96 -48.74 79.08 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.216 179.316 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.11 -43.53 98.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.575 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 84.6 m -62.6 -44.75 95.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.963 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -66.15 -39.55 89.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.707 179.667 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.444 HD23 ' HA ' ' A' ' 108' ' ' LEU . 15.2 mt -61.06 -53.59 55.25 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.954 -0.387 . . . . 10.0 109.954 178.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.7 m -57.6 -31.78 66.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.589 -179.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.98 -39.12 91.1 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.192 0.52 . . . . 10.0 110.789 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 6.4 t -90.61 -29.86 4.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.833 -0.622 . . . . 10.0 111.553 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.405 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.1 m-85 -82.17 -24.04 35.2 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.465 1.283 . . . . 10.0 114.465 -177.683 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.76 -38.42 33.81 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.291 0.478 . . . . 10.0 112.291 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.97 -18.93 65.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.058 0.456 . . . . 10.0 111.717 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -97.71 -4.2 37.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.978 0.418 . . . . 10.0 110.209 179.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.4 ' HA2' HG23 ' A' ' 131' ' ' VAL . . . 84.91 27.4 34.51 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.956 -0.64 . . . . 10.0 112.272 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.405 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 67.6 t -124.61 136.06 61.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 120.814 0.34 . . . . 10.0 110.642 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 29.4 m -140.39 123.18 16.38 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.935 0.397 . . . . 10.0 110.091 179.053 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 5.4 m -111.61 147.88 15.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.873 -179.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 19.1 m -150.65 155.93 40.35 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.133 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.472 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.4 t -112.17 115.75 50.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.126 -0.694 . . . . 10.0 109.126 179.629 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 14.5 m -136.55 117.92 14.67 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.146 -178.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 63.92 51.49 2.31 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.671 -0.695 . . . . 10.0 111.929 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 54.91 35.04 23.52 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.531 0.681 . . . . 10.0 110.813 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.608 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 75.6 tttt -140.54 133.37 29.05 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.485 -0.779 . . . . 10.0 109.827 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.472 ' CD2' HG22 ' A' ' 121' ' ' VAL . 94.0 mt -88.65 121.5 31.09 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 109.039 -0.726 . . . . 10.0 109.039 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.535 HD22 ' HB2' ' A' ' 80' ' ' SER . 13.2 mt -112.86 125.96 54.93 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.199 0.523 . . . . 10.0 110.809 -178.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 2.6 t -108.3 118.73 56.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 N-CA-C 108.222 -1.029 . . . . 10.0 108.222 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -127.98 138.09 32.19 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-O 120.841 0.353 . . . . 10.0 111.365 -178.296 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -81.62 133.24 8.15 Favored 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.133 1.888 . . . . 10.0 110.898 177.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.4 HG23 ' HA2' ' A' ' 116' ' ' GLY . 1.6 m -99.05 143.93 27.28 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.691 -179.657 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -79.65 71.19 7.17 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.803 2.335 . . . . 10.0 112.419 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 31.5 m -120.79 166.62 15.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 1.5 m -87.77 78.42 8.41 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.278 0.561 . . . . 10.0 110.382 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 2.9 m -77.55 -29.14 52.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.076 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -154.39 -139.71 2.88 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.716 -0.674 . . . . 10.0 111.439 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -96.31 -30.92 13.16 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.948 0.404 . . . . 10.0 110.416 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 8.7 tptp -121.45 177.36 5.23 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.045 -0.525 . . . . 10.0 109.703 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.6 -0.715 . . . . 10.0 110.088 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.598 0 N-CA-C 111.87 -0.492 . . . . 10.0 111.87 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -69.47 107.24 3.27 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.022 0.439 . . . . 10.0 110.677 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 -89.93 102.4 15.11 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.932 -179.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 43.7 mtt -138.86 143.74 38.91 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.944 -0.571 . . . . 10.0 109.654 179.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.23 -26.16 39.24 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.106 -179.539 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp 56.63 77.26 0.43 Allowed Pre-proline 0 C--O 1.234 0.249 0 CA-C-N 115.767 -0.652 . . . . 10.0 110.73 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.43 160.18 42.16 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.451 2.101 . . . . 10.0 112.206 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -118.06 148.65 43.99 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.942 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -64.08 139.26 66.11 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 122.482 2.121 . . . . 10.0 111.669 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -86.93 163.91 16.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.721 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -155.85 112.64 3.18 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.426 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -156.89 -143.35 3.64 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.724 -0.55 . . . . 10.0 111.724 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -78.95 65.65 3.51 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 121.037 -0.601 . . . . 10.0 112.804 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -88.2 -33.7 18.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.194 0.521 . . . . 10.0 110.176 179.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 48.2 m95 -92.06 -59.15 2.18 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.883 -0.598 . . . . 10.0 109.987 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.9 mttm 57.78 39.93 26.64 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.721 -0.672 . . . . 10.0 111.633 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 8.5 t60 -81.73 102.55 10.82 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.881 -0.414 . . . . 10.0 109.881 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -139.87 98.85 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.206 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -148.67 92.3 1.98 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.275 0.559 . . . . 10.0 110.515 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.7 m80 -101.86 131.74 48.04 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.124 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -88.78 -65.22 1.04 Allowed 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.368 -0.604 . . . . 10.0 109.368 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -155.65 164.86 38.06 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.347 -0.842 . . . . 10.0 109.237 178.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -127.76 72.13 1.39 Allowed 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.465 0.65 . . . . 10.0 110.93 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 44' ' ' PRO . . . -155.58 121.17 2.57 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.056 -0.975 . . . . 10.0 109.824 179.22 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 43' ' ' ALA . 38.1 Cg_exo -59.93 -66.23 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.847 2.365 . . . . 10.0 112.382 -179.246 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.6 m -142.31 97.67 3.17 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.333 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -132.65 80.77 1.91 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.226 0.536 . . . . 10.0 110.186 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 pt -120.45 107.81 38.47 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.524 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -75.39 58.15 5.04 Favored 'Trans proline' 0 N--CA 1.464 -0.243 0 C-N-CA 123.008 2.472 . . . . 10.0 111.969 179.299 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.5 tp -132.86 124.97 28.93 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.195 -179.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -104.41 150.07 24.85 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.624 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.58 109.15 0.65 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.837 0.351 . . . . 10.0 111.417 -179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 4.6 m -127.82 96.25 4.45 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.182 0.515 . . . . 10.0 110.145 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -66.91 127.1 31.23 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.129 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.4 m -82.92 113.1 20.29 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.577 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.436 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 95.1 m-85 -83.29 107.54 15.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.525 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -147.6 174.07 12.11 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.818 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.52 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -100.91 127.55 47.33 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.381 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.6 p -109.71 153.9 42.74 Favored Pre-proline 0 C--N 1.323 -0.587 0 N-CA-C 109.872 -0.418 . . . . 10.0 109.872 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -66.85 -9.52 25.04 Favored 'Trans proline' 0 CA--C 1.529 0.264 0 C-N-CA 122.333 2.022 . . . . 10.0 111.626 179.178 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 61.8 mtm -84.6 -19.89 32.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.492 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -73.11 -57.9 3.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.151 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.407 ' O ' HD22 ' A' ' 89' ' ' LEU . . . 87.05 -57.82 4.59 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.838 -0.696 . . . . 10.0 113.167 179.18 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 65.5 p -119.24 164.54 15.47 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.485 0.55 . . . . 10.0 112.485 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.416 HD13 ' CE2' ' A' ' 112' ' ' TYR . 27.3 tp -61.35 -45.14 95.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.282 -0.872 . . . . 10.0 111.386 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.1 ttpt -59.17 -50.34 74.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.828 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.594 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 51.8 m -60.74 -43.45 97.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.948 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.402 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 57.0 ttp -60.72 -50.82 71.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.612 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.441 ' HB3' HD13 ' A' ' 79' ' ' LEU . 83.2 mt -63.55 -35.23 79.81 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.875 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -60.87 -43.37 98.51 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.624 -0.51 . . . . 10.0 109.624 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.594 ' HG2' ' O ' ' A' ' 66' ' ' THR . 31.6 mmt180 -64.93 -46.06 83.2 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.643 -0.708 . . . . 10.0 109.643 178.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 38.9 m0 -55.23 -50.54 69.15 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.469 -0.787 . . . . 10.0 110.793 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.428 ' HA ' ' HB2' ' A' ' 77' ' ' MET . . . -66.0 -52.14 52.04 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.338 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.93 -43.61 77.55 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.253 0.464 . . . . 10.0 112.253 -178.278 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -58.21 -35.83 72.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.909 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.1 m -105.38 18.75 21.75 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.24 0.459 . . . . 10.0 112.24 -178.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 65.4 t30 57.91 35.54 25.44 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.636 0.732 . . . . 10.0 111.209 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.428 ' HB2' ' HA ' ' A' ' 72' ' ' ALA . 72.6 mtp -103.19 173.88 6.11 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.839 -0.618 . . . . 10.0 110.035 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 70.7 mm-40 -114.02 157.91 21.88 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.819 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.441 HD13 ' HB3' ' A' ' 68' ' ' LEU . 43.6 tp -124.99 131.51 53.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.195 0.522 . . . . 10.0 110.958 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -115.59 96.37 5.6 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.562 -0.745 . . . . 10.0 109.251 178.644 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.548 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 6.6 t80 -91.45 98.57 11.77 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.097 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.458 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 42.2 m-80 -94.94 11.96 29.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.901 -179.443 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.507 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 45.2 mt -84.12 147.61 51.24 Favored Pre-proline 0 C--N 1.324 -0.523 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.29 -41.86 68.63 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.662 2.241 . . . . 10.0 112.634 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 2.1 m -147.11 170.49 17.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.096 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.548 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 7.0 p-10 -80.82 148.06 30.16 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -123.72 143.24 50.4 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.838 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.28 152.32 36.5 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.524 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.407 HD22 ' O ' ' A' ' 62' ' ' GLY . 0.1 OUTLIER -58.75 136.31 57.7 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.735 0.302 . . . . 10.0 110.245 178.986 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.5 pt -81.48 -27.62 10.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.534 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 138.37 -62.49 0.57 Allowed Glycine 0 CA--C 1.523 0.536 0 C-N-CA 120.217 -0.992 . . . . 10.0 113.282 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -58.61 -15.75 27.03 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 123.02 2.48 . . . . 10.0 113.098 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t -61.81 -36.64 74.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.922 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.52 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.1 m -71.66 -14.71 62.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.87 -0.604 . . . . 10.0 111.723 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -88.3 -1.31 57.95 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.052 0.453 . . . . 10.0 110.523 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.437 HD13 HD12 ' A' ' 108' ' ' LEU . 56.9 mt -101.65 111.77 32.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.771 -0.649 . . . . 10.0 109.371 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.0 m -139.99 97.16 3.19 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.112 0.482 . . . . 10.0 110.564 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.1 t -130.76 157.67 42.2 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.692 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.42 -18.29 30.31 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.462 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.03 113.31 25.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.619 -0.718 . . . . 10.0 110.275 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.436 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 9.8 p -61.14 -31.68 50.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.565 0.221 . . . . 10.0 111.269 -179.774 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -65.93 -41.1 91.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.945 0.402 . . . . 10.0 110.028 179.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -66.99 -41.96 85.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.923 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.05 -50.37 72.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.61 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.23 -36.44 79.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.582 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 63.0 m -64.18 -45.76 86.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.852 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -69.78 -39.19 76.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.862 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.437 HD12 HD13 ' A' ' 96' ' ' ILE . 1.7 mp -63.34 -50.29 70.57 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.839 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 11.2 p -62.73 -21.72 66.01 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.696 0.258 . . . . 10.0 111.696 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.51 -48.03 51.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.891 0.376 . . . . 10.0 110.893 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.61 HG13 ' HD1' ' A' ' 112' ' ' TYR . 4.8 p -82.55 -28.48 8.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-O 121.421 0.629 . . . . 10.0 111.186 -179.426 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.61 ' HD1' HG13 ' A' ' 111' ' ' VAL . 3.1 m-85 -81.28 -22.86 38.33 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.658 -0.701 . . . . 10.0 112.798 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.65 -42.64 45.77 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 112.342 0.497 . . . . 10.0 112.342 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.96 -20.01 63.33 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.876 0.37 . . . . 10.0 111.377 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -87.81 -13.31 42.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.187 0.518 . . . . 10.0 109.955 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 130' ' ' PRO . . . 95.61 24.93 14.5 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 115.717 -0.674 . . . . 10.0 112.48 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.459 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 96.5 t -128.27 130.9 69.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.052 0.453 . . . . 10.0 111.378 -179.184 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.6 m -127.54 111.61 13.98 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.236 -0.438 . . . . 10.0 109.979 178.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.433 HG21 ' HB3' ' A' ' 108' ' ' LEU . 3.3 m -102.57 142.39 16.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.077 0.465 . . . . 10.0 111.088 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 15.3 m -150.38 165.53 32.82 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.813 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.532 HG22 HD23 ' A' ' 126' ' ' LEU . 3.4 t -119.64 117.31 53.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 13.8 m -134.6 118.71 17.53 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.639 -0.255 . . . . 10.0 110.659 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 65.05 43.75 3.63 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 123.732 0.645 . . . . 10.0 111.147 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 4.6 t30 59.37 29.67 19.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.116 -0.947 . . . . 10.0 110.619 -179.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -129.77 133.78 47.2 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.29 -0.868 . . . . 10.0 109.056 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.532 HD23 HG22 ' A' ' 121' ' ' VAL . 96.0 mt -87.97 122.01 31.06 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.727 -0.842 . . . . 10.0 108.727 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -113.3 116.0 29.04 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-O 121.207 0.527 . . . . 10.0 111.322 -178.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.458 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 3.2 t -99.33 117.63 44.73 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.077 0 N-CA-C 107.869 -1.159 . . . . 10.0 107.869 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -128.28 131.56 23.85 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-O 120.983 0.42 . . . . 10.0 111.096 -178.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' PRO . . . . . 0.406 ' HA ' ' O ' ' A' ' 116' ' ' GLY . 59.3 Cg_endo -73.77 136.97 24.0 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.365 2.043 . . . . 10.0 110.78 178.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -107.06 142.45 25.05 Favored Pre-proline 0 C--N 1.316 -0.879 0 C-N-CA 120.827 -0.349 . . . . 10.0 110.202 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -81.34 76.9 4.19 Favored 'Trans proline' 0 N--CA 1.453 -0.878 0 C-N-CA 122.66 2.24 . . . . 10.0 111.256 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 4.4 m -102.52 22.73 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.276 -0.875 . . . . 10.0 111.108 -178.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 19.3 m -116.85 105.74 12.69 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.241 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.4 m -79.76 72.0 6.44 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.748 -0.66 . . . . 10.0 111.061 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 133.97 -138.95 10.47 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.92 -0.657 . . . . 10.0 111.604 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -94.34 169.06 10.49 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.634 0.255 . . . . 10.0 110.425 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 48.0 pttt -75.8 157.75 33.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.553 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 38.2 tp . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.35 -0.833 . . . . 10.0 109.28 179.08 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.807 0 N-CA-C 112.04 -0.424 . . . . 10.0 112.04 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.9 m -84.21 111.98 19.86 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.999 0.428 . . . . 10.0 111.1 -179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 3.5 m170 -101.78 119.14 38.31 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.284 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -62.85 125.69 24.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.554 -179.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.2 t -85.13 134.33 34.18 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.121 0.486 . . . . 10.0 110.117 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -118.16 149.1 45.05 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.711 -179.137 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -75.74 61.93 6.34 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.735 2.29 . . . . 10.0 112.09 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.26 148.12 34.13 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.32 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.37 145.43 65.41 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.52 2.147 . . . . 10.0 111.615 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -87.7 59.09 5.24 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.085 0.469 . . . . 10.0 111.079 -179.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.401 ' HB3' ' HB2' ' A' ' 33' ' ' ARG . 51.6 m-85 61.12 49.37 5.64 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.429 179.346 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -65.51 114.77 6.96 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.848 -0.615 . . . . 10.0 113.023 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 90.98 9.19 64.11 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.962 -0.637 . . . . 10.0 112.494 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.401 ' HB2' ' HB3' ' A' ' 30' ' ' PHE . 50.8 mtp180 -106.56 -2.57 21.73 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 122.655 -0.32 . . . . 10.0 111.141 -179.564 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 59.6 m95 -106.33 11.51 30.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.251 0.548 . . . . 10.0 110.922 -179.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -97.79 25.18 6.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.747 -0.66 . . . . 10.0 110.289 179.286 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -78.25 87.87 4.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.608 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 7.0 m -138.27 144.25 30.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.487 179.167 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -146.56 135.01 21.97 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 110.169 -0.308 . . . . 10.0 110.169 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -127.09 28.09 5.82 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.971 0.415 . . . . 10.0 110.792 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -105.38 60.08 0.67 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.006 0.431 . . . . 10.0 110.328 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -60.7 142.57 55.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.606 -0.724 . . . . 10.0 111.221 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -108.32 153.64 22.96 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.851 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -95.8 138.78 21.7 Favored Pre-proline 0 C--N 1.317 -0.824 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.598 179.236 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -49.97 -52.66 8.46 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.689 2.259 . . . . 10.0 111.87 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.1 m -149.16 94.66 2.27 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.203 179.144 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -72.38 130.3 40.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.148 0.499 . . . . 10.0 110.625 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 11.5 pt -140.6 147.81 50.57 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 115.55 -0.75 . . . . 10.0 110.059 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -68.18 166.18 25.98 Favored 'Trans proline' 0 C--O 1.236 0.424 0 C-N-CA 122.313 2.009 . . . . 10.0 111.16 179.167 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 25.0 tp -87.74 65.03 8.26 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.375 0.607 . . . . 10.0 109.918 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -76.74 119.67 20.85 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.423 -0.808 . . . . 10.0 108.943 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.74 110.02 0.53 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.14 0.495 . . . . 10.0 111.58 -179.16 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.7 m -142.27 90.97 2.29 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.84 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -64.6 126.4 27.76 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.142 0.496 . . . . 10.0 111.074 -179.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.2 m -86.96 122.87 31.41 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.78 -0.646 . . . . 10.0 110.395 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -89.5 119.84 30.29 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.468 ' HG3' ' OG ' ' A' ' 97' ' ' SER . 1.9 tt0 -152.58 144.56 23.74 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.671 -178.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.51 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -78.16 128.05 33.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.002 178.742 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.462 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 82.5 p -113.71 159.64 34.92 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 116.571 -0.286 . . . . 10.0 110.576 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.462 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 47.1 Cg_endo -69.53 -3.31 11.61 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.459 2.106 . . . . 10.0 112.122 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 45.2 mtt -88.24 -25.14 23.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.362 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -72.22 -58.61 3.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.054 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 86.95 -57.21 4.63 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.77 -0.729 . . . . 10.0 112.895 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.649 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 65.3 p -121.52 172.57 7.98 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.426 0.528 . . . . 10.0 112.426 -179.366 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 25.7 tp -64.19 -48.62 75.22 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.114 -0.948 . . . . 10.0 111.752 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -58.79 -43.99 90.62 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.012 0.434 . . . . 10.0 110.472 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.8 m -66.51 -39.78 88.84 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.485 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 54.7 ttp -66.87 -50.14 63.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.044 0.45 . . . . 10.0 111.055 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 75.1 mt -62.17 -37.71 86.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.276 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -60.49 -41.34 94.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.284 179.07 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -65.78 -47.63 74.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.285 179.139 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 43.5 m0 -58.19 -51.94 67.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.574 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.69 -42.48 99.65 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.784 -0.643 . . . . 10.0 111.515 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.4 -44.77 95.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.727 0.298 . . . . 10.0 111.755 -179.325 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.15 -40.27 95.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.372 -0.376 . . . . 10.0 111.417 -179.035 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.9 m -94.0 6.96 46.83 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.897 -178.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 46.9 t30 55.85 49.25 16.43 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.239 0.542 . . . . 10.0 111.272 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.452 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 10.8 mtm -114.68 174.0 6.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.756 -179.621 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 26.6 mp0 -102.15 163.1 12.42 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.68 -179.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 45.9 tp -130.88 138.82 49.99 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.179 0.514 . . . . 10.0 111.134 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -124.54 96.23 4.82 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.432 -0.804 . . . . 10.0 109.142 178.487 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.496 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 4.7 t80 -92.31 98.34 11.44 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.427 -0.583 . . . . 10.0 109.427 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 73.9 m-20 -96.89 24.03 6.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.122 0.487 . . . . 10.0 110.589 -179.316 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.496 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 44.4 mt -93.51 142.48 25.24 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.425 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.84 -29.84 58.59 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.898 2.399 . . . . 10.0 112.327 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.2 m -147.46 153.26 39.34 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.587 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.495 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 34.3 t0 -80.68 125.12 29.64 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -100.47 149.8 23.31 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.643 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.649 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 2.0 t -92.84 151.95 19.7 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.7 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -50.59 121.67 6.11 Favored 'General case' 0 C--N 1.337 0.042 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.868 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.0 pt -67.01 -29.57 46.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.562 . . . . 10.0 111.935 -179.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 141.72 -68.45 0.46 Allowed Glycine 0 CA--C 1.52 0.344 0 C-N-CA 120.375 -0.916 . . . . 10.0 113.2 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.17 -7.28 3.58 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.639 2.893 . . . . 10.0 113.868 -179.033 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.465 ' HA ' HD12 ' A' ' 96' ' ' ILE . 5.8 t -68.07 -32.79 57.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.239 0.542 . . . . 10.0 110.452 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.51 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.5 m -72.62 -13.73 61.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.938 -0.573 . . . . 10.0 111.436 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -89.5 -0.1 57.26 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.044 0.449 . . . . 10.0 110.562 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.526 HD13 HD12 ' A' ' 108' ' ' LEU . 51.6 mt -97.95 111.0 26.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.584 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.468 ' OG ' ' HG3' ' A' ' 56' ' ' GLN . 2.8 m -134.08 98.78 4.23 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.697 -179.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 12.8 t -129.76 155.69 45.52 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.442 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -90.24 -9.47 47.89 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.798 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.4 t -104.29 123.76 47.95 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.662 0.267 . . . . 10.0 110.908 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.407 HG13 HG11 ' A' ' 121' ' ' VAL . 13.1 p -65.99 -29.7 47.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-O 121.123 0.487 . . . . 10.0 110.104 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -69.93 -41.45 74.58 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.733 179.433 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -68.7 -39.43 80.5 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.83 -48.8 77.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.658 179.059 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.46 -35.38 80.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.324 0.583 . . . . 10.0 110.473 179.401 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 92.8 m -67.34 -47.5 70.28 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.46 -0.791 . . . . 10.0 110.802 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -69.6 -40.89 76.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.881 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LEU . . . . . 0.526 HD12 HD13 ' A' ' 96' ' ' ILE . 2.5 mp -59.04 -48.28 82.17 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.773 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 59.2 m -59.55 -31.91 69.86 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 111.86 0.318 . . . . 10.0 111.86 -179.566 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.4 -37.42 83.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.375 0.607 . . . . 10.0 110.833 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 2.7 t -87.47 -42.74 15.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.521 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.48 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 13.2 m-30 -64.83 -26.63 68.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.166 -0.925 . . . . 10.0 112.504 -178.467 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -55.37 -31.42 61.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.774 0.321 . . . . 10.0 111.389 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.74 -11.54 59.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.91 0.386 . . . . 10.0 111.198 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 -109.96 -0.28 18.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.566 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 82.36 28.13 41.26 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.95 -0.643 . . . . 10.0 112.855 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.48 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 74.1 t -127.54 143.86 39.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.952 0.406 . . . . 10.0 110.338 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.9 m -142.47 138.83 31.28 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 178.722 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 9.9 m -126.32 143.24 40.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.407 0.623 . . . . 10.0 111.782 -178.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.2 m -150.84 139.85 21.02 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.429 178.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.407 HG11 HG13 ' A' ' 101' ' ' VAL . 2.3 p -102.48 121.0 53.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.3 m -139.91 124.51 18.2 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.767 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.4 48.62 7.63 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 123.537 0.523 . . . . 10.0 111.476 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.452 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 23.6 m120 57.69 33.01 22.7 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.783 -0.644 . . . . 10.0 111.498 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -137.19 129.9 30.24 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.6 -0.519 . . . . 10.0 109.6 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 37.3 mt -87.54 120.73 29.14 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 107.8 -1.185 . . . . 10.0 107.8 178.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.71 118.97 37.93 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.103 0.478 . . . . 10.0 111.591 -178.304 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.405 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 3.0 t -104.44 118.36 51.57 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.957 0 N-CA-C 108.187 -1.042 . . . . 10.0 108.187 178.369 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -131.01 131.25 23.09 Favored Pre-proline 0 C--N 1.317 -0.827 0 CA-C-O 120.741 0.305 . . . . 10.0 110.96 -178.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -72.14 134.38 23.03 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.467 2.111 . . . . 10.0 111.058 179.102 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.41 ' HA ' ' HD3' ' A' ' 132' ' ' PRO . 0.9 OUTLIER -97.71 144.7 28.45 Favored Pre-proline 0 C--N 1.315 -0.912 0 N-CA-C 109.892 -0.41 . . . . 10.0 109.892 179.368 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 132' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 131' ' ' VAL . 2.9 Cg_exo -73.1 85.75 1.18 Allowed 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.783 2.322 . . . . 10.0 111.651 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 16.5 m -128.26 125.81 64.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.82 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 65.7 m -159.13 55.0 0.41 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.599 0.714 . . . . 10.0 109.41 179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.5 m -76.18 119.22 19.79 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.227 -0.897 . . . . 10.0 110.564 -179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -113.55 28.87 8.26 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.663 -0.78 . . . . 10.0 112.657 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -86.31 -37.66 18.29 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.959 0.409 . . . . 10.0 110.531 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -132.08 98.58 4.46 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.898 179.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 2.6 mm? . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.254 -0.879 . . . . 10.0 110.138 -179.763 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.632 0 N-CA-C 111.63 -0.588 . . . . 10.0 111.63 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 14.7 m -76.43 71.64 3.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.186 0.517 . . . . 10.0 110.525 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 25.2 p80 -65.23 133.46 51.53 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.804 -0.634 . . . . 10.0 110.352 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 64.5 mtt -120.36 142.71 48.91 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.052 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -63.17 105.77 0.76 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.909 0.385 . . . . 10.0 111.361 -179.487 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -121.29 141.16 32.56 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.244 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -69.63 135.22 30.21 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.146 1.897 . . . . 10.0 111.416 179.414 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -71.35 154.62 93.53 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.63 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.72 149.72 57.73 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 122.55 2.167 . . . . 10.0 111.788 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.5 175.66 6.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.962 -179.242 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -164.08 150.06 11.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.006 -179.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 88.4 23.25 37.62 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.671 -0.776 . . . . 10.0 111.682 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -133.92 25.6 3.52 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 111.321 -0.712 . . . . 10.0 111.321 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 42.4 ttt180 -78.51 -33.15 48.24 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.938 0.399 . . . . 10.0 110.105 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 33.8 m95 -78.48 77.09 4.97 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.796 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -128.87 31.3 4.95 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.654 -0.703 . . . . 10.0 109.71 179.21 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 7.2 t-80 -72.4 97.34 2.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.905 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 15.8 m -125.49 -5.65 5.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.479 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -127.1 114.66 18.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.998 0.428 . . . . 10.0 110.62 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -74.48 -70.06 0.42 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.113 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -164.33 143.88 7.61 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.103 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -101.66 94.42 5.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.171 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -152.49 -171.21 3.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.326 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.87 149.7 42.4 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.407 -0.361 . . . . 10.0 110.588 179.357 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -57.12 -61.26 0.32 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.651 2.234 . . . . 10.0 111.879 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.7 m -150.9 79.66 1.32 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.13 0.491 . . . . 10.0 110.52 179.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -83.75 103.24 12.88 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.508 179.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 20.9 pt -133.73 139.58 34.0 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.813 -0.631 . . . . 10.0 110.434 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.77 136.92 43.71 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.508 2.139 . . . . 10.0 111.261 179.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.8 107.82 13.2 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.093 0.473 . . . . 10.0 109.896 -179.427 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -133.04 116.35 16.27 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.408 -0.815 . . . . 10.0 109.714 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.44 120.8 12.36 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.504 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 13.5 m -144.53 88.78 1.95 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.134 0.492 . . . . 10.0 110.537 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -80.27 121.45 25.65 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.45 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.6 m -73.92 115.6 13.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.077 0.465 . . . . 10.0 110.358 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.411 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 91.4 m-85 -84.19 105.27 14.92 Favored 'General case' 0 C--N 1.313 -1.022 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -141.05 147.27 38.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.314 -179.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.699 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -75.52 117.3 17.16 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.398 -0.593 . . . . 10.0 109.398 178.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 61.8 p -101.67 152.49 38.09 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 116.307 -0.406 . . . . 10.0 111.094 -178.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -64.98 -13.86 42.03 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.655 2.237 . . . . 10.0 112.416 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.5 ptp -86.78 -6.27 58.87 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.93 0.395 . . . . 10.0 110.447 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -84.14 -58.49 2.74 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 179.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 86.19 -60.24 4.6 Favored Glycine 0 N--CA 1.445 -0.754 0 CA-C-N 115.649 -0.705 . . . . 10.0 113.319 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 31.9 p -116.48 166.5 12.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.551 0.691 . . . . 10.0 112.705 -178.329 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.93 -46.25 82.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.368 -1.287 . . . . 10.0 111.392 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 29.9 ttmt -58.27 -56.7 18.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.922 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.1 m -56.49 -42.66 78.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.0 -0.546 . . . . 10.0 111.804 -179.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 50.2 ttp -59.77 -54.09 50.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.826 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.5 mt -64.81 -36.22 83.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.16 -0.473 . . . . 10.0 111.109 -179.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -60.18 -45.34 93.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.775 0.321 . . . . 10.0 110.323 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -66.3 -38.87 88.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.634 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 39.2 m0 -62.57 -53.74 50.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.325 0.583 . . . . 10.0 109.938 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.439 ' HB2' HD23 ' A' ' 126' ' ' LEU . . . -61.36 -39.88 92.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.225 -0.898 . . . . 10.0 111.637 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.69 -39.86 81.94 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.295 0.48 . . . . 10.0 112.295 -179.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -66.11 -36.16 82.43 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.87 0.322 . . . . 10.0 111.87 -178.792 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.423 ' HB2' ' SD ' ' A' ' 77' ' ' MET . 19.7 m -103.01 13.48 34.2 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 111.807 0.299 . . . . 10.0 111.807 -179.007 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 54.67 43.33 30.33 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.414 0.626 . . . . 10.0 111.29 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.459 ' HE1' HD11 ' A' ' 126' ' ' LEU . 64.2 mtp -102.97 160.49 14.57 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.205 -179.647 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -97.41 154.29 17.56 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.261 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 36.7 tp -122.01 133.89 54.81 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.483 0.659 . . . . 10.0 111.438 -179.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.451 ' HB2' HD13 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -114.76 95.39 5.21 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.145 -0.934 . . . . 10.0 109.03 179.04 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.504 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 9.8 t80 -99.94 95.79 7.12 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.987 0.422 . . . . 10.0 109.993 -179.427 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 20.8 m-20 -98.83 10.7 40.73 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.752 -179.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.504 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 40.4 mt -71.0 142.55 87.81 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.13 179.495 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.36 -39.23 92.63 Favored 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.842 2.361 . . . . 10.0 112.349 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 37.9 m -148.07 171.92 15.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.675 0.274 . . . . 10.0 110.585 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -82.32 135.57 35.18 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -113.17 128.62 56.53 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.999 -0.281 . . . . 10.0 110.279 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.0 OUTLIER -70.51 148.26 48.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.243 179.614 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.36 109.18 0.72 Allowed 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.407 HG12 ' H ' ' A' ' 90' ' ' ILE . 8.4 pt -55.94 -37.05 46.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.417 -0.81 . . . . 10.0 112.503 -178.796 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 151.95 -70.62 0.3 Allowed Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.193 -1.003 . . . . 10.0 112.995 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -55.31 -16.88 14.36 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.544 2.829 . . . . 10.0 113.422 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.488 HG12 ' HB2' ' A' ' 57' ' ' ALA . 21.4 t -59.94 -35.57 61.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.905 179.575 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.699 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.7 OUTLIER -71.4 -8.71 55.55 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.25 0.463 . . . . 10.0 112.25 -179.106 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.15 -1.98 57.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.885 0.374 . . . . 10.0 111.208 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 36.9 mt -93.78 107.05 18.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 109.695 -0.483 . . . . 10.0 109.695 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -133.97 91.54 2.83 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.141 0.496 . . . . 10.0 111.792 -179.257 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.6 t -130.33 155.2 46.73 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.117 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.3 p -87.33 -18.26 30.52 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 121.003 0.43 . . . . 10.0 110.522 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.5 m -88.72 108.53 19.53 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.648 179.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.411 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 11.3 p -57.36 -33.52 43.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.632 -178.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -67.72 -39.7 84.31 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -66.61 -42.89 86.13 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.29 -50.6 66.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.344 -0.844 . . . . 10.0 110.338 178.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.45 -35.94 79.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.996 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 48.0 m -64.53 -45.11 88.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.578 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -72.07 -38.07 69.49 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.597 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 62.8 mt -60.14 -50.72 72.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.666 179.318 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 72.2 m -58.34 -28.87 65.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.305 -0.407 . . . . 10.0 112.054 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.42 -37.24 82.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.19 0.519 . . . . 10.0 110.545 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 11.0 t -86.06 -41.01 14.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 121.424 0.63 . . . . 10.0 110.324 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.528 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 14.2 m-30 -66.56 -26.88 67.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.857 -1.065 . . . . 10.0 113.11 -178.371 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.91 -31.21 64.67 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.787 0.292 . . . . 10.0 111.787 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.22 -14.5 60.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.853 0.359 . . . . 10.0 111.232 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -107.83 -10.65 15.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.242 -0.436 . . . . 10.0 111.088 -179.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 95.2 31.79 7.41 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.645 -0.788 . . . . 10.0 113.155 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.528 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 69.1 t -131.1 142.43 43.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.871 0.367 . . . . 10.0 110.993 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.409 ' HB2' HG13 ' A' ' 131' ' ' VAL . 0.5 OUTLIER -135.46 138.02 42.77 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 178.517 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' ' 127' ' ' LEU . 14.4 m -130.99 143.72 40.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.143 0.496 . . . . 10.0 111.157 -179.429 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 19.9 m -152.64 153.38 33.21 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.865 179.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.441 HG22 ' CD1' ' A' ' 126' ' ' LEU . 5.7 t -106.1 118.16 53.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 68.7 m -140.43 118.46 11.89 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.561 -0.291 . . . . 10.0 111.05 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.88 51.06 4.86 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.607 -0.724 . . . . 10.0 112.021 179.382 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.7 t30 58.49 28.08 16.44 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.262 179.069 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -136.2 135.68 39.32 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.321 -0.4 . . . . 10.0 110.301 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.459 HD11 ' HE1' ' A' ' 77' ' ' MET . 2.5 mm? -88.84 121.71 31.48 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.916 -0.772 . . . . 10.0 108.916 178.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.451 HD13 ' HB2' ' A' ' 80' ' ' SER . 4.6 mm? -102.19 115.74 31.19 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.946 0.403 . . . . 10.0 110.412 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 2.7 t -112.02 118.38 57.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 N-CA-C 108.501 -0.926 . . . . 10.0 108.501 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -136.2 144.68 48.98 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-O 120.814 0.34 . . . . 10.0 111.114 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -75.8 141.63 24.63 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.254 1.969 . . . . 10.0 111.213 178.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.409 HG13 ' HB2' ' A' ' 118' ' ' SER . 7.6 m -113.8 144.47 31.53 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.504 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.36 93.58 1.08 Allowed 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.83 2.353 . . . . 10.0 112.161 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 4.2 m -133.04 170.94 19.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.553 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 2.6 p -160.22 134.78 7.56 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.198 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.3 m -115.15 21.14 14.45 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.3 0.572 . . . . 10.0 110.041 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 114.63 155.11 11.03 Favored Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 115.493 -0.776 . . . . 10.0 111.415 -179.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -111.8 127.75 55.9 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.77 0.319 . . . . 10.0 110.455 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mttp -87.25 71.31 10.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.062 0.458 . . . . 10.0 110.664 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 29.5 mt . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.511 -0.757 . . . . 10.0 110.254 -179.606 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.516 0 N-CA-C 111.684 -0.566 . . . . 10.0 111.684 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.62 -32.48 73.23 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.991 0.424 . . . . 10.0 110.824 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -160.12 96.95 1.23 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.226 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 59.9 mtt -126.92 72.5 1.36 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.25 0.548 . . . . 10.0 110.474 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.438 ' O ' ' HD3' ' A' ' 26' ' ' PRO . 0.7 OUTLIER -90.11 169.35 11.24 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.674 179.924 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -92.18 107.62 24.53 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 179.377 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.438 ' HD3' ' O ' ' A' ' 24' ' ' THR . 71.6 Cg_endo -83.59 80.91 2.37 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.671 2.248 . . . . 10.0 112.362 -179.551 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.431 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . . . -101.47 133.27 20.96 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.893 179.774 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 28.7 Cg_exo -61.9 128.59 24.74 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.612 2.208 . . . . 10.0 111.341 179.146 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -70.11 156.92 38.51 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.135 0.493 . . . . 10.0 111.352 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -88.57 122.48 32.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.783 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 114.7 -1.61 23.23 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 111.46 -0.656 . . . . 10.0 111.46 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -79.79 100.02 1.81 Allowed Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 121.192 -0.528 . . . . 10.0 112.559 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 7.0 ttp180 -99.89 -167.51 1.47 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.232 -0.655 . . . . 10.0 109.232 179.195 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 56.2 m95 63.91 27.43 14.42 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.933 0.397 . . . . 10.0 110.952 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -81.89 -34.35 30.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.184 0.516 . . . . 10.0 109.989 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -90.73 91.64 8.47 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 178.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 m -136.19 108.74 8.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.184 0.516 . . . . 10.0 111.668 -179.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -152.35 98.82 2.44 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.804 -0.634 . . . . 10.0 110.134 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 5.8 t-160 -86.7 75.44 9.66 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.874 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 53.8 p90 -87.31 -27.61 22.76 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.589 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -91.34 87.94 6.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.34 0.591 . . . . 10.0 110.376 -179.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -114.97 -62.54 1.59 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.761 -0.654 . . . . 10.0 109.843 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -158.43 144.29 12.4 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.193 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -61.76 -42.15 33.75 Favored 'Trans proline' 0 CA--C 1.53 0.306 0 C-N-CA 122.382 2.055 . . . . 10.0 112.46 -179.234 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.453 HG22 HG12 ' A' ' 47' ' ' ILE . 8.7 m -154.18 87.82 1.21 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.151 0.501 . . . . 10.0 110.982 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -102.58 73.06 1.28 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.252 0.548 . . . . 10.0 110.712 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.453 HG12 HG22 ' A' ' 45' ' ' THR . 16.8 pt -140.6 147.02 47.31 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.872 -0.604 . . . . 10.0 109.848 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.34 84.43 1.37 Allowed 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.269 1.98 . . . . 10.0 111.758 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -101.65 100.1 10.45 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.489 -0.778 . . . . 10.0 109.876 -179.422 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -103.71 104.24 14.25 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.694 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.19 110.96 2.37 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.108 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -125.76 99.16 5.85 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.899 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -69.24 132.02 45.81 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.703 -0.681 . . . . 10.0 111.038 -179.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.6 m -95.46 120.87 36.46 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.593 -0.731 . . . . 10.0 110.642 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.498 ' CE2' HG22 ' A' ' 101' ' ' VAL . 36.7 m-85 -82.11 112.29 19.02 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.314 -0.624 . . . . 10.0 109.314 179.209 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -153.05 160.33 42.95 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.188 -179.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.582 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -76.23 137.63 40.09 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.736 -0.468 . . . . 10.0 109.736 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.433 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 40.0 p -121.9 163.19 32.86 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.426 -178.6 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.433 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 71.7 Cg_endo -79.64 10.39 3.1 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 121.443 1.429 . . . . 10.0 112.15 179.013 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 22.1 mmt -112.62 -12.77 13.38 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 113.518 0.933 . . . . 10.0 113.518 -178.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.47 -66.17 0.66 Allowed 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.336 -0.546 . . . . 10.0 110.54 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.92 -63.73 0.27 Allowed Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 120.995 -0.621 . . . . 10.0 111.734 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 82.1 p -128.93 175.63 8.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.729 0.299 . . . . 10.0 110.893 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 50.7 tp -57.95 -41.96 83.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.526 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -60.0 -51.11 71.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.775 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.01 -41.34 97.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.308 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 41.1 ttp -61.41 -50.87 71.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.761 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 93.6 mt -63.77 -41.34 97.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.784 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -60.06 -41.59 92.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.531 179.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 70' ' ' ARG . 11.6 ttm180 -65.67 -44.62 85.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.465 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 44.9 m0 -58.69 -48.25 81.75 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.458 0.647 . . . . 10.0 110.093 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.93 -46.13 79.32 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.105 -0.952 . . . . 10.0 111.416 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -56.88 -45.32 82.63 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.359 0.503 . . . . 10.0 112.359 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -64.08 -32.1 73.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.147 0.498 . . . . 10.0 110.811 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.9 m -98.41 12.0 36.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.932 -0.577 . . . . 10.0 111.925 -178.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 56.06 43.41 27.06 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.363 0.601 . . . . 10.0 111.204 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 72.2 mtp -117.05 173.85 6.43 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.721 -179.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -114.45 166.82 11.29 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.558 -179.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.1 tp -136.62 138.65 41.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.961 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.492 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 35.5 m -121.4 96.93 5.28 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.378 -0.828 . . . . 10.0 110.475 179.471 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.49 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 8.0 t80 -89.67 108.17 19.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.033 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -103.84 12.84 33.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.971 0.415 . . . . 10.0 111.578 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.465 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 35.0 mt -87.09 144.97 37.15 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.796 -0.446 . . . . 10.0 109.796 179.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -57.69 -46.71 25.09 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.876 2.384 . . . . 10.0 112.845 -179.322 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.0 m -133.65 161.41 34.72 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.474 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.49 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 2.3 p30 -78.08 147.83 34.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.152 -0.476 . . . . 10.0 109.924 179.239 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -120.02 139.38 52.59 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.142 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.57 153.58 31.08 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.542 ' H ' HD22 ' A' ' 89' ' ' LEU . 0.5 OUTLIER -60.33 122.38 14.38 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 179.239 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.7 pt -62.7 -29.8 47.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 113.086 0.773 . . . . 10.0 113.086 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 144.85 -64.77 0.46 Allowed Glycine 0 CA--C 1.517 0.164 0 C-N-CA 120.054 -1.07 . . . . 10.0 112.749 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.419 ' HG2' HG11 ' A' ' 111' ' ' VAL . 33.8 Cg_endo -65.36 0.91 2.39 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.748 2.298 . . . . 10.0 112.847 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.8 t -67.8 -42.75 86.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.049 0.452 . . . . 10.0 110.365 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.582 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.7 OUTLIER -64.59 -15.08 60.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.321 179.096 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -80.31 -7.27 58.97 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.924 0.392 . . . . 10.0 110.573 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 29.8 mt -96.37 110.85 25.37 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 116.051 -0.522 . . . . 10.0 109.879 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.402 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 11.0 m -139.73 95.54 2.93 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.447 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.0 t -131.45 155.97 46.44 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.827 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -88.9 -14.44 36.78 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.086 0.47 . . . . 10.0 110.965 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.3 m -92.84 124.74 37.05 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.513 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.498 HG22 ' CE2' ' A' ' 55' ' ' TYR . 1.2 t -62.22 -46.33 96.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.12 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -60.86 -32.87 72.28 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.467 -0.788 . . . . 10.0 110.907 -179.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -71.97 -41.04 68.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.229 -0.441 . . . . 10.0 109.884 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.34 -50.17 75.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.698 -0.683 . . . . 10.0 110.664 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.77 -37.54 87.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.159 0.504 . . . . 10.0 110.694 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 37.4 m -63.76 -49.19 73.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.806 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.34 -40.37 93.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.492 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 47.7 mt -60.57 -51.09 70.89 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.331 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.4 m -58.5 -33.25 69.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.354 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.32 -40.19 93.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.939 0.4 . . . . 10.0 111.048 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.419 HG11 ' HG2' ' A' ' 92' ' ' PRO . 3.9 t -87.78 -39.76 13.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.359 0.6 . . . . 10.0 111.105 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.51 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 12.7 m-30 -66.58 -24.64 66.37 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.36 -0.836 . . . . 10.0 112.711 -178.651 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.429 ' O ' HG21 ' A' ' 133' ' ' VAL . . . -51.43 -37.43 48.5 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.889 0.329 . . . . 10.0 111.889 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.66 -9.48 54.4 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.807 0.337 . . . . 10.0 111.592 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -112.35 2.33 16.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.864 0.364 . . . . 10.0 110.188 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 77.92 26.36 60.51 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 115.841 -0.618 . . . . 10.0 113.049 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.51 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 96.3 t -121.85 140.46 45.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.607 0.242 . . . . 10.0 110.734 -179.458 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' SER . . . . . 0.472 ' HB2' HG13 ' A' ' 131' ' ' VAL . 3.4 t -139.21 140.72 37.84 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.563 -0.532 . . . . 10.0 109.563 179.267 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.449 HG12 HG22 ' A' ' 128' ' ' VAL . 9.8 m -131.19 139.81 50.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.897 0.379 . . . . 10.0 110.657 -179.679 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.1 m -142.89 156.83 44.98 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.605 -0.27 . . . . 10.0 110.382 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.53 HG22 ' CD2' ' A' ' 126' ' ' LEU . 5.3 t -109.43 114.44 46.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 108.65 -0.87 . . . . 10.0 108.65 179.053 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 15.8 m -132.83 118.2 18.68 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.668 -178.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 63.6 42.33 6.54 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.674 0.609 . . . . 10.0 110.752 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 5.4 t30 61.04 27.81 17.64 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.784 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.492 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 36.5 tttt -130.0 135.54 48.4 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.53 ' CD2' HG22 ' A' ' 121' ' ' VAL . 88.2 mt -88.55 122.63 32.22 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.704 0.288 . . . . 10.0 110.232 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -108.2 125.83 52.09 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.699 -179.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.449 HG22 HG12 ' A' ' 119' ' ' VAL . 6.6 t -113.57 119.95 62.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.36 -0.607 . . . . 10.0 109.36 178.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -140.82 148.09 51.11 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.634 0.254 . . . . 10.0 110.51 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -76.89 147.2 26.88 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.378 2.052 . . . . 10.0 111.913 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' VAL . . . . . 0.472 HG13 ' HB2' ' A' ' 118' ' ' SER . 2.8 m -114.99 149.46 42.54 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.922 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -77.3 99.14 1.27 Allowed 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.737 2.291 . . . . 10.0 112.444 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' VAL . . . . . 0.429 HG21 ' O ' ' A' ' 113' ' ' ALA . 2.8 m -137.54 22.1 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.915 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.43 ' HB3' ' HG3' ' A' ' 138' ' ' LYS . 1.2 m -72.18 121.36 19.19 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.19 -0.914 . . . . 10.0 110.977 -179.007 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.6 m -119.38 86.08 2.49 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.468 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 140.92 -154.23 24.27 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.796 -0.638 . . . . 10.0 111.697 -179.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.04 133.74 35.31 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.742 0.306 . . . . 10.0 110.727 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' LYS . . . . . 0.43 ' HG3' ' HB3' ' A' ' 134' ' ' SER . 27.4 mmmt -134.07 -164.46 1.5 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.187 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 16.3 tp . . . . . 0 C--O 1.245 0.852 0 CA-C-O 118.718 -0.658 . . . . 10.0 109.819 179.422 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.686 0 N-CA-C 111.848 -0.501 . . . . 10.0 111.848 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.2 m -81.83 115.12 20.89 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.716 0.293 . . . . 10.0 110.219 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -75.34 79.36 2.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.072 0.463 . . . . 10.0 110.461 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 57.8 mtt -91.72 -4.71 54.74 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.251 -179.144 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.17 87.0 4.92 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.083 0.468 . . . . 10.0 110.626 179.648 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -134.62 108.1 10.94 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.764 -179.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -65.51 145.77 83.24 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.445 2.097 . . . . 10.0 110.966 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.91 147.24 90.14 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.875 -179.526 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -69.43 -175.71 1.16 Allowed 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.559 2.173 . . . . 10.0 112.331 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -77.25 168.39 20.14 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.907 -179.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -159.6 106.98 1.71 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.907 -179.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.29 -160.76 10.96 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.99 -0.624 . . . . 10.0 111.678 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 75.83 76.54 0.78 Allowed Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.767 -0.73 . . . . 10.0 112.087 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 13.6 mtp180 -129.39 -174.73 3.36 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 110.38 -0.23 . . . . 10.0 110.38 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 41.7 m95 61.43 33.17 18.8 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 123.667 0.605 . . . . 10.0 110.912 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.2 mtpt -97.39 -176.29 3.46 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.944 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 55.99 60.15 3.38 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 115.523 -0.762 . . . . 10.0 109.993 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.82 28.26 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.827 -179.001 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -111.64 118.68 36.34 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.384 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 39.2 t-80 -65.75 -56.57 11.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.562 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -166.79 133.29 2.37 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.237 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -78.22 98.51 5.9 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.176 -0.466 . . . . 10.0 109.983 179.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -155.98 167.17 31.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.65 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -127.08 155.06 76.55 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.084 -0.507 . . . . 10.0 109.644 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -53.02 -47.49 27.28 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.799 2.332 . . . . 10.0 112.22 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.2 m -143.44 90.63 2.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.077 0.465 . . . . 10.0 110.389 179.149 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.41 91.39 4.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.402 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.6 pt -125.07 148.68 61.07 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.453 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -68.96 85.91 0.49 Allowed 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.519 2.146 . . . . 10.0 111.932 179.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -128.05 118.91 24.33 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.53 -0.759 . . . . 10.0 110.51 -179.374 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -90.95 116.53 28.83 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.042 179.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.27 130.32 45.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.863 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.3 m -142.06 107.92 5.15 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.974 0.416 . . . . 10.0 110.927 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.423 ' CD2' ' HB3' ' A' ' 74' ' ' ASP . 13.6 t80 -82.04 131.62 35.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.364 179.232 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.1 m -79.14 118.49 21.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.284 0.564 . . . . 10.0 111.084 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -83.5 109.31 17.26 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.751 -0.658 . . . . 10.0 110.184 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.42 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 12.0 pt20 -147.36 154.82 41.36 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.829 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.44 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -85.42 124.59 32.18 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.049 0.452 . . . . 10.0 110.0 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.432 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 73.0 p -117.01 158.91 42.94 Favored Pre-proline 0 C--N 1.317 -0.807 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.225 -179.459 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.432 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 45.2 Cg_endo -68.23 -7.98 21.55 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 121.997 1.798 . . . . 10.0 111.322 179.061 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 52.3 mtm -82.85 -20.33 35.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.82 179.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -75.64 -59.39 2.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.857 -0.61 . . . . 10.0 109.461 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 91.51 -61.98 2.77 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.799 -0.715 . . . . 10.0 112.938 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 49.5 p -124.45 166.29 16.27 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.939 0.399 . . . . 10.0 111.551 -179.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.461 HD13 ' HE2' ' A' ' 112' ' ' TYR . 45.2 tp -56.85 -44.73 82.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.492 -0.776 . . . . 10.0 111.217 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.452 ' O ' ' HG3' ' A' ' 69' ' ' GLU . 36.9 ttmt -59.87 -53.62 55.81 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.379 -179.837 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.559 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 2.3 m -57.49 -43.81 84.46 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.423 -0.353 . . . . 10.0 111.069 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 52.0 ttp -57.63 -51.52 69.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.121 0.486 . . . . 10.0 110.407 179.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 77.0 mt -64.95 -36.86 85.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.131 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 22.3 mt-10 -63.86 -41.0 97.88 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 110.261 -0.274 . . . . 10.0 110.261 179.002 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.559 ' HG2' ' O ' ' A' ' 66' ' ' THR . 32.0 mmt180 -69.32 -39.26 78.33 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 179.05 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 37.6 m0 -61.93 -54.77 37.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.734 179.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.591 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -59.89 -44.11 94.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.531 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.95 -36.25 83.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.734 0.302 . . . . 10.0 111.541 -179.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 70' ' ' ARG . 0.5 OUTLIER -73.28 -12.89 61.01 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.887 0.375 . . . . 10.0 111.424 -179.304 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.5 m -120.58 12.28 11.48 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.437 -0.347 . . . . 10.0 111.312 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 62.2 t30 56.05 51.68 11.6 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.358 0.599 . . . . 10.0 110.619 179.337 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.422 ' HG2' ' OD1' ' A' ' 124' ' ' ASN . 71.1 mtp -124.27 171.17 10.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.984 -0.553 . . . . 10.0 111.029 -179.093 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.411 ' HB2' ' HG3' ' A' ' 125' ' ' LYS . 37.6 mm-40 -101.68 164.87 11.52 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.063 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.7 tp -141.52 142.48 33.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.344 0.593 . . . . 10.0 111.473 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.449 ' HB2' ' HG ' ' A' ' 127' ' ' LEU . 12.9 m -131.12 97.38 4.28 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.13 -0.941 . . . . 10.0 110.525 179.534 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.644 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 15.7 t80 -91.01 103.48 16.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.298 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -93.41 0.99 57.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.766 0.317 . . . . 10.0 111.65 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.644 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 2.1 mm? -74.33 137.13 75.01 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.316 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.56 -26.66 54.12 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.969 2.446 . . . . 10.0 112.577 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 57.2 m -141.19 161.92 36.71 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.946 0.403 . . . . 10.0 111.033 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.402 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 6.6 p-10 -85.91 143.67 28.07 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.974 179.262 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -121.37 134.91 55.13 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.223 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.07 161.37 29.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.57 -0.286 . . . . 10.0 110.371 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.98 107.96 3.33 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.0 pt -47.99 -46.13 12.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.621 -0.718 . . . . 10.0 112.533 -178.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 165.38 -69.33 0.19 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.044 -1.074 . . . . 10.0 112.881 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -56.41 -13.4 10.16 Favored 'Trans proline' 0 N--CA 1.478 0.583 0 C-N-CA 123.661 2.907 . . . . 10.0 113.39 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.421 ' H ' HG23 ' A' ' 93' ' ' VAL . 2.1 t -60.47 -36.31 68.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.246 0.546 . . . . 10.0 110.346 179.692 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.44 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.8 m -69.34 -12.0 61.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.605 -0.725 . . . . 10.0 111.51 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.48 -1.19 53.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.936 0.398 . . . . 10.0 110.921 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.42 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 53.6 mt -98.36 113.72 33.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.801 -0.444 . . . . 10.0 109.801 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.1 m -142.29 95.39 2.79 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.979 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.0 t -131.02 153.58 49.1 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.549 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.09 -8.71 58.54 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.903 0.382 . . . . 10.0 111.315 179.498 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.8 t -100.02 119.18 37.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.578 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 12.8 p -65.78 -30.85 51.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-O 121.024 0.44 . . . . 10.0 110.255 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -69.07 -41.94 76.88 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 52.9 tp60 -66.43 -40.9 89.79 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.597 178.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.61 -49.09 78.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.331 179.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.82 -35.96 79.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.169 0.509 . . . . 10.0 110.221 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 95.0 m -66.14 -49.29 67.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.965 179.347 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -65.8 -44.73 84.81 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.028 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 64.1 mt -59.85 -49.24 78.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.676 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 49.4 m -62.38 -23.45 66.82 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.551 0.204 . . . . 10.0 111.551 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.79 -41.43 78.74 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.837 0.351 . . . . 10.0 110.656 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.426 HG13 ' HD1' ' A' ' 112' ' ' TYR . 3.4 p -89.03 -32.63 5.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.408 0.623 . . . . 10.0 111.326 179.583 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.461 ' HE2' HD13 ' A' ' 64' ' ' LEU . 3.5 m-30 -77.67 -23.42 49.6 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.254 0.835 . . . . 10.0 113.254 -178.287 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.08 -49.32 42.28 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 111.78 0.289 . . . . 10.0 111.78 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.85 -22.86 67.07 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.112 0.482 . . . . 10.0 111.441 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -84.89 -15.02 45.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.264 0.554 . . . . 10.0 110.306 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 94.68 25.99 14.16 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.747 -0.739 . . . . 10.0 112.275 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' VAL . . . . . 0.424 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 95.4 t -129.54 138.39 54.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.929 0.395 . . . . 10.0 110.877 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.1 m -138.34 120.98 16.27 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.058 0.456 . . . . 10.0 110.314 178.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.512 HG12 HG13 ' A' ' 128' ' ' VAL . 3.9 m -104.78 137.46 33.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.171 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.96 140.47 23.38 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.191 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 1.7 p -107.96 123.2 63.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.186 0.517 . . . . 10.0 109.685 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 56.4 m -143.72 132.99 23.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.578 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 59.1 39.86 22.65 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.317 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.422 ' OD1' ' HG2' ' A' ' 77' ' ' MET . 18.8 t30 63.81 24.18 13.68 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.488 -0.778 . . . . 10.0 111.048 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.411 ' HG3' ' HB2' ' A' ' 78' ' ' GLN . 41.5 tttt -128.03 133.13 49.08 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.251 -179.605 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.591 HD12 ' HB2' ' A' ' 72' ' ' ALA . 17.2 mt -89.04 121.44 31.38 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.595 -0.891 . . . . 10.0 108.595 178.425 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.449 ' HG ' ' HB2' ' A' ' 80' ' ' SER . 0.3 OUTLIER -117.34 122.95 45.31 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.174 0.511 . . . . 10.0 110.876 -179.358 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.531 ' CG1' HD21 ' A' ' 83' ' ' LEU . 1.8 t -111.26 121.03 63.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.632 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -134.94 146.05 57.09 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.076 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -76.54 150.77 32.09 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.316 2.011 . . . . 10.0 111.676 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -119.96 147.12 43.66 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.659 179.668 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -78.48 98.1 1.18 Allowed 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.76 2.307 . . . . 10.0 112.497 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 1.6 m -127.69 19.0 3.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.367 0.604 . . . . 10.0 110.761 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.13 101.11 13.17 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.66 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.9 m -70.64 131.63 44.21 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.5 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 94.26 -95.97 1.99 Allowed Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 120.719 -0.753 . . . . 10.0 112.183 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -87.62 117.27 26.32 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.731 0.3 . . . . 10.0 111.415 -179.577 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' LYS . . . . . 0.43 ' HD3' ' C ' ' A' ' 138' ' ' LYS . 7.5 tmtt? -159.87 124.05 3.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.312 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 66.7 mt . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.775 -0.631 . . . . 10.0 109.967 179.361 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.711 0 N-CA-C 111.76 -0.536 . . . . 10.0 111.76 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 m -100.26 140.18 34.88 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.278 -0.268 . . . . 10.0 110.278 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -127.57 33.31 4.85 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.381 0.61 . . . . 10.0 110.275 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.97 159.98 14.69 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.627 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.6 t -148.96 145.31 27.29 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.85 0.357 . . . . 10.0 110.293 179.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -132.7 71.88 78.1 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.813 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -83.64 154.12 13.61 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 123.028 2.485 . . . . 10.0 111.823 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -153.78 136.89 10.06 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.514 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_exo -57.44 141.02 94.88 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.596 2.198 . . . . 10.0 111.495 179.364 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.94 166.92 12.58 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.553 -179.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -165.89 106.44 0.72 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.009 -179.32 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 175.78 137.24 2.51 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.896 -0.669 . . . . 10.0 111.965 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 131.27 -3.74 5.54 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.58 -0.819 . . . . 10.0 112.56 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.2 mtp180 -73.65 -33.03 64.32 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 120.771 0.319 . . . . 10.0 110.768 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 78.4 m95 -82.74 -11.09 58.57 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.053 0.454 . . . . 10.0 110.545 -179.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt -94.6 91.82 6.76 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.649 -0.705 . . . . 10.0 109.909 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -146.45 89.85 1.89 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.233 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.1 m -137.83 168.29 20.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.464 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -120.61 105.25 10.62 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.09 0.471 . . . . 10.0 110.039 179.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 16.5 m170 -82.91 8.41 12.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.043 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -85.56 -1.41 57.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.343 -0.389 . . . . 10.0 110.582 179.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -67.95 130.23 42.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.081 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.18 -64.37 1.16 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.507 -179.469 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -121.85 144.63 41.4 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.309 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -62.26 -50.25 5.0 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.044 1.83 . . . . 10.0 111.523 -179.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.8 m -142.35 107.69 5.02 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.851 179.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -82.88 106.13 14.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.916 0.389 . . . . 10.0 110.353 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -129.56 101.72 18.66 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.792 -179.54 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -68.61 99.66 0.64 Allowed 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.807 2.338 . . . . 10.0 111.419 179.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.1 tp -151.95 119.53 6.06 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.413 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -75.09 123.08 24.57 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 179.468 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.21 111.95 1.38 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.829 0.347 . . . . 10.0 110.237 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.6 m -143.02 99.23 3.42 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 120.994 0.426 . . . . 10.0 111.107 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -68.9 120.18 14.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.527 -0.76 . . . . 10.0 109.931 179.056 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.8 m -76.95 122.81 25.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.728 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' TYR . . . . . 0.465 ' O ' ' HA ' ' A' ' 97' ' ' SER . 95.2 m-85 -89.96 121.99 32.56 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.562 -0.744 . . . . 10.0 109.979 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.415 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 19.8 pt20 -152.21 153.06 33.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.688 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ALA . . . . . 0.446 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -86.17 121.26 28.52 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 52.2 p -111.54 154.41 43.86 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-O 120.69 0.281 . . . . 10.0 111.322 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.92 -10.54 27.26 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.726 2.284 . . . . 10.0 111.83 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 21.4 mmt -82.4 -18.54 41.61 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.189 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -79.35 -52.78 7.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.694 -0.685 . . . . 10.0 109.575 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 92.82 -67.35 1.85 Allowed Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.464 -0.789 . . . . 10.0 112.855 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.498 HG21 ' OD2' ' A' ' 86' ' ' ASP . 28.4 p -118.58 169.39 9.83 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.79 0.329 . . . . 10.0 111.512 -179.19 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.525 HD13 ' CE2' ' A' ' 112' ' ' TYR . 41.2 tp -59.35 -36.43 75.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.679 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -61.16 -58.3 8.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.527 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.39 -33.31 75.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.161 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.448 ' HB2' ' O ' ' A' ' 63' ' ' THR . 4.4 tmm? -63.03 -54.8 32.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.733 -0.667 . . . . 10.0 111.166 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.0 mp -68.42 -31.52 70.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.317 -0.401 . . . . 10.0 111.263 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -57.84 -43.5 85.88 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.706 -0.479 . . . . 10.0 109.706 178.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -68.47 -42.35 78.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.119 179.483 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 25.4 m0 -55.85 -55.42 32.67 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.624 -0.717 . . . . 10.0 110.683 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.82 -45.54 85.79 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.072 -0.967 . . . . 10.0 111.702 -178.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.95 -40.76 90.07 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.929 0.344 . . . . 10.0 111.929 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -66.24 -27.83 68.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.012 0.434 . . . . 10.0 111.51 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.405 ' HB2' ' SD ' ' A' ' 77' ' ' MET . 4.0 m -108.76 11.65 26.18 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 -178.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 55.55 48.42 18.76 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.589 0.709 . . . . 10.0 110.67 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.405 ' SD ' ' HB2' ' A' ' 75' ' ' SER . 59.1 mtp -114.65 168.09 10.18 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.164 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.424 ' HB3' ' HG3' ' A' ' 125' ' ' LYS . 2.0 mm-40 -99.88 158.99 15.42 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.655 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 26.8 tp -132.83 128.26 36.31 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.571 0.7 . . . . 10.0 110.935 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.418 ' HB2' HD13 ' A' ' 127' ' ' LEU . 69.4 m -114.96 94.75 4.89 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 114.972 -1.013 . . . . 10.0 109.427 178.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.5 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 12.5 t80 -94.45 101.46 13.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.808 -179.164 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -105.23 28.37 7.36 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.99 0.424 . . . . 10.0 111.473 -179.096 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.49 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 34.2 mt -96.01 145.85 30.27 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.052 179.519 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.4 -38.43 89.33 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 123.183 2.589 . . . . 10.0 112.547 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.4 m -150.73 171.09 17.71 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.992 0.425 . . . . 10.0 110.888 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.5 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 8.9 p-10 -83.1 131.56 35.14 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.718 -0.674 . . . . 10.0 109.839 179.323 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -103.79 131.74 50.7 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.747 -179.29 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.65 150.8 48.53 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.441 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.449 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -58.28 108.86 0.67 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 120.977 0.418 . . . . 10.0 110.09 178.481 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.2 pt -52.57 -37.93 25.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.071 -0.968 . . . . 10.0 112.91 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 141.17 -72.38 0.4 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.291 -0.957 . . . . 10.0 112.071 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -57.07 -17.05 23.3 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 123.039 2.493 . . . . 10.0 112.367 179.568 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 10.2 p -63.8 -32.0 55.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.512 0.672 . . . . 10.0 110.267 178.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.446 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.4 m -72.53 -7.42 49.93 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.153 -0.931 . . . . 10.0 111.08 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.2 -4.72 48.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.315 0.578 . . . . 10.0 110.237 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.415 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 65.1 mt -92.2 112.51 25.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 CA-C-N 115.422 -0.808 . . . . 10.0 109.82 -179.368 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.465 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 1.7 m -142.61 97.9 3.2 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.605 -0.725 . . . . 10.0 109.821 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.1 t -131.38 157.16 44.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.747 0.308 . . . . 10.0 110.888 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.03 -21.79 39.88 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.786 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.2 t -90.16 119.03 30.14 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.771 0.32 . . . . 10.0 110.491 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.0 p -65.04 -31.69 55.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.85 0.357 . . . . 10.0 110.556 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -68.9 -41.24 78.51 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 109.546 -0.539 . . . . 10.0 109.546 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -66.75 -41.43 87.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.845 179.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.57 -47.09 76.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.158 178.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.11 -35.21 80.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.295 178.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 86.0 m -65.58 -48.42 72.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.228 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -65.17 -37.56 87.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.089 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.8 mp -63.91 -52.78 58.29 Favored 'General case' 0 C--O 1.219 -0.508 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.22 178.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.6 m -57.91 -29.61 65.24 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.967 0.358 . . . . 10.0 111.967 -179.307 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.2 -45.78 91.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.255 0.55 . . . . 10.0 110.51 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.718 HG13 ' HD1' ' A' ' 112' ' ' TYR . 11.9 p -89.55 -22.65 6.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.756 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' TYR . . . . . 0.718 ' HD1' HG13 ' A' ' 111' ' ' VAL . 3.7 m-85 -83.13 -24.08 32.74 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.143 0.794 . . . . 10.0 113.143 -178.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.63 -40.11 38.23 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.077 0.399 . . . . 10.0 112.077 -179.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.47 -19.49 63.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.103 0.478 . . . . 10.0 111.402 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -93.72 -2.57 53.63 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.398 0.618 . . . . 10.0 109.632 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.22 23.33 52.01 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 115.466 -0.788 . . . . 10.0 112.625 179.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 60.8 t -124.55 140.25 48.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.026 0.441 . . . . 10.0 111.546 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 6.6 m -139.94 122.6 16.34 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.359 -0.608 . . . . 10.0 109.359 178.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 10.8 m -114.65 149.35 16.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.143 0.497 . . . . 10.0 111.358 -178.507 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.0 p -152.13 170.47 19.89 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.088 -0.506 . . . . 10.0 109.872 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' VAL . . . . . 0.503 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.5 t -125.7 119.07 53.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.173 -0.677 . . . . 10.0 109.173 179.508 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 15.3 m -128.73 109.62 11.47 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.028 -179.227 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 58.99 57.69 3.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.63 -0.714 . . . . 10.0 112.06 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 19.9 t30 61.13 21.6 12.0 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.569 -0.742 . . . . 10.0 111.782 178.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.424 ' HG3' ' HB3' ' A' ' 78' ' ' GLN . 47.8 tttt -125.54 133.12 52.45 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.984 -0.376 . . . . 10.0 109.984 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.503 ' CD2' HG22 ' A' ' 121' ' ' VAL . 69.6 mt -87.95 122.23 31.31 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.511 -0.551 . . . . 10.0 109.511 179.307 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.418 HD13 ' HB2' ' A' ' 80' ' ' SER . 3.9 mm? -107.93 117.24 33.6 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.533 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 11.5 t -109.05 118.06 55.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 108.515 -0.92 . . . . 10.0 108.515 178.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -134.19 141.66 40.24 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-O 120.766 0.317 . . . . 10.0 110.569 -179.036 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -81.31 145.21 14.97 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.313 2.009 . . . . 10.0 111.365 179.026 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 1.7 m -110.82 145.81 33.13 Favored Pre-proline 0 C--N 1.323 -0.579 0 C-N-CA 120.942 -0.303 . . . . 10.0 110.617 179.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -79.07 88.6 1.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.699 2.266 . . . . 10.0 111.846 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 13.1 m -130.93 -175.42 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.109 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 1.1 m -73.89 145.73 44.58 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.95 0.405 . . . . 10.0 110.761 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 2.6 m -70.07 -38.35 75.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.151 0.5 . . . . 10.0 110.031 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -106.15 57.41 0.47 Allowed Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.703 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -73.48 98.64 2.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.036 0.446 . . . . 10.0 110.626 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -162.04 175.89 11.31 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.617 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.512 -0.756 . . . . 10.0 110.141 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.1 t80 . . . . . 0 N--CA 1.455 -0.18 0 CA-C-O 120.753 0.311 . . . . 10.0 110.703 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.6 m -85.41 119.03 25.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.219 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -88.64 113.34 24.11 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.022 -0.733 . . . . 10.0 109.022 179.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -153.73 158.57 41.17 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.018 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.52 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -73.85 139.08 44.81 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.817 -0.809 . . . . 10.0 108.817 178.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.2 p -126.23 161.82 49.8 Favored Pre-proline 0 C--N 1.319 -0.725 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.353 -177.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -75.53 12.33 1.38 Allowed 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 121.93 1.754 . . . . 10.0 112.326 179.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 16.2 ptt? -111.27 -17.17 13.23 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.426 0.528 . . . . 10.0 112.426 -179.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.17 -61.67 1.87 Allowed 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.17 -0.612 . . . . 10.0 110.669 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.18 -53.59 2.49 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.731 -0.747 . . . . 10.0 112.019 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 61.8 p -126.78 166.44 17.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.727 0.298 . . . . 10.0 111.058 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.401 HD13 ' CE2' ' A' ' 112' ' ' TYR . 62.6 tp -56.23 -45.35 79.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.815 -0.63 . . . . 10.0 111.168 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -56.48 -54.57 44.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.646 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.89 -35.99 78.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.586 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.413 ' HE3' HD21 ' A' ' 108' ' ' LEU . 50.5 ttp -64.03 -50.5 68.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.367 -0.378 . . . . 10.0 110.218 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 71.3 mt -64.76 -34.75 79.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.248 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -60.0 -50.02 75.4 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.163 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -66.43 -40.69 89.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.235 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 31.3 m0 -57.64 -54.3 48.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.152 0.501 . . . . 10.0 110.829 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.92 -42.4 81.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.699 -0.682 . . . . 10.0 111.944 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.42 -40.56 78.6 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.564 0.579 . . . . 10.0 112.564 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -60.5 -39.33 87.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.905 0.383 . . . . 10.0 111.415 -179.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.403 ' HB2' ' HG3' ' A' ' 77' ' ' MET . 8.7 m -97.78 11.98 35.4 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.36 -179.273 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 m120 56.06 39.96 30.35 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.532 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.403 ' HG3' ' HB2' ' A' ' 75' ' ' SER . 5.2 mtm -102.88 164.09 11.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.783 -0.644 . . . . 10.0 109.488 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 -96.82 157.86 15.7 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.565 -0.288 . . . . 10.0 110.953 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 34.0 tp -128.74 138.06 51.91 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.194 0.521 . . . . 10.0 110.649 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.24 96.16 4.98 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.121 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.509 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 16.4 t80 -95.45 98.83 10.84 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.708 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -101.77 37.87 1.74 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.858 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.509 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 44.2 mt -106.01 142.15 24.24 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -61.04 -30.31 89.33 Favored 'Trans proline' 0 CA--C 1.529 0.23 0 C-N-CA 122.764 2.31 . . . . 10.0 113.313 -179.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.2 m -145.69 166.85 24.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.893 0.378 . . . . 10.0 111.494 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.38 124.97 39.68 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.214 -0.662 . . . . 10.0 109.214 179.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -110.27 156.7 20.33 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.554 0.216 . . . . 10.0 110.714 -178.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.8 OUTLIER -79.99 177.02 9.22 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.727 179.574 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.98 134.54 41.45 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.41 HG12 ' H ' ' A' ' 90' ' ' ILE . 1.7 pt -65.87 -28.8 44.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 112.517 0.562 . . . . 10.0 112.517 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 138.03 -62.72 0.57 Allowed Glycine 0 CA--C 1.52 0.36 0 C-N-CA 120.296 -0.954 . . . . 10.0 113.618 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.86 7.99 1.47 Allowed 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.534 2.156 . . . . 10.0 113.151 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.9 t -69.41 -45.63 78.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.939 0.4 . . . . 10.0 110.658 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.52 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.0 OUTLIER -65.77 -13.75 60.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.593 179.85 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.68 1.8 47.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.031 0.443 . . . . 10.0 110.875 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.418 HD13 HD12 ' A' ' 108' ' ' LEU . 46.6 mt -107.62 107.2 22.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.181 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.4 97.61 4.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.048 0.451 . . . . 10.0 111.128 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.2 t -130.74 155.95 45.78 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.711 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.12 -6.26 55.6 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.235 0.541 . . . . 10.0 110.816 179.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 19.4 t -98.46 116.24 30.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.287 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.15 -31.63 54.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.186 0.517 . . . . 10.0 110.059 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -68.12 -43.47 78.33 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.798 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.6 tp60 -67.77 -41.21 83.63 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.286 -0.416 . . . . 10.0 110.343 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.96 -49.15 72.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.413 179.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.16 -36.95 85.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.461 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 98.9 m -63.37 -43.81 96.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.824 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -70.78 -41.36 71.81 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.454 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.418 HD12 HD13 ' A' ' 96' ' ' ILE . 2.0 mp -61.92 -51.17 69.22 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.91 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.7 p -58.31 -25.52 61.96 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.172 0.434 . . . . 10.0 112.172 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.36 -43.65 66.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.029 0.443 . . . . 10.0 111.149 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.439 HG13 ' HD1' ' A' ' 112' ' ' TYR . 10.5 p -87.56 -24.5 6.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.203 0.525 . . . . 10.0 111.291 -179.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.439 ' HD1' HG13 ' A' ' 111' ' ' VAL . 8.0 m-85 -79.79 -24.28 41.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.795 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -51.28 -36.43 42.27 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.438 -0.346 . . . . 10.0 111.643 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.65 -27.09 68.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.959 0.409 . . . . 10.0 111.664 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -91.97 -11.98 34.61 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.715 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . 0.449 ' HA2' HG23 ' A' ' 131' ' ' VAL . . . 93.45 27.46 13.13 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.622 -0.799 . . . . 10.0 112.107 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 57.8 t -124.53 125.67 70.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.798 0.332 . . . . 10.0 111.076 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.4 m -122.67 113.87 19.82 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.188 178.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 16.4 m -105.39 142.33 18.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.801 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 41.6 m -152.46 166.27 32.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.015 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.504 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.5 t -117.73 128.4 74.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 110.111 -0.329 . . . . 10.0 110.111 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.6 m -147.6 120.86 8.94 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.728 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 61.68 43.13 10.11 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 123.636 0.585 . . . . 10.0 111.559 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 19.1 m120 62.33 26.61 15.91 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.727 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -130.31 132.8 46.04 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.61 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.504 ' CD2' HG22 ' A' ' 121' ' ' VAL . 97.4 mt -88.61 122.72 32.36 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 108.62 -0.882 . . . . 10.0 108.62 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -112.79 122.76 48.59 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.331 0.586 . . . . 10.0 111.234 -178.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.2 t -108.17 119.21 57.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.269 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -128.45 138.49 33.16 Favored Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 110.032 -0.358 . . . . 10.0 110.032 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.425 ' HA ' ' O ' ' A' ' 116' ' ' GLY . 69.4 Cg_endo -77.96 135.02 13.66 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 121.98 1.786 . . . . 10.0 111.855 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.449 HG23 ' HA2' ' A' ' 116' ' ' GLY . 3.2 m . . . . . 0 C--N 1.319 -0.727 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.347 179.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 29.0 t80 . . . . . 0 C--O 1.234 0.241 0 CA-C-O 120.924 0.392 . . . . 10.0 110.313 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 30.4 m -75.36 121.29 22.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.831 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -86.47 116.54 24.68 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.408 -0.814 . . . . 10.0 109.088 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -145.85 147.74 32.13 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.187 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.797 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -74.77 112.14 10.68 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.733 -0.469 . . . . 10.0 109.733 178.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.425 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 26.2 p -107.55 157.26 36.21 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.799 -179.143 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.425 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 37.3 Cg_endo -65.99 -11.21 30.03 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.348 2.032 . . . . 10.0 111.255 178.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 51.3 mtt -77.74 -29.42 51.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.64 -0.709 . . . . 10.0 109.891 179.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -75.88 -51.67 12.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.221 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 81.2 -63.14 4.37 Favored Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.478 -0.783 . . . . 10.0 113.64 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 43.8 p -113.1 169.33 9.01 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.881 0.372 . . . . 10.0 111.67 -178.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.495 HD13 ' HE2' ' A' ' 112' ' ' TYR . 66.9 tp -63.46 -47.42 81.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.64 -0.709 . . . . 10.0 111.227 -179.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 34.1 ttmt -56.11 -55.99 26.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.222 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.0 m -61.37 -32.45 72.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.845 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 55.9 ttp -68.99 -51.19 41.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.938 0.399 . . . . 10.0 110.35 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.1 mt -62.35 -35.66 79.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.703 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -61.44 -40.94 96.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.558 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -68.66 -40.55 80.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.278 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.441 ' CZ3' ' HB1' ' A' ' 104' ' ' ALA . 43.7 m0 -64.13 -50.01 69.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.447 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.547 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -60.48 -37.14 80.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.199 179.376 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.45 -34.71 77.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.567 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.06 -41.32 95.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.331 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.76 7.69 45.59 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.33 0.492 . . . . 10.0 112.33 -177.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 60.72 53.22 4.04 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.59 0.71 . . . . 10.0 109.856 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.487 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 22.0 mtm -124.43 171.22 10.12 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.831 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -106.24 171.11 7.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.468 -0.333 . . . . 10.0 110.585 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.3 tp -133.27 133.53 42.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.149 0.5 . . . . 10.0 111.578 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -119.24 95.9 4.99 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.467 -0.788 . . . . 10.0 109.506 178.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.467 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 6.7 t80 -88.98 98.52 11.8 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.697 -0.683 . . . . 10.0 109.394 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.419 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 64.3 m-80 -101.81 37.09 1.9 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.283 0.563 . . . . 10.0 110.898 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.437 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 33.7 mt -101.21 145.44 30.44 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.816 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -62.35 -40.29 41.06 Favored 'Trans proline' 0 N--CA 1.464 -0.232 0 C-N-CA 122.617 2.211 . . . . 10.0 111.531 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -138.72 141.85 38.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.727 -0.669 . . . . 10.0 110.083 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.467 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 15.1 t70 -78.56 131.31 36.72 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.741 -0.466 . . . . 10.0 109.741 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -100.58 148.19 25.09 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.111 0.482 . . . . 10.0 111.532 -178.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.9 m -81.84 147.52 29.31 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.494 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -54.31 123.81 14.02 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 121.097 0.475 . . . . 10.0 111.372 179.345 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.46 HD12 ' HG2' ' A' ' 92' ' ' PRO . 24.2 pt -80.99 -164.28 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.508 -0.769 . . . . 10.0 110.733 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -77.18 -68.84 1.46 Allowed Glycine 0 CA--C 1.522 0.511 0 C-N-CA 120.836 -0.697 . . . . 10.0 113.304 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.46 ' HG2' HD12 ' A' ' 90' ' ' ILE . 13.8 Cg_endo -56.96 -14.55 14.55 Favored 'Trans proline' 0 N--CA 1.477 0.517 0 C-N-CA 123.592 2.861 . . . . 10.0 115.267 -178.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.413 HG22 ' HB2' ' A' ' 57' ' ' ALA . 12.6 p -68.93 -40.49 81.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.303 0.573 . . . . 10.0 110.406 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.797 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 2.1 m -67.82 -12.52 60.78 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.556 -0.747 . . . . 10.0 111.379 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.06 1.84 56.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.298 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 54.4 mt -96.69 111.39 26.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.254 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.7 m -130.11 100.67 5.5 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.675 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 15.4 t -129.72 155.46 45.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.785 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.64 10.09 38.0 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.085 0.402 . . . . 10.0 112.085 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.6 t -125.55 127.49 46.47 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.679 0.276 . . . . 10.0 110.71 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 6.0 p -66.4 -28.59 43.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.252 0.548 . . . . 10.0 110.249 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -70.72 -44.83 66.08 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.565 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -66.63 -38.62 87.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.871 -0.604 . . . . 10.0 109.902 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.441 ' HB1' ' CZ3' ' A' ' 71' ' ' TRP . . . -56.6 -50.42 72.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.864 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.48 -29.93 71.13 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.265 0.555 . . . . 10.0 110.551 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 36.9 m -69.03 -50.85 44.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.67 -0.695 . . . . 10.0 110.972 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -67.73 -36.96 81.53 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.055 -0.52 . . . . 10.0 111.652 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 26.7 mt -59.51 -50.01 75.57 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.704 0.288 . . . . 10.0 110.814 179.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.6 m -60.52 -27.76 67.87 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.356 -0.384 . . . . 10.0 111.937 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.89 -41.67 77.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.825 0.345 . . . . 10.0 111.144 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.8 p -87.48 -35.55 8.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.037 0.446 . . . . 10.0 111.585 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.495 ' HE2' HD13 ' A' ' 64' ' ' LEU . 4.0 m-30 -71.49 -22.19 61.83 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -178.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -55.39 -22.61 20.55 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.614 0.245 . . . . 10.0 111.334 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.07 -31.04 71.69 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.958 0.409 . . . . 10.0 110.615 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -94.46 -24.11 17.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.314 0.578 . . . . 10.0 109.964 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 106.77 34.37 3.06 Favored Glycine 0 N--CA 1.444 -0.77 0 CA-C-N 115.613 -0.721 . . . . 10.0 112.484 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.447 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 75.8 t -124.44 135.96 62.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.743 0.306 . . . . 10.0 110.298 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.1 m -136.1 132.22 35.82 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.108 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 7.5 m -120.73 149.29 23.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.275 0.56 . . . . 10.0 111.87 -178.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 58.3 m -155.21 154.45 32.26 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.668 179.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 1.7 p -110.83 119.55 59.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.981 0.419 . . . . 10.0 109.896 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.0 m -137.14 128.47 28.14 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.221 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 58.49 43.6 19.21 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 123.692 0.62 . . . . 10.0 111.447 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.487 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 9.8 m-20 58.27 39.28 25.8 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.902 0.858 . . . . 10.0 110.193 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 69.5 tttt -145.3 128.94 17.14 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.892 -1.049 . . . . 10.0 109.239 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.547 HD12 ' HB2' ' A' ' 72' ' ' ALA . 20.7 mt -88.01 121.73 30.76 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 108.265 -1.013 . . . . 10.0 108.265 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.38 123.93 51.23 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.163 0.506 . . . . 10.0 111.428 -178.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.419 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 2.9 t -102.11 120.82 52.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.223 179.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -129.91 133.33 24.88 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.112 -179.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.23 131.9 9.99 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.113 1.875 . . . . 10.0 111.993 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 4.5 m . . . . . 0 C--N 1.318 -0.803 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.18 179.929 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 32.9 t80 . . . . . 0 N--CA 1.453 -0.316 0 CA-C-O 121.017 0.437 . . . . 10.0 110.815 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.1 m -82.63 120.85 26.08 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.682 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -86.81 113.14 22.38 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.11 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -152.07 151.39 31.04 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.476 -0.783 . . . . 10.0 109.721 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -85.33 125.84 33.26 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.889 -0.412 . . . . 10.0 109.889 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.7 p -105.31 149.56 37.88 Favored Pre-proline 0 C--N 1.321 -0.646 0 C-N-CA 120.885 -0.326 . . . . 10.0 110.704 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -64.69 -12.29 33.15 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.643 2.228 . . . . 10.0 111.951 179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 40.1 mtt -85.25 -14.15 47.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.456 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -78.77 -48.64 14.47 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.259 -0.645 . . . . 10.0 109.259 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.58 -64.18 4.34 Favored Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.324 -0.853 . . . . 10.0 113.612 178.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 28.0 p -113.3 168.4 9.76 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 112.212 0.449 . . . . 10.0 112.212 -178.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 47.2 tp -66.01 -43.21 88.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.723 -0.671 . . . . 10.0 111.797 -179.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -55.25 -54.43 43.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.978 0.418 . . . . 10.0 110.42 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.1 m -64.75 -38.99 92.85 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.712 -0.676 . . . . 10.0 111.52 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.413 ' HB2' ' O ' ' A' ' 63' ' ' THR . 9.5 tmm? -61.89 -48.4 80.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.976 0.417 . . . . 10.0 111.164 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 57.6 mt -68.12 -31.35 70.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.319 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -62.24 -42.17 99.08 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.728 -0.471 . . . . 10.0 109.728 179.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' A' ' 74' ' ' ASP . 17.1 mmm-85 -60.6 -42.57 97.04 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.214 178.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 37.1 m0 -60.13 -55.29 35.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.59 -0.732 . . . . 10.0 111.07 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.49 -47.37 84.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.907 -179.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.46 -35.75 80.29 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -178.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.482 ' HB2' ' O ' ' A' ' 70' ' ' ARG . 0.4 OUTLIER -73.4 -23.97 60.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.756 0.312 . . . . 10.0 111.805 -179.211 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.4 t -108.63 7.15 26.45 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.854 -0.339 . . . . 10.0 111.555 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 65.2 t30 62.18 38.84 13.33 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.606 0.717 . . . . 10.0 110.374 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 68.3 mtp -111.08 173.6 6.26 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.219 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.405 ' HB2' ' HG3' ' A' ' 125' ' ' LYS . 88.6 mm-40 -108.15 158.72 17.18 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.531 -0.304 . . . . 10.0 110.252 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.7 tp -133.07 136.91 46.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.984 0.421 . . . . 10.0 110.891 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.578 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 3.9 m -124.12 97.64 5.43 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.709 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.544 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 4.6 t80 -86.06 97.41 10.28 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.742 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -104.65 29.35 6.25 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.943 0.401 . . . . 10.0 111.03 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.544 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 57.4 mt -89.12 146.87 37.23 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.45 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -57.64 -35.85 98.7 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.637 2.225 . . . . 10.0 111.856 179.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.0 m -151.31 155.98 39.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.904 -0.589 . . . . 10.0 109.924 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.417 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 37.7 t0 -77.84 130.83 37.14 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.603 -0.518 . . . . 10.0 109.603 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -104.73 140.04 38.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.03 0.443 . . . . 10.0 111.349 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 2.9 m -81.27 149.04 29.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.34 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.436 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -55.28 112.81 1.18 Allowed 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.872 0.368 . . . . 10.0 110.817 179.564 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 11.0 pt -65.19 -36.72 78.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.862 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 149.36 -71.5 0.3 Allowed Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.38 -0.914 . . . . 10.0 113.335 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -50.78 -17.74 3.47 Favored 'Trans proline' 0 N--CA 1.48 0.694 0 C-N-CA 123.775 2.984 . . . . 10.0 113.832 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.412 HG23 ' H ' ' A' ' 93' ' ' VAL . 0.4 OUTLIER -60.91 -37.26 76.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.118 0.485 . . . . 10.0 110.882 179.499 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.0 -9.08 57.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.494 -179.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -92.11 -0.93 57.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.164 0.507 . . . . 10.0 110.561 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.407 HD13 HD12 ' A' ' 108' ' ' LEU . 56.7 mt -100.34 116.39 43.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.962 -0.563 . . . . 10.0 109.525 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -142.49 95.48 2.8 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.736 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 11.9 t -130.91 154.32 48.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.449 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.02 -13.9 43.1 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.223 -0.444 . . . . 10.0 111.117 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.0 m -91.65 116.1 28.6 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.358 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.6 p -60.82 -36.48 71.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.351 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -67.56 -38.06 83.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.125 0.488 . . . . 10.0 109.893 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -67.35 -42.63 83.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.885 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.62 -47.73 81.37 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.348 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.31 -34.05 76.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.482 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 81.8 m -68.58 -50.91 48.13 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.078 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -64.04 -40.77 97.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.3 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.407 HD12 HD13 ' A' ' 96' ' ' ILE . 2.1 mp -63.56 -49.28 74.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.581 -0.281 . . . . 10.0 110.513 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.4 m -61.38 -29.19 69.76 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.499 0.185 . . . . 10.0 111.499 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.15 -42.39 98.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.906 0.384 . . . . 10.0 110.785 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.6 p -88.61 -37.67 10.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.38 0.61 . . . . 10.0 111.245 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.555 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.5 m-30 -72.65 -23.13 60.86 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 113.994 1.109 . . . . 10.0 113.994 -177.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.29 -36.93 33.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.568 0.223 . . . . 10.0 111.216 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.95 -32.23 70.38 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.948 0.404 . . . . 10.0 110.534 179.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -79.92 -9.85 59.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.439 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . 0.445 ' HA2' HG23 ' A' ' 131' ' ' VAL . . . 89.28 26.77 24.87 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.827 -0.624 . . . . 10.0 112.33 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.555 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 76.3 t -125.28 129.67 73.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.986 0.422 . . . . 10.0 111.053 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 8.0 t -127.46 113.07 15.7 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.288 -0.634 . . . . 10.0 109.288 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 2.6 m -102.28 135.72 37.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.168 0.509 . . . . 10.0 110.564 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -147.43 141.1 25.6 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.857 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.481 ' HB ' HD23 ' A' ' 126' ' ' LEU . 2.4 p -106.09 124.18 61.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-O 121.249 0.547 . . . . 10.0 109.68 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 64.5 m -142.47 123.12 14.18 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.72 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.4 51.33 5.39 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.811 -0.631 . . . . 10.0 111.48 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.6 m-20 57.41 28.87 16.04 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.815 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.578 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 50.5 tttt -136.29 131.82 34.91 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.321 -0.4 . . . . 10.0 109.991 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.481 HD23 ' HB ' ' A' ' 121' ' ' VAL . 37.7 mt -88.08 120.96 29.93 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.824 -0.806 . . . . 10.0 108.824 178.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -107.32 115.42 30.13 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.381 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.409 HG12 HD21 ' A' ' 83' ' ' LEU . 2.2 t -100.64 116.57 44.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 107.834 -1.173 . . . . 10.0 107.834 177.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -122.47 131.51 24.38 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 116.484 -0.325 . . . . 10.0 110.916 -177.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.434 ' HA ' ' O ' ' A' ' 116' ' ' GLY . 73.8 Cg_endo -79.07 131.85 10.13 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.122 1.881 . . . . 10.0 111.496 178.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.445 HG23 ' HA2' ' A' ' 116' ' ' GLY . 8.5 m . . . . . 0 C--N 1.317 -0.847 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.424 -179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 16.4 t80 . . . . . 0 N--CA 1.452 -0.351 0 CA-C-O 120.831 0.348 . . . . 10.0 111.08 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.0 m -81.0 106.22 12.84 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.819 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -77.46 100.11 5.89 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.24 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.448 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 3.0 tt0 -141.86 142.35 33.11 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.98 -1.009 . . . . 10.0 110.223 -178.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.462 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -74.96 122.09 22.94 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.149 -0.685 . . . . 10.0 109.149 178.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 22.1 p -94.33 141.37 23.45 Favored Pre-proline 0 C--N 1.318 -0.802 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.723 -179.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -70.26 0.72 5.61 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 122.63 2.22 . . . . 10.0 112.104 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 60.9 mtt -104.71 -6.3 20.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.737 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.54 ' OD1' ' HB ' ' A' ' 66' ' ' THR . 10.9 t70 -72.47 -69.57 0.4 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.831 0.348 . . . . 10.0 110.827 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.446 ' O ' HG22 ' A' ' 88' ' ' THR . . . 113.09 -42.35 1.98 Allowed Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.485 -0.865 . . . . 10.0 114.008 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 72.0 p -135.99 168.64 18.97 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 118.454 1.127 . . . . 10.0 113.664 -177.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.461 HD13 ' HE2' ' A' ' 112' ' ' TYR . 60.2 tp -69.67 -48.29 60.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.048 -0.978 . . . . 10.0 111.121 179.278 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.55 ' HD3' ' CD1' ' A' ' 81' ' ' TYR . 25.6 tptp -58.37 -50.16 74.64 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.82 -0.627 . . . . 10.0 111.293 -178.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.54 ' HB ' ' OD1' ' A' ' 61' ' ' ASP . 62.8 m -60.48 -40.77 92.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.705 0.288 . . . . 10.0 110.906 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 47.7 ttp -61.55 -48.04 82.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.951 0.405 . . . . 10.0 110.213 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 79.6 mt -63.87 -37.53 87.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.496 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -62.04 -44.03 97.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.561 178.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.83 -43.89 97.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.392 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.417 ' CZ3' HD11 ' A' ' 108' ' ' LEU . 44.4 m0 -63.76 -50.79 67.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.461 -0.79 . . . . 10.0 111.078 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.564 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -63.41 -47.86 80.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.561 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.25 -41.38 88.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.693 0.282 . . . . 10.0 111.427 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -64.96 -37.57 88.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.951 0.405 . . . . 10.0 111.366 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 7.4 p -91.04 5.59 48.28 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.642 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 63.1 t30 60.47 32.73 20.59 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.629 0.728 . . . . 10.0 110.219 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.44 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 17.4 mtm -107.08 168.57 9.11 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.42 -179.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -98.46 165.87 11.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.488 -0.324 . . . . 10.0 110.206 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 24.4 tp -133.86 131.23 38.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.123 0.487 . . . . 10.0 111.335 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -116.6 97.1 5.82 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.509 179.138 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.599 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 25.2 t80 -92.07 98.05 11.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.641 -0.708 . . . . 10.0 110.421 -179.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -101.23 20.95 14.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.907 0.384 . . . . 10.0 111.122 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.599 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 31.4 mt -80.94 143.21 53.07 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.036 179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -57.3 -45.4 35.15 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.674 2.249 . . . . 10.0 112.448 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.1 m -135.93 168.26 19.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.982 0.42 . . . . 10.0 110.884 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.424 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 0.4 OUTLIER -79.57 135.03 36.5 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.593 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -115.62 162.89 16.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.878 0.37 . . . . 10.0 111.153 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.446 HG22 ' O ' ' A' ' 62' ' ' GLY . 1.2 p -108.37 172.61 6.74 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.658 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.48 114.51 14.11 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.4 pt -62.41 -37.37 78.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.685 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 155.24 -71.73 0.26 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.551 -0.833 . . . . 10.0 112.805 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.33 -2.13 1.21 Allowed 'Trans proline' 0 N--CA 1.481 0.782 0 C-N-CA 123.649 2.899 . . . . 10.0 113.922 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.412 ' H ' HG23 ' A' ' 93' ' ' VAL . 2.3 t -65.8 -44.12 93.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.892 0.377 . . . . 10.0 110.451 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.462 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.7 OUTLIER -65.17 -8.96 19.45 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.028 -0.533 . . . . 10.0 112.053 179.421 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.67 -10.95 54.95 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.063 0.459 . . . . 10.0 110.496 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.448 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 23.8 mt -90.16 107.56 18.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -136.21 91.96 2.73 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.029 0.443 . . . . 10.0 111.088 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.0 t -132.33 155.76 47.81 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.58 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -90.75 -5.63 55.45 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.285 0.564 . . . . 10.0 110.567 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.6 t -95.67 115.58 27.63 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.508 HG13 HG11 ' A' ' 121' ' ' VAL . 13.9 p -64.1 -30.07 49.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.896 0.379 . . . . 10.0 110.405 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -68.71 -43.17 76.57 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.678 178.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -65.3 -42.62 92.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.989 178.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.66 -50.48 73.02 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.846 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.61 -35.2 77.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.235 0.54 . . . . 10.0 110.357 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 99.4 m -66.01 -49.72 66.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.74 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -63.32 -40.57 97.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.487 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.417 HD11 ' CZ3' ' A' ' 71' ' ' TRP . 83.5 mt -61.33 -49.86 75.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.568 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.2 m -59.29 -27.7 66.09 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.48 -42.57 78.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.972 0.415 . . . . 10.0 111.232 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -87.98 -29.6 5.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.971 0.415 . . . . 10.0 111.874 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.541 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.6 m-30 -81.07 -22.69 39.04 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 114.0 1.111 . . . . 10.0 114.0 -177.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.27 -30.23 11.37 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 111.74 0.274 . . . . 10.0 111.74 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.76 -39.6 73.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.056 0.455 . . . . 10.0 110.739 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 -74.91 -24.09 58.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.112 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . 0.433 ' HA2' HG23 ' A' ' 131' ' ' VAL . . . 103.86 35.11 3.57 Favored Glycine 0 N--CA 1.445 -0.739 0 CA-C-N 115.515 -0.766 . . . . 10.0 112.381 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.541 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 94.8 t -131.35 129.54 62.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.08 0.467 . . . . 10.0 111.116 -179.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.1 m -130.0 118.84 22.21 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.462 ' CG1' HG13 ' A' ' 128' ' ' VAL . 9.2 m -112.44 136.83 47.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.224 0.535 . . . . 10.0 112.04 -177.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 73.1 m -145.0 140.12 27.94 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.798 -0.637 . . . . 10.0 109.723 179.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.508 HG11 HG13 ' A' ' 101' ' ' VAL . 2.5 p -102.05 128.83 54.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.856 -0.424 . . . . 10.0 109.856 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.1 m -151.12 130.88 13.18 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.223 -0.444 . . . . 10.0 111.06 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 59.33 45.63 13.71 Favored 'General case' 0 C--O 1.235 0.298 0 O-C-N 123.684 0.615 . . . . 10.0 111.842 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.44 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 92.4 m-20 59.7 33.85 21.97 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.505 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.94 131.44 27.02 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.26 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.564 HD12 ' HB2' ' A' ' 72' ' ' ALA . 18.6 mt -89.53 120.97 31.3 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 107.587 -1.264 . . . . 10.0 107.587 177.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.86 119.91 40.95 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.306 0.574 . . . . 10.0 111.179 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.462 HG13 ' CG1' ' A' ' 119' ' ' VAL . 3.2 t -106.42 118.57 54.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-N 115.246 -0.888 . . . . 10.0 108.827 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -131.17 138.3 32.59 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-O 120.768 0.318 . . . . 10.0 110.782 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.49 138.71 13.95 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.2 1.933 . . . . 10.0 111.68 178.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.433 HG23 ' HA2' ' A' ' 116' ' ' GLY . 0.2 OUTLIER . . . . . 0 C--N 1.321 -0.665 0 N-CA-C 110.041 -0.355 . . . . 10.0 110.041 179.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 29.1 t80 . . . . . 0 N--CA 1.453 -0.324 0 CA-C-O 120.766 0.317 . . . . 10.0 110.762 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.9 m -75.1 110.93 9.83 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 121.194 0.521 . . . . 10.0 110.233 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -89.31 98.87 12.01 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.188 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -134.56 147.14 50.2 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.006 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.41 ' HB2' ' SD ' ' A' ' 67' ' ' MET . . . -74.77 121.0 21.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.74 0.305 . . . . 10.0 110.418 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.425 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 81.3 p -107.1 158.47 32.89 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.354 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.425 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 50.6 Cg_endo -68.54 -4.14 12.46 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.286 1.991 . . . . 10.0 112.036 179.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 61.6 mtt -92.28 -18.66 23.08 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.825 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -73.12 -55.64 6.2 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.419 0.628 . . . . 10.0 109.686 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 88.71 -64.21 3.46 Favored Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.595 -0.73 . . . . 10.0 113.347 178.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 15.7 p -117.57 165.59 13.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.04 0.447 . . . . 10.0 112.088 -178.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.523 HD13 ' CE2' ' A' ' 112' ' ' TYR . 55.0 tp -57.89 -42.32 84.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.118 -0.946 . . . . 10.0 110.565 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.4 ' O ' ' HG3' ' A' ' 69' ' ' GLU . 58.0 tttt -60.89 -57.84 10.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.847 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.18 -38.38 73.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.165 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.41 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 51.7 ttp -63.52 -51.67 64.51 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.628 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 98.6 mt -64.2 -36.96 85.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.091 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 51.9 mt-10 -63.5 -38.86 92.76 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.206 0.526 . . . . 10.0 110.087 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? -71.65 -32.13 67.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.216 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 38.6 m0 -70.98 -55.12 9.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.754 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.05 -28.5 69.64 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.711 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.13 -35.57 81.2 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.024 0.379 . . . . 10.0 112.024 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -68.79 -37.81 79.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.86 0.362 . . . . 10.0 111.195 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.431 ' HB2' ' HG3' ' A' ' 77' ' ' MET . 0.1 OUTLIER -95.29 6.77 48.13 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.471 -179.284 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 63.9 t30 55.58 46.7 22.36 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.591 0.71 . . . . 10.0 110.577 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.431 ' HG3' ' HB2' ' A' ' 75' ' ' SER . 22.1 mtm -111.1 165.67 11.7 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.324 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -98.81 154.47 17.98 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.32 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.9 tp -124.72 131.42 53.46 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.312 0.577 . . . . 10.0 110.5 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 61.8 m -113.03 96.21 5.82 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.104 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.506 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 15.9 t80 -91.31 98.47 11.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.695 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -101.37 30.76 4.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.98 0.419 . . . . 10.0 111.175 -179.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.506 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 43.8 mt -97.43 146.96 32.28 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.048 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -56.43 -41.63 74.13 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.943 2.429 . . . . 10.0 112.633 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 30.4 m -143.45 167.6 21.8 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.697 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.472 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 12.5 p-10 -83.9 129.04 34.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.012 -0.54 . . . . 10.0 109.636 179.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -105.27 136.98 43.79 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.775 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 1.3 p -76.09 155.4 34.77 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.999 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -56.74 116.43 3.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.511 -0.313 . . . . 10.0 110.179 178.865 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.2 pt -63.06 -33.88 63.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.711 -179.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 142.73 -67.48 0.46 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.471 -0.871 . . . . 10.0 113.157 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.71 -2.93 1.22 Allowed 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.838 3.025 . . . . 10.0 114.137 -179.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.436 HG23 ' H ' ' A' ' 93' ' ' VAL . 0.3 OUTLIER -68.7 -36.74 75.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.299 0.571 . . . . 10.0 110.274 179.577 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 22.8 m -72.64 -9.04 58.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.825 -0.625 . . . . 10.0 111.559 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.22 -1.35 56.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.499 0.666 . . . . 10.0 109.917 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.518 HD13 HD12 ' A' ' 108' ' ' LEU . 19.6 mt -106.07 105.56 18.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.261 -0.881 . . . . 10.0 109.931 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -124.95 89.59 3.09 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.148 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.9 t -121.98 153.78 38.08 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.969 0.414 . . . . 10.0 111.089 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -92.94 -7.22 46.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.722 179.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.1 m -103.78 116.66 32.71 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.022 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.1 p -60.59 -32.5 51.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.712 -0.222 . . . . 10.0 111.352 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -67.1 -40.79 86.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.857 0.36 . . . . 10.0 110.176 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -65.06 -41.2 95.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.11 -0.495 . . . . 10.0 109.939 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.42 -51.45 66.83 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.581 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.51 -32.47 73.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.197 0.522 . . . . 10.0 110.813 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 88.3 m -66.83 -49.21 66.49 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.575 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -69.73 -37.23 76.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.947 -0.57 . . . . 10.0 111.353 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.518 HD12 HD13 ' A' ' 96' ' ' ILE . 3.4 mp -61.47 -49.41 76.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.962 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.0 m -59.22 -30.28 68.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.556 -0.293 . . . . 10.0 111.706 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.73 -47.05 79.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.901 0.381 . . . . 10.0 111.178 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.54 HG13 ' HD1' ' A' ' 112' ' ' TYR . 3.9 p -82.26 -35.89 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.139 0.495 . . . . 10.0 111.339 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.54 ' HD1' HG13 ' A' ' 111' ' ' VAL . 3.3 m-30 -72.06 -23.9 61.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.934 -0.575 . . . . 10.0 112.469 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -51.27 -31.33 20.77 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.892 0.33 . . . . 10.0 111.892 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.81 -20.9 57.84 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.144 0.497 . . . . 10.0 111.268 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 6.0 mm100 -94.69 -7.98 39.13 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.416 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 90.57 24.82 27.28 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-N 115.686 -0.688 . . . . 10.0 112.364 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.424 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 56.1 t -126.43 141.89 44.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.751 0.31 . . . . 10.0 111.0 -179.258 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 29.2 m -141.61 138.88 32.89 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 9.0 m -127.92 152.93 36.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.191 0.52 . . . . 10.0 111.872 -178.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.0 m -154.01 158.82 41.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.237 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.517 HG22 ' CD2' ' A' ' 126' ' ' LEU . 5.5 t -113.42 114.86 48.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.538 -0.912 . . . . 10.0 108.538 178.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 13.7 m -132.34 116.03 16.35 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.597 -0.274 . . . . 10.0 111.124 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.45 51.68 5.12 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.848 -0.614 . . . . 10.0 111.121 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.8 m120 54.95 38.09 29.89 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.05 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -141.5 132.14 25.56 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.509 -0.769 . . . . 10.0 109.164 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.517 ' CD2' HG22 ' A' ' 121' ' ' VAL . 89.8 mt -88.96 121.61 31.49 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 109.303 -0.629 . . . . 10.0 109.303 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -108.03 115.76 30.72 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.947 -179.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.8 t -102.98 118.65 50.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 N-CA-C 108.321 -0.992 . . . . 10.0 108.321 178.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -133.78 138.4 30.82 Favored Pre-proline 0 C--N 1.317 -0.809 0 CA-C-O 120.841 0.353 . . . . 10.0 110.539 -178.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.06 146.39 25.56 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.212 1.942 . . . . 10.0 111.683 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.322 -0.617 0 N-CA-C 109.736 -0.468 . . . . 10.0 109.736 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.9 t80 . . . . . 0 N--CA 1.452 -0.371 0 CA-C-O 120.705 0.288 . . . . 10.0 110.719 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 60.4 m -72.66 113.8 10.1 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.216 0.531 . . . . 10.0 109.959 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -81.14 114.0 19.68 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.091 -0.959 . . . . 10.0 109.627 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -148.17 154.68 40.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.185 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.55 107.82 14.62 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.702 -0.481 . . . . 10.0 109.702 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.472 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 21.4 p -100.1 158.21 32.44 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.96 -178.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.472 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 40.5 Cg_endo -66.6 -8.43 21.0 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.904 2.403 . . . . 10.0 112.421 179.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 26.4 mmt -90.97 -7.62 51.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.035 0.445 . . . . 10.0 110.507 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -87.9 -58.78 2.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.391 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.31 -58.4 4.91 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.418 -0.896 . . . . 10.0 113.275 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 28.9 p -121.49 168.16 12.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.044 0.449 . . . . 10.0 111.801 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.444 HD22 ' HE2' ' A' ' 112' ' ' TYR . 59.4 tp -61.81 -37.41 84.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.251 -0.886 . . . . 10.0 110.712 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -61.7 -55.12 33.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.198 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.26 -41.96 90.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.074 0.464 . . . . 10.0 111.109 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 47.8 ttp -61.0 -53.2 60.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.811 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 87.6 mt -63.67 -36.23 83.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.029 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.438 ' OE2' HD23 ' A' ' 79' ' ' LEU . 44.2 mm-40 -59.29 -44.86 92.46 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.985 -0.376 . . . . 10.0 109.985 178.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -63.81 -45.29 90.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.36 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 42.8 m0 -57.41 -49.08 77.37 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.54 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.87 -50.01 58.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.446 -0.797 . . . . 10.0 111.761 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.29 -45.55 87.73 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.273 0.471 . . . . 10.0 112.273 -178.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -64.17 -35.68 81.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.026 0.441 . . . . 10.0 111.237 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.6 m -90.67 5.14 49.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.044 -0.525 . . . . 10.0 111.57 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 59.75 41.4 18.37 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.093 0.473 . . . . 10.0 111.218 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.479 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 24.0 mtm -117.94 173.18 6.92 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.655 -0.702 . . . . 10.0 109.913 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -105.13 161.0 14.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.626 -0.261 . . . . 10.0 110.795 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.438 HD23 ' OE2' ' A' ' 69' ' ' GLU . 20.1 tp -132.15 134.61 45.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.375 0.607 . . . . 10.0 111.22 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 19.7 m -118.57 96.14 5.15 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.054 -0.975 . . . . 10.0 110.07 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.455 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 17.8 t80 -89.96 97.78 11.39 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.128 -0.693 . . . . 10.0 109.128 179.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -107.19 48.44 0.84 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.556 0.693 . . . . 10.0 110.53 -179.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.455 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 38.5 mt -108.31 153.96 41.66 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.206 -0.906 . . . . 10.0 109.329 179.258 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -59.33 -38.19 86.21 Favored 'Trans proline' 0 CA--C 1.529 0.239 0 C-N-CA 122.568 2.179 . . . . 10.0 112.465 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.8 m -152.15 169.67 21.86 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.08 -0.341 . . . . 10.0 110.08 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.422 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 7.7 p-10 -78.4 143.51 36.74 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.816 -0.439 . . . . 10.0 109.816 178.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -121.15 138.72 54.07 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.466 -0.334 . . . . 10.0 111.017 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.7 OUTLIER -81.61 158.93 24.18 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.394 179.301 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.62 133.77 55.37 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.047 -0.353 . . . . 10.0 110.047 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.0 pt -78.35 -29.82 15.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 112.437 0.532 . . . . 10.0 112.437 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 144.34 -64.92 0.46 Allowed Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.043 -1.075 . . . . 10.0 113.74 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -68.16 6.78 0.76 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 123.227 2.618 . . . . 10.0 113.762 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.429 ' HA ' HD12 ' A' ' 96' ' ' ILE . 2.9 t -76.88 -38.23 28.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.105 0.479 . . . . 10.0 110.115 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 41.8 m -67.69 -15.72 63.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.141 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -79.71 -9.83 59.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.149 0.499 . . . . 10.0 110.329 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.429 HD12 ' HA ' ' A' ' 93' ' ' VAL . 28.8 mt -94.78 113.51 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.8 m -139.13 93.89 2.74 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.93 -179.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 15.3 t -131.21 155.67 46.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.481 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.88 -6.34 54.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.169 0.509 . . . . 10.0 111.101 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.4 m -100.68 114.95 29.12 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.559 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.1 p -62.37 -30.92 50.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.183 -178.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -68.17 -40.85 82.17 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -67.03 -39.38 86.98 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.359 -0.608 . . . . 10.0 109.359 178.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.18 -50.33 74.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.266 178.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.63 -33.54 74.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.15 0.5 . . . . 10.0 110.396 179.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 97.8 m -64.5 -50.61 66.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.404 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -66.03 -44.15 85.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.85 -0.613 . . . . 10.0 110.173 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -54.2 -54.24 42.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.633 -0.712 . . . . 10.0 110.953 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.7 m -62.06 -34.71 76.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.415 -0.357 . . . . 10.0 111.74 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.73 -37.1 80.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.151 0.501 . . . . 10.0 111.133 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 16.0 t -87.87 -49.29 14.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.2 0.524 . . . . 10.0 111.023 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.445 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.4 m-30 -62.25 -23.89 66.94 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.598 0.962 . . . . 10.0 113.598 -178.09 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -54.96 -22.99 16.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.743 0.306 . . . . 10.0 111.14 179.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.06 -37.36 75.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.133 0.492 . . . . 10.0 110.474 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 -85.62 -23.1 27.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.46 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 107.54 30.73 3.96 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.63 -0.795 . . . . 10.0 113.034 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.445 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 86.9 t -125.09 135.5 63.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.776 0.322 . . . . 10.0 110.5 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 5.2 m -131.38 132.18 44.22 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.222 -0.444 . . . . 10.0 109.891 178.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 11.7 m -122.77 140.97 44.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.052 -178.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.0 m -145.41 163.47 34.52 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.408 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.473 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.3 t -118.59 127.75 75.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.551 -0.536 . . . . 10.0 109.551 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 20.3 m -145.58 119.33 9.23 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.7 -0.227 . . . . 10.0 111.061 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 58.39 48.6 12.07 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.206 0.602 . . . . 10.0 112.146 179.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.479 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 89.3 m-20 60.1 38.33 20.51 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.804 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -145.85 135.35 23.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.718 -0.674 . . . . 10.0 109.58 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.473 ' CD2' HG22 ' A' ' 121' ' ' VAL . 75.2 mt -92.27 123.34 35.53 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.189 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -106.38 116.9 32.73 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.297 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.9 t -105.73 119.67 55.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 179.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -134.78 140.14 34.39 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.824 -178.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -80.44 140.41 13.49 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 122.235 1.956 . . . . 10.0 111.275 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 3.9 m . . . . . 0 C--N 1.323 -0.574 0 C-N-CA 120.96 -0.296 . . . . 10.0 110.935 179.893 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 27.2 t80 . . . . . 0 N--CA 1.453 -0.289 0 N-CA-C 110.199 -0.297 . . . . 10.0 110.199 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 13.2 m -77.24 123.11 26.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.495 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -92.15 117.4 29.82 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -158.61 165.61 34.05 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.595 -179.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.817 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -78.56 124.48 28.2 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.717 -0.846 . . . . 10.0 108.717 177.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.431 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 44.8 p -104.86 163.48 17.1 Favored Pre-proline 0 C--N 1.313 -0.982 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.748 -178.097 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.431 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 95.6 Cg_endo -80.53 12.26 2.63 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 121.787 1.658 . . . . 10.0 112.074 178.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 21.4 ptm -112.32 -18.35 12.52 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.76 -62.89 1.19 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.835 0.35 . . . . 10.0 111.517 -179.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.0 -49.37 1.4 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.511 -0.852 . . . . 10.0 112.129 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 32.5 p -130.74 168.92 16.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 117.028 0.414 . . . . 10.0 110.511 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.55 HD13 ' HE2' ' A' ' 112' ' ' TYR . 59.8 tp -57.49 -44.77 85.23 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.271 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -59.23 -53.49 57.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.835 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -33.32 71.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.482 -0.326 . . . . 10.0 111.677 -179.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 51.3 ttp -69.23 -49.96 51.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.101 0.477 . . . . 10.0 110.042 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.4 mt -65.11 -33.9 77.12 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.655 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -61.34 -39.77 91.79 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 178.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -65.89 -42.14 90.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.005 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 43.0 m0 -62.46 -51.85 65.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.174 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.441 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -63.0 -44.99 94.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.57 -0.741 . . . . 10.0 111.838 -179.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.02 -47.83 84.6 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 111.796 0.295 . . . . 10.0 111.796 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.04 -20.23 62.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.912 0.387 . . . . 10.0 111.36 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.5 t -96.93 -1.81 45.0 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.317 -0.402 . . . . 10.0 110.738 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 9.8 m120 60.44 41.39 16.03 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.525 0.679 . . . . 10.0 110.172 -179.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 26.8 mtm -121.17 168.82 11.16 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.303 -0.862 . . . . 10.0 110.453 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -98.42 160.52 14.23 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.084 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 34.5 tp -129.44 134.15 47.68 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.78 0.324 . . . . 10.0 110.577 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.475 ' HB2' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -121.14 97.37 5.49 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.027 179.157 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.574 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 20.6 t80 -84.12 98.22 9.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.556 -0.747 . . . . 10.0 109.587 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.51 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 84.8 m-20 -100.38 37.54 1.66 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.073 0.463 . . . . 10.0 110.462 -179.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.574 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 26.6 mt -103.42 150.83 38.4 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 116.062 -0.517 . . . . 10.0 109.868 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -64.65 -34.48 51.25 Favored 'Trans proline' 0 CA--C 1.531 0.326 0 C-N-CA 122.579 2.186 . . . . 10.0 112.939 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.9 m -148.05 172.68 13.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.666 0.27 . . . . 10.0 110.752 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -83.88 130.99 34.9 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.273 -0.64 . . . . 10.0 109.273 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -114.78 149.84 36.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.964 0.411 . . . . 10.0 111.309 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.96 169.46 11.2 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.219 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.62 129.7 38.21 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 178.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 pt -67.1 -28.55 43.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 112.084 0.401 . . . . 10.0 112.084 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 145.8 -70.75 0.36 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.525 -0.845 . . . . 10.0 112.905 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.92 5.14 0.68 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.237 2.625 . . . . 10.0 113.435 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 3.8 t -67.68 -39.23 81.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.034 0.445 . . . . 10.0 110.185 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.817 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 9.1 m -68.19 -11.06 58.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.375 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -88.77 -6.68 57.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.889 0.376 . . . . 10.0 110.628 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 42.1 mt -93.93 107.52 19.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 N-CA-C 109.156 -0.683 . . . . 10.0 109.156 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.0 m -141.17 104.74 4.69 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.4 t -132.42 157.2 45.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.107 -0.497 . . . . 10.0 109.785 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.78 -11.71 47.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.848 0.356 . . . . 10.0 111.613 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.6 m -98.38 118.57 35.34 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.212 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.46 -32.69 54.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.748 0.309 . . . . 10.0 111.342 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -66.93 -43.2 83.88 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -66.91 -40.31 87.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.769 179.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.08 -46.72 75.48 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.364 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.01 -36.36 84.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.166 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 39.0 m -64.85 -50.64 65.84 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.886 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -66.12 -44.43 84.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.398 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.439 ' HB3' ' CG2' ' A' ' 119' ' ' VAL . 3.2 tp -58.07 -48.1 81.17 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 120.945 0.402 . . . . 10.0 110.165 179.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 70.4 m -61.46 -31.2 71.16 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.686 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.4 -39.45 94.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.15 0.5 . . . . 10.0 110.953 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.1 t -86.91 -34.91 7.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.926 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.55 ' HE2' HD13 ' A' ' 64' ' ' LEU . 3.6 m-30 -79.75 -23.87 41.95 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 113.576 0.954 . . . . 10.0 113.576 -177.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.46 -42.23 42.56 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.059 0.392 . . . . 10.0 112.059 -179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.36 -21.91 62.84 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.032 0.444 . . . . 10.0 111.336 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -87.83 -12.83 43.81 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.591 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 96.46 18.71 29.83 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.954 -0.641 . . . . 10.0 112.392 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.462 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 57.6 t -123.52 137.37 56.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.881 0.372 . . . . 10.0 111.005 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.1 m -138.52 122.3 17.61 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.543 -0.539 . . . . 10.0 109.543 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.439 ' CG2' ' HB3' ' A' ' 108' ' ' LEU . 6.0 m -107.16 139.56 28.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.941 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 37.2 m -149.58 144.02 25.95 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.409 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 2.1 p -106.08 122.24 59.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 44.7 m -140.4 124.34 17.4 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.415 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 62.73 46.58 5.16 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.68 0.613 . . . . 10.0 110.839 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 20.3 m-20 54.02 40.78 31.97 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.823 0.821 . . . . 10.0 110.394 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.472 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 57.2 tttt -143.08 129.06 19.57 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.809 -1.087 . . . . 10.0 108.929 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.441 HD12 ' HB2' ' A' ' 72' ' ' ALA . 21.7 mt -88.45 122.22 31.69 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.475 HD22 ' HB2' ' A' ' 80' ' ' SER . 14.8 mt -114.25 134.18 55.11 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 120.971 0.415 . . . . 10.0 110.52 -178.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.51 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 2.5 t -111.39 119.03 58.88 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 108.293 -1.003 . . . . 10.0 108.293 178.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -125.63 135.88 27.57 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-O 120.776 0.322 . . . . 10.0 110.969 -178.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -79.72 134.83 11.12 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.194 1.929 . . . . 10.0 111.682 178.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.8 m . . . . . 0 C--N 1.321 -0.636 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.61 179.841 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.6 t80 . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 120.943 0.401 . . . . 10.0 111.039 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.5 m -87.1 117.73 26.02 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.414 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -83.3 123.53 29.71 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.385 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -155.53 149.76 25.8 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.047 -0.524 . . . . 10.0 109.969 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.476 ' HB2' ' SD ' ' A' ' 67' ' ' MET . . . -84.8 130.22 34.71 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.786 0.327 . . . . 10.0 110.529 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 48.0 p -107.74 153.72 41.35 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.052 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.55 5.92 2.18 Favored 'Trans proline' 0 CA--C 1.53 0.308 0 C-N-CA 122.386 2.058 . . . . 10.0 111.819 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.3 mtt -105.97 -12.42 15.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.752 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -69.05 -52.04 32.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.019 0.437 . . . . 10.0 110.505 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 97.74 -68.46 0.75 Allowed Glycine 0 N--CA 1.444 -0.806 0 C-N-CA 120.511 -0.852 . . . . 10.0 112.816 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.433 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 67.6 p -126.83 170.34 12.3 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.084 0.469 . . . . 10.0 112.199 -178.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 54.1 tp -57.38 -43.06 83.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.898 -1.046 . . . . 10.0 110.764 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -59.94 -52.44 65.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.945 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -43.05 91.5 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.256 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.476 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 50.8 ttp -63.36 -52.33 62.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.69 -0.686 . . . . 10.0 111.117 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.426 ' HB3' HD13 ' A' ' 79' ' ' LEU . 74.9 mt -62.51 -36.78 83.65 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.31 -0.404 . . . . 10.0 111.24 -179.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -60.01 -44.01 94.84 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.7 ttm180 -65.27 -41.76 93.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.467 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 42.7 m0 -61.48 -50.2 73.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.567 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -68.41 -36.6 79.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.702 -179.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.1 -41.1 87.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.518 -0.31 . . . . 10.0 111.813 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -56.28 -39.56 72.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.572 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.415 ' HB2' ' HG3' ' A' ' 77' ' ' MET . 67.7 m -101.8 14.09 32.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.447 -0.342 . . . . 10.0 111.792 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 54.99 38.08 29.94 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.068 0.461 . . . . 10.0 111.252 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.415 ' HG3' ' HB2' ' A' ' 75' ' ' SER . 11.8 mtm -95.88 173.15 7.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.931 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.465 ' HB2' ' HG3' ' A' ' 125' ' ' LYS . 14.0 mt-30 -103.88 156.42 17.85 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.945 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.426 HD13 ' HB3' ' A' ' 68' ' ' LEU . 23.8 tp -128.52 132.79 48.31 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.089 0.471 . . . . 10.0 110.186 178.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.44 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 75.6 m -120.16 97.16 5.46 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.398 -0.819 . . . . 10.0 110.852 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.564 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 9.0 t80 -87.03 98.5 11.31 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.848 -0.614 . . . . 10.0 110.283 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.531 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 37.0 m-80 -99.83 21.97 11.77 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.07 0.462 . . . . 10.0 110.701 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.564 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 41.8 mt -90.27 141.5 27.66 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.672 179.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -61.88 -34.1 82.7 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.695 2.264 . . . . 10.0 112.82 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -138.95 165.63 26.59 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.872 0.368 . . . . 10.0 110.951 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.433 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 6.5 m-20 -86.44 136.62 33.04 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -119.22 140.03 50.9 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.252 -0.579 . . . . 10.0 111.496 -179.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.433 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.8 OUTLIER -79.92 158.13 26.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.06 179.405 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.45 122.63 15.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.988 0.423 . . . . 10.0 110.313 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.553 HD13 ' NE2' ' A' ' 115' ' ' GLN . 4.7 pt -62.5 -30.77 49.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.788 -0.642 . . . . 10.0 111.878 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 140.64 -65.76 0.51 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.452 -0.88 . . . . 10.0 113.152 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -60.88 -5.55 4.84 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.37 2.713 . . . . 10.0 113.604 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.431 ' H ' HG23 ' A' ' 93' ' ' VAL . 1.6 t -64.16 -39.26 84.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.277 0.561 . . . . 10.0 109.91 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 66.0 m -71.72 -6.14 39.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.419 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.2 -8.42 39.36 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.27 0.557 . . . . 10.0 110.156 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.512 HD13 HD12 ' A' ' 108' ' ' LEU . 56.2 mt -92.74 109.49 21.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.16 -0.682 . . . . 10.0 109.16 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -131.72 95.37 3.71 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.016 -178.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.8 t -131.1 156.25 45.56 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.869 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.49 -10.52 43.35 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 121.13 0.49 . . . . 10.0 110.311 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 29.6 t -96.01 118.54 32.81 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.351 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 11.0 p -64.22 -30.23 49.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.088 0.47 . . . . 10.0 110.295 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -69.77 -44.62 69.76 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.49 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -63.18 -41.62 99.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.868 179.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.46 -49.38 76.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.607 179.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.28 -37.26 84.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.069 0.461 . . . . 10.0 110.488 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 91.1 m -64.94 -48.79 72.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.544 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -64.63 -40.76 96.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.934 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.512 HD12 HD13 ' A' ' 96' ' ' ILE . 3.0 mp -60.71 -53.97 50.93 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 116.153 -0.476 . . . . 10.0 109.85 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.8 m -55.85 -30.83 62.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.579 0.228 . . . . 10.0 111.54 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.32 -44.12 92.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.767 0.318 . . . . 10.0 111.098 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.475 HG13 ' HD1' ' A' ' 112' ' ' TYR . 8.7 p -90.15 -21.85 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 121.008 0.432 . . . . 10.0 111.929 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.475 ' HD1' HG13 ' A' ' 111' ' ' VAL . 6.3 m-85 -82.41 -25.04 34.05 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.461 0.541 . . . . 10.0 112.461 -179.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -52.68 -33.7 48.55 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.119 0.414 . . . . 10.0 112.119 -179.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.48 -25.64 67.58 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.811 0.339 . . . . 10.0 111.383 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . 0.553 ' NE2' HD13 ' A' ' 90' ' ' ILE . 1.8 mp0 -92.07 -19.9 21.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.191 0.519 . . . . 10.0 109.682 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.82 30.27 6.17 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.496 -0.775 . . . . 10.0 112.428 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 94.4 t -125.83 140.05 49.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.899 0.381 . . . . 10.0 110.753 -179.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 9.5 m -137.03 131.8 33.34 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.16 -0.473 . . . . 10.0 109.821 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 127' ' ' LEU . 6.4 m -122.95 140.01 47.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.014 0.435 . . . . 10.0 111.165 -178.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.6 m -144.69 163.55 33.66 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.504 -0.316 . . . . 10.0 110.517 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.525 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.2 t -116.65 115.19 48.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.414 -0.588 . . . . 10.0 109.414 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 19.9 m -136.39 116.65 13.55 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.608 -0.269 . . . . 10.0 110.728 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 59.0 54.25 5.12 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.716 -0.675 . . . . 10.0 111.768 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 55.42 33.53 21.11 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.763 -0.653 . . . . 10.0 111.569 179.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.465 ' HG3' ' HB2' ' A' ' 78' ' ' GLN . 19.4 tttt -138.83 130.79 27.96 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.382 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.525 ' CD2' HG22 ' A' ' 121' ' ' VAL . 91.1 mt -89.6 121.82 32.16 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.873 -0.788 . . . . 10.0 108.873 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.425 ' O ' ' HA ' ' A' ' 119' ' ' VAL . 4.0 mm? -103.01 115.68 31.07 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.872 -178.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.531 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 3.6 t -105.93 117.82 52.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 107.57 -1.27 . . . . 10.0 107.57 177.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -136.42 142.83 40.95 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-O 120.699 0.285 . . . . 10.0 111.186 -178.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -81.54 130.56 7.0 Favored 'Trans proline' 0 N--CA 1.451 -0.981 0 C-N-CA 122.269 1.979 . . . . 10.0 111.028 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 1.7 m . . . . . 0 C--N 1.316 -0.856 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.547 -179.586 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.1 t80 . . . . . 0 N--CA 1.452 -0.348 0 CA-C-O 120.724 0.297 . . . . 10.0 110.412 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.5 m -77.24 115.56 17.12 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.568 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.51 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 93.0 m-85 -85.87 115.72 23.68 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.915 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.415 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 10.7 pt20 -146.36 160.32 42.2 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.52 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.427 ' HB2' ' SD ' ' A' ' 67' ' ' MET . . . -92.7 114.81 27.47 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.158 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.9 p -97.09 153.91 38.33 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 116.408 -0.36 . . . . 10.0 110.836 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -65.42 -16.43 54.18 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.399 2.066 . . . . 10.0 111.638 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 19.0 ptt? -86.2 -6.5 58.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.701 -0.681 . . . . 10.0 110.682 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -79.44 -56.99 3.92 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.187 -0.671 . . . . 10.0 109.187 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 92.86 -69.07 1.69 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.849 -0.691 . . . . 10.0 113.229 178.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 35.5 p -118.91 166.22 13.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.179 0.514 . . . . 10.0 111.993 -178.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.523 HD13 ' CE2' ' A' ' 112' ' ' TYR . 61.4 tp -56.64 -40.69 75.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.852 -1.067 . . . . 10.0 111.06 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -61.53 -51.98 66.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.716 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.97 -40.29 95.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.004 0.43 . . . . 10.0 111.318 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.427 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 54.4 ttp -62.2 -53.67 51.89 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.131 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.7 mt -63.82 -33.65 76.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.024 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.11 -43.24 91.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.327 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.3 ttm-85 -67.7 -44.31 78.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.481 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 40.2 m0 -56.65 -52.3 65.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.037 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.77 -45.42 82.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.555 -179.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.92 -40.54 93.56 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.736 0.303 . . . . 10.0 111.62 -179.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -60.62 -41.85 95.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.163 -0.472 . . . . 10.0 111.425 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 20.0 m -98.94 12.32 36.25 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.229 0.455 . . . . 10.0 112.229 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 57.66 41.14 25.88 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.371 0.605 . . . . 10.0 111.389 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 60.3 mtp -104.27 173.48 6.29 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.023 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -104.94 158.06 16.79 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.511 -0.313 . . . . 10.0 110.769 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 19.8 tp -129.5 136.24 49.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.412 0.625 . . . . 10.0 111.577 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.463 ' HB2' ' HG ' ' A' ' 127' ' ' LEU . 1.8 m -124.22 95.34 4.51 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.036 -0.984 . . . . 10.0 109.525 179.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.524 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 12.6 t80 -91.79 97.88 11.27 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.537 -0.542 . . . . 10.0 109.537 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 38.9 m-80 -101.26 31.33 3.73 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.149 0.499 . . . . 10.0 111.065 -178.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.524 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 64.2 mt -96.03 140.54 22.32 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.59 -30.83 93.13 Favored 'Trans proline' 0 N--CA 1.466 -0.137 0 C-N-CA 122.778 2.319 . . . . 10.0 112.187 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 17.0 m -149.88 170.5 18.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.224 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.463 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 4.9 p-10 -87.06 147.28 25.75 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.953 -0.567 . . . . 10.0 109.699 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -124.55 141.22 52.25 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.71 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -83.9 151.15 25.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.093 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -56.05 120.77 8.0 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.125 178.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.435 HD13 ' NE2' ' A' ' 115' ' ' GLN . 3.2 pt -67.96 -29.62 45.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 112.567 0.58 . . . . 10.0 112.567 -179.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.421 ' H ' HG23 ' A' ' 93' ' ' VAL . . . 140.35 -65.27 0.52 Allowed Glycine 0 CA--C 1.521 0.427 0 C-N-CA 120.577 -0.82 . . . . 10.0 112.789 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.59 -0.85 2.72 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.913 2.409 . . . . 10.0 112.89 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.421 HG23 ' H ' ' A' ' 91' ' ' GLY . 2.0 t -67.34 -38.21 80.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.118 0.485 . . . . 10.0 109.907 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 74.3 m -68.83 -11.69 60.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.543 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -84.16 -6.75 59.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.164 0.507 . . . . 10.0 110.064 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.415 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 34.8 mt -94.76 105.25 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-N 115.782 -0.645 . . . . 10.0 109.6 179.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.0 m -139.5 96.02 3.02 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.374 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.0 t -131.32 156.32 45.69 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.59 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.54 -13.41 51.89 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.085 0.469 . . . . 10.0 110.753 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.9 t -94.49 114.69 26.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.105 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.51 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 9.3 p -65.07 -30.99 52.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.993 0.425 . . . . 10.0 109.943 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -67.78 -43.27 80.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.79 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -66.79 -40.38 88.1 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.272 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.92 -50.81 67.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.751 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.93 -31.51 72.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.918 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 54.4 m -66.69 -45.42 78.89 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.156 0.503 . . . . 10.0 110.395 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -71.23 -41.33 70.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.714 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 19.2 mt -58.07 -48.66 79.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 10.0 111.391 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.434 ' O ' ' HB2' ' A' ' 113' ' ' ALA . 4.9 p -62.83 -22.79 66.9 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.038 0.384 . . . . 10.0 112.038 -179.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.77 -43.71 45.14 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.282 0.563 . . . . 10.0 110.494 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 13.6 t -78.96 -32.52 15.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 121.58 0.705 . . . . 10.0 110.707 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.523 ' CE2' HD13 ' A' ' 64' ' ' LEU . 3.1 m-85 -81.16 -21.94 39.33 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.28 -0.873 . . . . 10.0 112.574 -178.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.434 ' HB2' ' O ' ' A' ' 109' ' ' SER . . . -52.84 -27.95 20.63 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.772 0.286 . . . . 10.0 111.772 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.4 -21.36 61.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.073 0.463 . . . . 10.0 111.123 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . 0.435 ' NE2' HD13 ' A' ' 90' ' ' ILE . 2.4 mp0 -95.44 -25.99 16.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.981 -0.554 . . . . 10.0 109.691 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 107.41 34.06 2.99 Favored Glycine 0 N--CA 1.448 -0.539 0 CA-C-N 115.62 -0.718 . . . . 10.0 112.291 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.472 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 72.2 t -128.87 128.07 67.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.682 0.277 . . . . 10.0 111.104 -179.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.4 m -123.47 104.29 8.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.21 0.529 . . . . 10.0 110.179 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.47 HG12 HG13 ' A' ' 128' ' ' VAL . 5.2 m -94.23 139.7 17.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.924 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -147.11 152.49 38.56 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.045 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.433 HG22 ' CD2' ' A' ' 126' ' ' LEU . 2.9 t -110.12 120.69 61.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 17.5 m -136.91 115.87 12.32 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.544 -0.298 . . . . 10.0 111.103 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 63.21 48.56 3.64 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.669 -0.696 . . . . 10.0 111.523 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 16.0 t30 60.73 23.54 13.42 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.082 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 40.9 tttt -126.74 131.0 51.43 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.475 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.433 ' CD2' HG22 ' A' ' 121' ' ' VAL . 95.2 mt -88.09 121.62 30.71 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 108.822 -0.807 . . . . 10.0 108.822 179.315 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.463 ' HG ' ' HB2' ' A' ' 80' ' ' SER . 0.3 OUTLIER -117.46 119.52 35.31 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.201 0.524 . . . . 10.0 111.035 -179.031 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.515 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 2.8 t -102.89 119.67 51.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 CA-C-N 115.644 -0.707 . . . . 10.0 109.104 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -127.66 132.99 24.62 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-O 120.909 0.385 . . . . 10.0 110.815 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.53 132.44 12.22 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 122.7 2.266 . . . . 10.0 112.554 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 1.1 m . . . . . 0 C--N 1.32 -0.677 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.053 179.598 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 16.1 t80 . . . . . 0 N--CA 1.452 -0.344 0 CA-C-O 120.964 0.412 . . . . 10.0 111.235 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.8 m -87.72 113.79 23.73 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.093 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -80.47 108.55 14.19 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.095 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.444 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 16.6 pt20 -141.99 159.56 41.98 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.886 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.637 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -92.92 126.97 38.26 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.03 -0.532 . . . . 10.0 109.842 178.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.404 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 16.2 p -118.31 158.86 45.57 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 116.115 -0.493 . . . . 10.0 109.972 -179.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.404 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 56.1 Cg_endo -72.04 -0.96 9.3 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 122.183 1.922 . . . . 10.0 111.495 178.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 68.5 mtm -90.31 -26.83 19.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.444 -0.798 . . . . 10.0 110.259 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -65.79 -50.08 66.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.964 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.43 -66.11 1.77 Allowed Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.589 -0.815 . . . . 10.0 113.153 178.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 29.9 p -125.35 173.93 8.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.143 0.497 . . . . 10.0 111.86 -178.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 46.1 tp -62.75 -41.22 99.1 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.006 -0.997 . . . . 10.0 110.491 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -61.31 -54.74 40.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.841 -179.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.92 -42.09 84.04 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.402 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 57.3 ttp -61.2 -51.5 68.73 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.488 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 86.4 mt -64.03 -38.04 89.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.116 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -60.34 -44.8 95.17 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 120.853 0.359 . . . . 10.0 110.311 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.0 mtp85 -68.98 -42.16 76.9 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.44 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 31.2 m0 -55.69 -48.54 74.92 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.43 0.633 . . . . 10.0 109.863 178.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.504 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -68.55 -51.84 38.52 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.158 -0.928 . . . . 10.0 111.613 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.27 -46.28 72.63 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.057 0.391 . . . . 10.0 112.057 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -60.75 -40.19 91.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.94 0.4 . . . . 10.0 111.571 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.4 m -93.14 9.71 34.8 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.887 -178.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 56.14 48.25 17.86 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.482 0.658 . . . . 10.0 110.45 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 81.1 mtp -116.2 173.54 6.53 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.047 -0.979 . . . . 10.0 109.88 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -108.83 160.74 15.74 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.433 -0.348 . . . . 10.0 110.228 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 19.9 tp -133.71 143.0 48.23 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.291 0.567 . . . . 10.0 110.773 -179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.474 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 31.7 m -127.91 96.06 4.38 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.042 -0.981 . . . . 10.0 109.595 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.521 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 13.8 t80 -93.02 98.16 11.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.441 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -98.64 22.07 10.45 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.075 0.464 . . . . 10.0 111.159 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.521 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 48.0 mt -88.01 143.59 33.37 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 109.565 -0.532 . . . . 10.0 109.565 179.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -61.71 -30.79 85.66 Favored 'Trans proline' 0 N--CA 1.465 -0.162 0 C-N-CA 122.633 2.222 . . . . 10.0 112.881 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.3 m -148.27 167.73 24.39 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.608 -0.269 . . . . 10.0 110.576 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.451 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 3.8 p-10 -83.47 146.16 28.55 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -129.16 149.56 50.91 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 110.241 -0.281 . . . . 10.0 110.241 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.58 169.95 11.28 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.79 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -74.19 144.28 44.84 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.813 -0.44 . . . . 10.0 109.813 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.7 pt -83.64 -36.15 12.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.337 -0.392 . . . . 10.0 111.71 -179.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 155.07 -67.92 0.3 Allowed Glycine 0 N--CA 1.453 -0.19 0 C-N-CA 120.297 -0.954 . . . . 10.0 113.13 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.5 -12.13 13.11 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 123.395 2.73 . . . . 10.0 113.468 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.402 HG23 ' H ' ' A' ' 93' ' ' VAL . 2.9 t -63.75 -39.49 85.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.028 0.442 . . . . 10.0 110.357 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.637 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.3 m -69.08 -7.53 36.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.843 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.99 -3.28 48.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.035 0.445 . . . . 10.0 110.604 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.444 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 52.2 mt -95.79 113.47 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.74 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.0 m -141.98 91.52 2.36 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.34 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 11.9 t -129.97 155.8 45.5 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.299 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.81 -10.77 54.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.037 0.446 . . . . 10.0 111.071 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.5 t -93.54 113.26 25.34 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.776 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.25 -28.94 45.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.054 0.454 . . . . 10.0 110.439 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 61.7 mt-30 -70.51 -39.64 73.98 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.013 -0.539 . . . . 10.0 109.81 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . 0.427 ' O ' ' HB ' ' A' ' 106' ' ' THR . 53.7 tp60 -69.99 -41.0 74.96 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.047 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.99 -50.03 73.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.51 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.47 -30.75 71.82 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.367 179.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.427 ' HB ' ' O ' ' A' ' 103' ' ' GLN . 55.5 m -64.34 -51.07 65.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.824 -0.625 . . . . 10.0 110.811 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -68.09 -39.75 82.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.153 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.449 ' HB3' HG21 ' A' ' 119' ' ' VAL . 1.6 mp -60.95 -50.9 71.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.126 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 13.0 p -63.54 -31.93 73.24 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.102 -0.239 . . . . 10.0 111.247 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.23 -40.79 98.44 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.146 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.587 HG13 ' HD1' ' A' ' 112' ' ' TYR . 12.0 p -89.28 -24.31 5.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 120.945 0.403 . . . . 10.0 111.942 -179.233 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.587 ' HD1' HG13 ' A' ' 111' ' ' VAL . 3.4 m-30 -83.35 -24.26 32.15 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.575 0.954 . . . . 10.0 113.575 -179.07 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.04 -32.62 15.91 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.64 -18.94 62.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.903 0.382 . . . . 10.0 111.386 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -98.03 -0.26 44.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.021 0.439 . . . . 10.0 110.182 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.85 21.25 56.25 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.975 -0.631 . . . . 10.0 112.887 179.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 92.5 t -121.49 128.64 75.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.805 0.336 . . . . 10.0 110.554 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.9 m -126.96 104.17 7.86 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.982 0.42 . . . . 10.0 110.728 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.659 HG12 HG13 ' A' ' 128' ' ' VAL . 27.7 m -94.59 148.26 5.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.012 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 18.9 m -154.62 175.89 13.09 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.887 -0.783 . . . . 10.0 108.887 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 13.9 p -142.62 125.77 14.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 121.526 0.679 . . . . 10.0 110.268 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 19.6 m -113.25 108.31 17.09 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.246 -0.888 . . . . 10.0 109.36 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 64.57 -89.61 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 O-C-N 123.755 0.66 . . . . 10.0 111.346 -179.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.9 m-20 -132.76 23.96 4.31 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.188 0.518 . . . . 10.0 109.843 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.474 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 38.6 tttt -125.72 127.91 46.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.032 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.504 HD12 ' HB2' ' A' ' 72' ' ' ALA . 36.0 mt -87.31 122.28 30.87 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.463 -0.939 . . . . 10.0 108.463 178.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -107.12 115.58 30.43 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.179 0.514 . . . . 10.0 111.121 -178.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.659 HG13 HG12 ' A' ' 119' ' ' VAL . 5.7 t -112.4 117.91 56.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 108.268 -1.012 . . . . 10.0 108.268 178.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -137.66 143.33 40.13 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-O 120.602 0.239 . . . . 10.0 110.456 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -81.03 142.53 13.76 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.519 2.146 . . . . 10.0 111.932 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 3.3 m . . . . . 0 C--N 1.32 -0.696 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.14 179.184 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 27.5 t80 . . . . . 0 N--CA 1.454 -0.227 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.6 m -79.83 121.02 24.88 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.86 0.362 . . . . 10.0 111.032 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -90.99 111.64 23.19 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.631 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -146.08 147.83 32.0 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.847 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.493 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -81.7 115.25 20.86 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.362 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 73.2 p -96.61 152.23 38.43 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.24 -0.436 . . . . 10.0 109.873 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.93 -18.38 64.66 Favored 'Trans proline' 0 CA--C 1.527 0.159 0 C-N-CA 122.225 1.95 . . . . 10.0 112.041 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.0 ptt? -89.6 2.92 54.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.515 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.604 ' HA ' ' NH1' ' A' ' 70' ' ' ARG . 28.9 m-20 -82.09 -52.21 7.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.262 0.553 . . . . 10.0 109.808 178.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.08 -66.98 2.97 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.534 -0.757 . . . . 10.0 113.697 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.5 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 24.4 p -122.34 165.92 15.51 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.663 0.616 . . . . 10.0 112.663 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.518 HD13 ' CE2' ' A' ' 112' ' ' TYR . 33.2 tp -62.42 -42.05 99.16 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.819 -1.082 . . . . 10.0 111.143 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 51.8 tttt -57.99 -55.37 35.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.739 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.6 m -59.63 -41.22 89.96 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.155 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 57.6 ttp -63.54 -52.53 60.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.856 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 70.8 mt -62.1 -40.24 95.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.369 -0.378 . . . . 10.0 111.286 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -60.54 -43.39 97.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.312 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.604 ' NH1' ' HA ' ' A' ' 61' ' ' ASP . 97.2 mtt180 -66.85 -42.5 85.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.225 179.287 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -58.83 -54.13 50.58 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.605 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.96 -40.16 96.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.687 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.11 -40.74 94.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.771 0.32 . . . . 10.0 111.311 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.69 -21.14 64.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.408 -179.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.408 ' HB2' ' SD ' ' A' ' 77' ' ' MET . 1.5 m -109.35 7.09 24.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.526 -0.306 . . . . 10.0 111.706 -179.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 61.4 t30 56.46 48.22 17.26 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.837 0.827 . . . . 10.0 110.655 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.408 ' SD ' ' HB2' ' A' ' 75' ' ' SER . 72.7 mtp -116.89 173.19 6.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.16 -0.927 . . . . 10.0 110.128 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.424 ' HB3' ' HE3' ' A' ' 125' ' ' LYS . 29.3 mm-40 -106.1 159.48 16.04 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.969 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.7 tp -134.8 138.77 44.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.319 0.581 . . . . 10.0 111.669 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.426 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 1.4 m -123.74 96.59 5.02 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.08 179.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.625 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 8.7 t80 -91.65 102.82 15.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.864 -178.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.482 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 37.1 m-80 -104.85 33.49 3.59 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.009 0.433 . . . . 10.0 110.908 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.528 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 55.6 mt -102.94 146.88 33.23 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.018 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.97 -34.54 94.98 Favored 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.735 2.29 . . . . 10.0 112.321 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.3 m -152.5 166.59 31.51 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.36 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.625 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 9.5 p-10 -84.92 128.75 34.76 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 178.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -100.39 136.99 39.42 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.18 -178.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.5 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.9 OUTLIER -72.59 154.99 40.5 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.518 179.181 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.11 114.84 3.34 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 179.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.3 pt -59.74 -32.83 50.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -178.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 149.26 -70.75 0.31 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.578 -0.82 . . . . 10.0 112.66 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.14 -4.69 3.21 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.511 2.807 . . . . 10.0 113.48 -179.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.414 HG23 ' H ' ' A' ' 93' ' ' VAL . 2.9 t -64.97 -36.04 76.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.308 0.575 . . . . 10.0 110.236 179.349 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.493 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.7 OUTLIER -67.22 -14.14 62.63 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.544 -0.753 . . . . 10.0 111.677 -179.342 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -87.67 1.56 53.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.876 0.37 . . . . 10.0 111.1 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 40.3 mt -98.51 110.28 25.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.1 t -141.12 93.99 2.65 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.543 -178.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.8 t -132.19 156.78 45.83 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.511 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -89.5 -13.69 36.91 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.052 0.453 . . . . 10.0 110.791 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.5 114.06 26.34 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.336 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.5 p -62.2 -33.83 60.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.832 0.348 . . . . 10.0 110.854 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -64.18 -39.38 93.87 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.122 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -72.53 -42.1 65.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.305 -0.407 . . . . 10.0 109.999 179.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.77 -51.09 66.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.91 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.74 -33.08 74.85 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.958 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 95.9 m -67.59 -47.12 70.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.669 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.406 ' O ' HG23 ' A' ' 111' ' ' VAL . 14.4 mt-10 -66.26 -40.08 89.9 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.262 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.402 ' O ' ' HB2' ' A' ' 112' ' ' TYR . 30.7 mt -61.24 -49.6 76.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.934 179.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.429 ' O ' ' HB2' ' A' ' 113' ' ' ALA . 4.6 p -64.17 -22.14 66.82 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 111.765 0.283 . . . . 10.0 111.765 -179.217 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.49 -46.82 52.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.09 0.471 . . . . 10.0 110.311 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 107' ' ' GLU . 4.7 t -75.78 -47.74 32.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.678 0.752 . . . . 10.0 110.334 179.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.518 ' CE2' HD13 ' A' ' 64' ' ' LEU . 3.6 m-30 -64.33 -21.11 66.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.928 -1.033 . . . . 10.0 113.254 -178.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.429 ' HB2' ' O ' ' A' ' 109' ' ' SER . . . -52.18 -28.55 18.64 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.806 0.298 . . . . 10.0 111.806 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.12 -23.72 54.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.148 0.499 . . . . 10.0 111.101 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 17.8 mp0 -89.75 -6.92 55.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.298 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 89.11 27.38 23.53 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.72 -0.752 . . . . 10.0 111.994 -179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.453 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 97.0 t -127.8 134.51 65.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.849 0.357 . . . . 10.0 110.605 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 14.4 m -136.16 105.15 5.91 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.267 0.556 . . . . 10.0 110.614 179.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.518 HG12 HG13 ' A' ' 128' ' ' VAL . 13.2 m -97.45 150.09 4.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.522 -0.763 . . . . 10.0 111.145 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 15.1 m -155.66 170.82 21.13 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.366 -0.605 . . . . 10.0 109.366 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.432 HG22 ' CD2' ' A' ' 126' ' ' LEU . 2.8 t -120.96 129.47 75.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 179.158 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 25.3 m -145.25 117.32 8.32 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.717 0.294 . . . . 10.0 111.268 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.56 50.68 5.59 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.551 -0.749 . . . . 10.0 111.901 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 30.5 t30 59.48 25.86 14.72 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.394 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.426 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 56.7 tttt -131.54 137.64 48.57 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.432 ' CD2' HG22 ' A' ' 121' ' ' VAL . 97.3 mt -87.91 122.16 31.2 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.116 -0.698 . . . . 10.0 109.116 179.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -103.91 115.76 31.05 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.317 -178.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.518 HG13 HG12 ' A' ' 119' ' ' VAL . 10.6 t -108.54 118.22 55.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 N-CA-C 108.552 -0.907 . . . . 10.0 108.552 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -137.71 139.64 27.41 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.436 -178.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -79.13 154.4 25.29 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.736 2.29 . . . . 10.0 112.098 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.32 -0.676 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.074 179.049 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.2 t80 . . . . . 0 N--CA 1.455 -0.196 0 CA-C-O 120.94 0.4 . . . . 10.0 111.329 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.7 m -84.39 117.74 23.81 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.143 178.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.437 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 93.0 m-85 -84.99 116.18 23.24 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.006 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -153.08 146.88 25.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.142 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.407 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -81.11 136.63 35.94 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.904 -0.406 . . . . 10.0 109.904 179.169 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 80.3 p -119.52 157.91 50.52 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 116.341 -0.391 . . . . 10.0 110.354 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -68.61 -8.16 22.43 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.405 2.07 . . . . 10.0 111.802 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 60.3 mtt -84.72 -17.36 38.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.496 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -73.27 -49.21 28.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.47 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.62 -61.64 4.54 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.871 -0.68 . . . . 10.0 112.413 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.438 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 24.4 p -121.55 170.37 9.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.872 0.368 . . . . 10.0 111.085 -179.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.437 HD22 ' O ' ' A' ' 64' ' ' LEU . 1.7 tm? -67.15 -39.09 86.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.226 179.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.41 -55.14 38.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.129 179.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.9 m -65.09 -27.47 68.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.238 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.403 ' HB2' ' O ' ' A' ' 63' ' ' THR . 9.7 tmm? -69.78 -55.27 10.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.371 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 43.0 mt -64.53 -32.74 74.52 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.669 0.271 . . . . 10.0 111.087 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -60.5 -39.06 86.38 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.636 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 59.7 ttp85 -70.18 -41.73 73.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.434 . . . . 10.0 110.222 179.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 29.1 m0 -58.02 -48.72 79.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.473 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.505 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -68.97 -42.46 76.59 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.553 -0.749 . . . . 10.0 111.626 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.42 -40.76 79.04 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -178.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -63.13 -38.23 90.37 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.854 0.316 . . . . 10.0 111.854 -179.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 10.2 m -98.75 11.63 38.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.435 -0.348 . . . . 10.0 111.817 -178.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 60.5 t30 58.14 30.1 18.86 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.482 0.658 . . . . 10.0 110.762 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 73.1 mtp -92.9 169.67 10.27 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.698 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -106.71 151.09 25.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.043 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 41.9 tp -116.08 126.54 53.89 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.288 0.566 . . . . 10.0 111.117 179.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.412 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 0.5 OUTLIER -108.97 95.87 5.94 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 178.725 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.564 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 7.7 t80 -93.41 101.82 14.04 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.088 -179.056 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.7 m-80 -100.68 31.07 3.65 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.326 0.584 . . . . 10.0 110.452 -179.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.536 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 32.1 mt -105.57 151.24 39.75 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.606 -0.725 . . . . 10.0 109.716 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.74 -27.68 21.47 Favored 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 122.542 2.161 . . . . 10.0 112.918 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.0 m -153.75 167.24 30.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.646 0.26 . . . . 10.0 110.76 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.564 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 6.6 p-10 -93.04 146.3 23.73 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.43 -0.581 . . . . 10.0 109.43 178.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.428 ' HE2' HD13 ' A' ' 83' ' ' LEU . 9.2 m-85 -124.78 157.93 34.57 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.416 -0.356 . . . . 10.0 110.237 -179.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.438 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.6 OUTLIER -81.76 163.79 22.15 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.087 179.702 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.46 119.35 15.49 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 179.373 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.4 pt -57.41 -34.92 47.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 112.439 0.533 . . . . 10.0 112.439 -179.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 152.31 -72.84 0.27 Allowed Glycine 0 CA--C 1.518 0.279 0 C-N-CA 120.06 -1.067 . . . . 10.0 113.261 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -61.54 -3.25 3.21 Favored 'Trans proline' 0 N--CA 1.478 0.588 0 C-N-CA 123.374 2.716 . . . . 10.0 113.903 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.1 t -61.62 -41.24 89.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.237 0.541 . . . . 10.0 110.64 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.407 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.9 OUTLIER -73.09 -7.11 49.87 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.613 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.09 2.28 56.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.927 0.394 . . . . 10.0 111.017 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 32.5 mt -104.6 113.76 42.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.558 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.4 m -138.34 99.47 3.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.004 0.431 . . . . 10.0 111.868 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.8 t -131.52 156.24 46.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.535 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.56 -13.12 43.78 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.043 0.449 . . . . 10.0 110.903 178.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 17.0 t -93.13 116.82 29.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.219 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.437 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 14.6 p -65.1 -30.38 50.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.921 0.391 . . . . 10.0 110.206 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -68.44 -42.35 79.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.954 -0.567 . . . . 10.0 109.825 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -68.75 -43.37 75.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.937 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.02 -48.34 73.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.626 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.72 -39.61 92.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.573 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 62.2 m -65.69 -48.0 73.53 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.807 -0.633 . . . . 10.0 111.0 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -65.75 -38.71 89.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.045 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.411 ' HA ' HD23 ' A' ' 108' ' ' LEU . 16.7 mt -62.54 -48.89 77.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.749 -0.463 . . . . 10.0 109.749 178.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.8 m -58.95 -33.01 70.13 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.854 -0.612 . . . . 10.0 111.227 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.25 -40.51 94.3 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.933 0.396 . . . . 10.0 110.999 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.85 -40.72 15.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.49 0.662 . . . . 10.0 110.852 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.433 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 8.3 m-30 -69.64 -25.46 63.93 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.249 -0.887 . . . . 10.0 112.647 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.05 -42.27 49.42 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.295 0.48 . . . . 10.0 112.295 -179.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.37 -23.84 67.43 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -95.1 -3.79 47.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.839 0.352 . . . . 10.0 110.928 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 88.62 23.8 35.22 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.715 -0.755 . . . . 10.0 113.237 179.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.433 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 88.6 t -126.33 139.76 50.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.965 0.412 . . . . 10.0 110.578 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.0 m -142.28 140.84 32.33 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 110.068 -0.345 . . . . 10.0 110.068 178.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.437 HG12 HG22 ' A' ' 128' ' ' VAL . 11.0 m -126.5 134.23 66.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.103 0.478 . . . . 10.0 111.55 -178.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.8 m -140.1 143.71 36.41 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 179.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.468 ' HB ' HD23 ' A' ' 126' ' ' LEU . 3.1 p -107.75 127.58 63.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-O 121.275 0.559 . . . . 10.0 110.039 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.4 m -145.99 130.53 17.83 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.153 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.32 39.51 18.77 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.564 0.54 . . . . 10.0 111.089 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 14.4 m120 62.67 28.84 16.76 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.65 -0.705 . . . . 10.0 110.986 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.412 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 66.7 tttt -130.81 132.25 45.13 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.867 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.505 HD12 ' HB2' ' A' ' 72' ' ' ALA . 48.9 mt -87.88 122.11 31.11 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.298 -1.001 . . . . 10.0 108.298 179.097 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.14 115.52 27.65 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.062 0.458 . . . . 10.0 111.286 -178.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.437 HG22 HG12 ' A' ' 119' ' ' VAL . 3.2 t -97.17 119.91 45.82 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 N-CA-C 108.742 -0.836 . . . . 10.0 108.742 178.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -132.6 128.48 20.98 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 109.943 -0.392 . . . . 10.0 109.943 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.23 131.22 16.23 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.311 2.008 . . . . 10.0 112.087 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.318 -0.771 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.315 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.9 t80 . . . . . 0 C--O 1.234 0.287 0 CA-C-O 120.998 0.428 . . . . 10.0 111.467 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.4 m -86.19 122.21 29.86 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.76 -0.655 . . . . 10.0 110.4 179.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.425 ' OH ' ' HB3' ' A' ' 75' ' ' SER . 67.4 m-85 -87.68 114.12 24.0 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.741 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -146.64 145.18 29.96 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.91 -0.586 . . . . 10.0 109.994 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -79.18 123.54 27.49 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 178.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.449 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 50.6 p -111.06 158.16 36.68 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-O 120.66 0.267 . . . . 10.0 111.04 -178.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.449 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 35.6 Cg_endo -64.25 -20.19 66.57 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.431 2.087 . . . . 10.0 111.321 178.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -66.28 -35.1 79.54 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -75.11 -56.07 5.1 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.484 -0.932 . . . . 10.0 108.484 178.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.63 -56.13 3.39 Favored Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.309 -0.86 . . . . 10.0 113.536 178.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 63.5 p -108.04 166.03 11.03 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.062 0.458 . . . . 10.0 111.883 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 31.6 tp -61.92 -48.12 81.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.143 -0.935 . . . . 10.0 111.553 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -58.09 -54.55 45.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.77 -0.195 . . . . 10.0 111.133 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.3 m -58.41 -37.84 76.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.98 0.419 . . . . 10.0 111.497 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 10.1 tmm? -68.84 -52.29 31.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.002 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 26.8 mt -63.64 -34.13 77.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.519 -0.309 . . . . 10.0 111.09 -179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -62.24 -43.38 98.97 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 -64.48 -43.04 95.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.076 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 21.3 m0 -60.03 -54.48 45.53 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.719 -0.673 . . . . 10.0 110.985 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.562 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -62.94 -36.82 84.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.982 -0.554 . . . . 10.0 111.655 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.83 -44.05 97.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.811 0.339 . . . . 10.0 111.158 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.04 -34.56 77.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.55 -179.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.425 ' HB3' ' OH ' ' A' ' 55' ' ' TYR . 4.7 p -91.51 0.77 57.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.415 -0.357 . . . . 10.0 111.551 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 56.29 46.41 21.18 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.569 0.699 . . . . 10.0 109.705 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.508 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 21.9 mtm -115.37 168.07 10.3 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.698 -179.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -93.79 150.08 20.69 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.125 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 22.4 tp -124.06 134.66 53.35 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.92 0.39 . . . . 10.0 110.174 179.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.62 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 1.6 m -121.46 95.98 4.9 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.987 179.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.512 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 11.6 t80 -90.83 96.78 10.81 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.273 -0.64 . . . . 10.0 109.273 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -98.92 22.52 10.09 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.258 0.552 . . . . 10.0 110.841 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.512 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 63.5 mt -87.56 138.33 31.81 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.537 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -61.44 -35.78 81.15 Favored 'Trans proline' 0 C--O 1.235 0.332 0 C-N-CA 123.08 2.52 . . . . 10.0 113.122 -179.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.8 m -137.51 168.71 19.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.143 0.497 . . . . 10.0 111.037 -179.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -82.78 143.81 30.59 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.574 178.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.461 ' CE2' HD13 ' A' ' 83' ' ' LEU . 48.4 m-85 -124.12 145.43 49.28 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.482 -0.326 . . . . 10.0 110.193 179.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 1.5 m -97.82 151.57 20.06 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.882 -179.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.54 112.73 1.7 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 120.875 0.369 . . . . 10.0 110.126 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -62.64 -33.8 61.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 112.68 0.622 . . . . 10.0 112.68 -178.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 151.02 -64.78 0.38 Allowed Glycine 0 CA--C 1.519 0.332 0 C-N-CA 120.172 -1.013 . . . . 10.0 113.455 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.56 -13.98 28.45 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.883 2.389 . . . . 10.0 113.16 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.441 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.4 t -64.91 -35.5 75.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.862 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.93 -11.48 60.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.427 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.12 2.95 55.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.341 -0.39 . . . . 10.0 111.392 -179.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.599 HD13 HD12 ' A' ' 108' ' ' LEU . 39.3 mt -98.0 108.36 21.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.533 -0.303 . . . . 10.0 110.273 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.72 100.43 5.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.755 -179.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.2 t -132.54 155.59 48.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.579 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -91.05 -1.63 57.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.846 0.355 . . . . 10.0 111.484 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.4 t -109.01 121.44 45.13 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.467 -0.333 . . . . 10.0 110.279 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.58 -30.78 51.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.83 0.348 . . . . 10.0 110.733 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -68.88 -46.28 68.8 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 179.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -65.12 -36.38 84.08 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.329 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.34 -51.12 70.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.229 178.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.81 -33.38 75.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.632 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 51.5 m -66.91 -46.32 75.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.775 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -70.99 -36.81 72.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.277 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.599 HD12 HD13 ' A' ' 96' ' ' ILE . 2.9 mp -62.75 -47.61 82.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.751 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.1 p -62.45 -29.84 70.81 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 116.734 -0.212 . . . . 10.0 111.281 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.04 -35.74 81.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.166 0.508 . . . . 10.0 110.791 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 45.6 t -84.94 -41.65 15.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.409 0.624 . . . . 10.0 110.264 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.531 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 12.1 m-30 -68.3 -26.75 65.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.166 -0.924 . . . . 10.0 112.273 -178.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -51.02 -44.69 61.05 Favored 'General case' 0 C--N 1.33 -0.279 0 O-C-N 123.07 0.231 . . . . 10.0 111.468 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.62 -23.4 65.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.891 0.377 . . . . 10.0 111.265 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -89.38 -12.46 40.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.786 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 96.13 22.28 20.45 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.604 -0.808 . . . . 10.0 112.809 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.531 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 90.3 t -127.61 145.41 35.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.872 0.367 . . . . 10.0 110.052 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.2 m -139.44 117.92 12.14 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.996 0.427 . . . . 10.0 110.269 178.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.469 HG12 HG13 ' A' ' 128' ' ' VAL . 28.0 m -108.48 144.98 16.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.778 -0.647 . . . . 10.0 111.46 -179.536 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 48.5 m -155.47 142.46 19.12 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.885 -0.783 . . . . 10.0 108.885 178.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.516 ' HB ' HD23 ' A' ' 126' ' ' LEU . 2.6 p -104.44 117.39 49.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 16.6 m -132.52 118.93 19.87 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.252 -178.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.28 51.93 5.19 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 123.916 0.76 . . . . 10.0 112.402 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.508 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 78.3 m-20 60.44 33.89 20.59 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.059 -0.518 . . . . 10.0 111.594 179.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.62 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 64.2 tttt -143.69 129.28 19.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.789 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.562 HD12 ' HB2' ' A' ' 72' ' ' ALA . 36.7 mt -88.26 121.22 30.4 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.604 -0.888 . . . . 10.0 108.604 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 127' ' ' LEU . 2.3 mm? -103.39 116.54 32.6 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.667 -179.062 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.469 HG13 HG12 ' A' ' 119' ' ' VAL . 2.8 t -111.43 118.01 56.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 N-CA-C 108.64 -0.874 . . . . 10.0 108.64 178.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -143.39 148.43 44.03 Favored Pre-proline 0 C--N 1.322 -0.625 0 CA-C-O 120.686 0.279 . . . . 10.0 111.144 -178.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -79.06 143.58 18.04 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.552 2.168 . . . . 10.0 110.911 178.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.712 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.202 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 30.1 t80 . . . . . 0 N--CA 1.452 -0.37 0 CA-C-O 120.741 0.305 . . . . 10.0 110.207 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 13.9 m -69.0 114.96 7.76 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.343 0.592 . . . . 10.0 110.256 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.501 ' O ' ' HA ' ' A' ' 97' ' ' SER . 52.0 m-85 -79.59 115.49 19.24 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.526 -0.761 . . . . 10.0 110.865 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -150.69 148.94 29.19 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.73 179.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.34 119.3 24.92 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.258 -0.645 . . . . 10.0 109.258 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.8 p -104.32 153.5 38.99 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.833 -179.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -64.42 -13.11 36.56 Favored 'Trans proline' 0 N--CA 1.465 -0.149 0 C-N-CA 122.67 2.246 . . . . 10.0 111.701 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 24.7 mmt -79.35 -21.96 45.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.313 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -75.31 -51.56 12.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.386 -0.598 . . . . 10.0 109.386 179.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.94 -65.25 2.95 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.918 -0.658 . . . . 10.0 112.846 178.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.473 HG22 HG23 ' A' ' 88' ' ' THR . 30.0 p -117.22 169.73 9.23 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.018 0.437 . . . . 10.0 111.666 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.403 HD13 ' CE2' ' A' ' 112' ' ' TYR . 60.4 tp -62.85 -38.87 92.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.453 -0.794 . . . . 10.0 110.821 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -61.42 -52.17 65.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.474 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.24 -35.47 81.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.273 -0.422 . . . . 10.0 111.546 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.0 tmm? -68.06 -50.62 54.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.849 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 88.2 mt -63.23 -35.85 81.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.842 0.353 . . . . 10.0 110.229 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -61.53 -38.13 86.28 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 178.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.433 HH11 ' HD3' ' A' ' 70' ' ' ARG . 3.8 tpp180 -68.17 -46.27 71.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.037 179.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 32.5 m0 -57.33 -50.94 71.33 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.827 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.52 -41.77 83.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.892 -0.594 . . . . 10.0 111.858 -179.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.83 -41.03 96.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.82 0.343 . . . . 10.0 111.668 -179.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -68.75 -34.07 74.96 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.316 -0.402 . . . . 10.0 111.266 -179.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.9 m -94.01 2.9 55.98 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.316 -0.402 . . . . 10.0 111.802 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 67.2 t30 57.74 55.26 5.61 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.366 0.603 . . . . 10.0 110.4 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 19.5 mtm -129.59 173.13 10.89 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.034 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -98.72 155.12 17.49 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.553 -0.294 . . . . 10.0 110.264 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.0 tp -132.2 135.57 46.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.919 0.39 . . . . 10.0 110.997 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.608 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 1.1 m -122.74 96.78 5.16 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.523 179.183 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.514 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 27.7 t80 -88.16 98.88 11.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.745 -0.662 . . . . 10.0 109.534 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -107.72 33.45 4.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.779 0.323 . . . . 10.0 111.463 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.449 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 39.4 mt -88.06 150.28 47.13 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 110.322 -0.251 . . . . 10.0 110.322 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -63.14 -29.56 74.4 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.577 2.185 . . . . 10.0 112.262 179.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.1 m -152.36 166.28 32.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.412 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.514 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 0.6 OUTLIER -87.97 140.44 29.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.507 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -120.98 144.94 48.24 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.935 0.398 . . . . 10.0 111.231 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.473 HG23 HG22 ' A' ' 63' ' ' THR . 0.2 OUTLIER -84.73 161.13 20.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.242 179.766 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -57.09 117.81 4.39 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.138 0.495 . . . . 10.0 110.573 179.125 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.6 pt -61.68 -35.97 70.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.407 -0.815 . . . . 10.0 112.162 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 137.87 -69.01 0.5 Allowed Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.633 -0.794 . . . . 10.0 112.285 -179.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.27 -13.12 36.25 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.718 2.278 . . . . 10.0 112.389 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.36 -32.46 53.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.631 0.729 . . . . 10.0 110.196 178.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.68 -10.58 59.84 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.834 -1.075 . . . . 10.0 111.261 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -92.32 -1.19 57.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.059 0.456 . . . . 10.0 110.715 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 56.9 mt -98.24 113.36 32.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.567 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.501 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 1.6 m -140.66 96.72 3.07 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.753 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.7 t -127.02 155.72 42.78 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.698 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.46 -5.05 52.71 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.356 -0.383 . . . . 10.0 111.972 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 62.3 m -100.27 119.38 38.31 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.906 -0.405 . . . . 10.0 109.906 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.4 HG22 ' HE2' ' A' ' 55' ' ' TYR . 0.8 OUTLIER -56.72 -49.29 78.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.136 -0.484 . . . . 10.0 111.913 -178.979 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -62.07 -33.52 74.56 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.776 -0.647 . . . . 10.0 111.403 -178.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -73.36 -39.76 64.91 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.96 -48.74 79.08 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.216 179.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.11 -43.53 98.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.575 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 84.6 m -62.6 -44.75 95.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.963 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -66.15 -39.55 89.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.707 179.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.444 HD23 ' HA ' ' A' ' 108' ' ' LEU . 15.2 mt -61.06 -53.59 55.25 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.954 -0.387 . . . . 10.0 109.954 178.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.7 m -57.6 -31.78 66.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.589 -179.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.98 -39.12 91.1 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.192 0.52 . . . . 10.0 110.789 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 6.4 t -90.61 -29.86 4.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.833 -0.622 . . . . 10.0 111.553 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.405 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.1 m-85 -82.17 -24.04 35.2 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.465 1.283 . . . . 10.0 114.465 -177.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.76 -38.42 33.81 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.291 0.478 . . . . 10.0 112.291 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.97 -18.93 65.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.058 0.456 . . . . 10.0 111.717 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -97.71 -4.2 37.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.978 0.418 . . . . 10.0 110.209 179.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . 0.4 ' HA2' HG23 ' A' ' 131' ' ' VAL . . . 84.91 27.4 34.51 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.956 -0.64 . . . . 10.0 112.272 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.405 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 67.6 t -124.61 136.06 61.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 120.814 0.34 . . . . 10.0 110.642 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 29.4 m -140.39 123.18 16.38 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.935 0.397 . . . . 10.0 110.091 179.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 5.4 m -111.61 147.88 15.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.873 -179.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 19.1 m -150.65 155.93 40.35 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.133 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.472 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.4 t -112.17 115.75 50.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.126 -0.694 . . . . 10.0 109.126 179.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 14.5 m -136.55 117.92 14.67 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.146 -178.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 63.92 51.49 2.31 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.671 -0.695 . . . . 10.0 111.929 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 54.91 35.04 23.52 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.531 0.681 . . . . 10.0 110.813 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.608 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 75.6 tttt -140.54 133.37 29.05 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.485 -0.779 . . . . 10.0 109.827 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.472 ' CD2' HG22 ' A' ' 121' ' ' VAL . 94.0 mt -88.65 121.5 31.09 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 109.039 -0.726 . . . . 10.0 109.039 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.535 HD22 ' HB2' ' A' ' 80' ' ' SER . 13.2 mt -112.86 125.96 54.93 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.199 0.523 . . . . 10.0 110.809 -178.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 2.6 t -108.3 118.73 56.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 N-CA-C 108.222 -1.029 . . . . 10.0 108.222 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -127.98 138.09 32.19 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-O 120.841 0.353 . . . . 10.0 111.365 -178.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -81.62 133.24 8.15 Favored 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.133 1.888 . . . . 10.0 110.898 177.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.4 HG23 ' HA2' ' A' ' 116' ' ' GLY . 1.6 m . . . . . 0 C--N 1.317 -0.836 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.691 -179.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.8 t80 . . . . . 0 N--CA 1.456 -0.136 0 CA-C-O 120.952 0.406 . . . . 10.0 111.129 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.4 m -82.92 113.1 20.29 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.577 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.436 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 95.1 m-85 -83.29 107.54 15.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.525 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -147.6 174.07 12.11 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.818 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.52 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -100.91 127.55 47.33 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.381 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.6 p -109.71 153.9 42.74 Favored Pre-proline 0 C--N 1.323 -0.587 0 N-CA-C 109.872 -0.418 . . . . 10.0 109.872 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -66.85 -9.52 25.04 Favored 'Trans proline' 0 CA--C 1.529 0.264 0 C-N-CA 122.333 2.022 . . . . 10.0 111.626 179.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 61.8 mtm -84.6 -19.89 32.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.492 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -73.11 -57.9 3.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.151 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . 0.407 ' O ' HD22 ' A' ' 89' ' ' LEU . . . 87.05 -57.82 4.59 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.838 -0.696 . . . . 10.0 113.167 179.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 65.5 p -119.24 164.54 15.47 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.485 0.55 . . . . 10.0 112.485 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.416 HD13 ' CE2' ' A' ' 112' ' ' TYR . 27.3 tp -61.35 -45.14 95.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.282 -0.872 . . . . 10.0 111.386 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.1 ttpt -59.17 -50.34 74.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.828 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.594 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 51.8 m -60.74 -43.45 97.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.948 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.402 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 57.0 ttp -60.72 -50.82 71.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.612 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.441 ' HB3' HD13 ' A' ' 79' ' ' LEU . 83.2 mt -63.55 -35.23 79.81 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.875 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -60.87 -43.37 98.51 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.624 -0.51 . . . . 10.0 109.624 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.594 ' HG2' ' O ' ' A' ' 66' ' ' THR . 31.6 mmt180 -64.93 -46.06 83.2 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.643 -0.708 . . . . 10.0 109.643 178.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 38.9 m0 -55.23 -50.54 69.15 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.469 -0.787 . . . . 10.0 110.793 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.428 ' HA ' ' HB2' ' A' ' 77' ' ' MET . . . -66.0 -52.14 52.04 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.338 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.93 -43.61 77.55 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.253 0.464 . . . . 10.0 112.253 -178.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -58.21 -35.83 72.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.909 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.1 m -105.38 18.75 21.75 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.24 0.459 . . . . 10.0 112.24 -178.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 65.4 t30 57.91 35.54 25.44 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.636 0.732 . . . . 10.0 111.209 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.428 ' HB2' ' HA ' ' A' ' 72' ' ' ALA . 72.6 mtp -103.19 173.88 6.11 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.839 -0.618 . . . . 10.0 110.035 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 70.7 mm-40 -114.02 157.91 21.88 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.819 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.441 HD13 ' HB3' ' A' ' 68' ' ' LEU . 43.6 tp -124.99 131.51 53.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.195 0.522 . . . . 10.0 110.958 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -115.59 96.37 5.6 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.562 -0.745 . . . . 10.0 109.251 178.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.548 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 6.6 t80 -91.45 98.57 11.77 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.097 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.458 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 42.2 m-80 -94.94 11.96 29.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.901 -179.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.507 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 45.2 mt -84.12 147.61 51.24 Favored Pre-proline 0 C--N 1.324 -0.523 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.29 -41.86 68.63 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.662 2.241 . . . . 10.0 112.634 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 2.1 m -147.11 170.49 17.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.096 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.548 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 7.0 p-10 -80.82 148.06 30.16 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -123.72 143.24 50.4 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.838 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.28 152.32 36.5 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.524 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.407 HD22 ' O ' ' A' ' 62' ' ' GLY . 0.1 OUTLIER -58.75 136.31 57.7 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.735 0.302 . . . . 10.0 110.245 178.986 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.5 pt -81.48 -27.62 10.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.534 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 138.37 -62.49 0.57 Allowed Glycine 0 CA--C 1.523 0.536 0 C-N-CA 120.217 -0.992 . . . . 10.0 113.282 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -58.61 -15.75 27.03 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 123.02 2.48 . . . . 10.0 113.098 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t -61.81 -36.64 74.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.922 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.52 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.1 m -71.66 -14.71 62.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.87 -0.604 . . . . 10.0 111.723 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -88.3 -1.31 57.95 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.052 0.453 . . . . 10.0 110.523 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.437 HD13 HD12 ' A' ' 108' ' ' LEU . 56.9 mt -101.65 111.77 32.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.771 -0.649 . . . . 10.0 109.371 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.0 m -139.99 97.16 3.19 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.112 0.482 . . . . 10.0 110.564 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.1 t -130.76 157.67 42.2 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.692 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.42 -18.29 30.31 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.462 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.03 113.31 25.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.619 -0.718 . . . . 10.0 110.275 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.436 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 9.8 p -61.14 -31.68 50.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.565 0.221 . . . . 10.0 111.269 -179.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -65.93 -41.1 91.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.945 0.402 . . . . 10.0 110.028 179.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -66.99 -41.96 85.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.923 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.05 -50.37 72.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.61 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.23 -36.44 79.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.582 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 63.0 m -64.18 -45.76 86.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.852 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -69.78 -39.19 76.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.862 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.437 HD12 HD13 ' A' ' 96' ' ' ILE . 1.7 mp -63.34 -50.29 70.57 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.839 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 11.2 p -62.73 -21.72 66.01 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.696 0.258 . . . . 10.0 111.696 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.51 -48.03 51.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.891 0.376 . . . . 10.0 110.893 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.61 HG13 ' HD1' ' A' ' 112' ' ' TYR . 4.8 p -82.55 -28.48 8.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-O 121.421 0.629 . . . . 10.0 111.186 -179.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.61 ' HD1' HG13 ' A' ' 111' ' ' VAL . 3.1 m-85 -81.28 -22.86 38.33 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.658 -0.701 . . . . 10.0 112.798 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.65 -42.64 45.77 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 112.342 0.497 . . . . 10.0 112.342 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.96 -20.01 63.33 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.876 0.37 . . . . 10.0 111.377 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -87.81 -13.31 42.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.187 0.518 . . . . 10.0 109.955 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 130' ' ' PRO . . . 95.61 24.93 14.5 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 115.717 -0.674 . . . . 10.0 112.48 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.459 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 96.5 t -128.27 130.9 69.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.052 0.453 . . . . 10.0 111.378 -179.184 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.6 m -127.54 111.61 13.98 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.236 -0.438 . . . . 10.0 109.979 178.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.433 HG21 ' HB3' ' A' ' 108' ' ' LEU . 3.3 m -102.57 142.39 16.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.077 0.465 . . . . 10.0 111.088 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 15.3 m -150.38 165.53 32.82 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.813 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.532 HG22 HD23 ' A' ' 126' ' ' LEU . 3.4 t -119.64 117.31 53.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 13.8 m -134.6 118.71 17.53 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.639 -0.255 . . . . 10.0 110.659 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 65.05 43.75 3.63 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 123.732 0.645 . . . . 10.0 111.147 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 4.6 t30 59.37 29.67 19.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.116 -0.947 . . . . 10.0 110.619 -179.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -129.77 133.78 47.2 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.29 -0.868 . . . . 10.0 109.056 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.532 HD23 HG22 ' A' ' 121' ' ' VAL . 96.0 mt -87.97 122.01 31.06 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.727 -0.842 . . . . 10.0 108.727 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -113.3 116.0 29.04 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-O 121.207 0.527 . . . . 10.0 111.322 -178.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.458 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 3.2 t -99.33 117.63 44.73 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.077 0 N-CA-C 107.869 -1.159 . . . . 10.0 107.869 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -128.28 131.56 23.85 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-O 120.983 0.42 . . . . 10.0 111.096 -178.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . 0.406 ' HA ' ' O ' ' A' ' 116' ' ' GLY . 59.3 Cg_endo -73.77 136.97 24.0 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.365 2.043 . . . . 10.0 110.78 178.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.316 -0.879 0 C-N-CA 120.827 -0.349 . . . . 10.0 110.202 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.9 t80 . . . . . 0 N--CA 1.455 -0.218 0 CA-C-O 121.142 0.496 . . . . 10.0 111.074 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.2 m -86.96 122.87 31.41 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.78 -0.646 . . . . 10.0 110.395 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -89.5 119.84 30.29 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.468 ' HG3' ' OG ' ' A' ' 97' ' ' SER . 1.9 tt0 -152.58 144.56 23.74 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.671 -178.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.51 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -78.16 128.05 33.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.002 178.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.462 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 82.5 p -113.71 159.64 34.92 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 116.571 -0.286 . . . . 10.0 110.576 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.462 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 47.1 Cg_endo -69.53 -3.31 11.61 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.459 2.106 . . . . 10.0 112.122 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 45.2 mtt -88.24 -25.14 23.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.362 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -72.22 -58.61 3.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.054 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 86.95 -57.21 4.63 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.77 -0.729 . . . . 10.0 112.895 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.649 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 65.3 p -121.52 172.57 7.98 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.426 0.528 . . . . 10.0 112.426 -179.366 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 25.7 tp -64.19 -48.62 75.22 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.114 -0.948 . . . . 10.0 111.752 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -58.79 -43.99 90.62 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.012 0.434 . . . . 10.0 110.472 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.8 m -66.51 -39.78 88.84 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.485 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 54.7 ttp -66.87 -50.14 63.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.044 0.45 . . . . 10.0 111.055 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 75.1 mt -62.17 -37.71 86.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.276 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -60.49 -41.34 94.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.284 179.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -65.78 -47.63 74.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.285 179.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 43.5 m0 -58.19 -51.94 67.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.574 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.69 -42.48 99.65 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.784 -0.643 . . . . 10.0 111.515 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.4 -44.77 95.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.727 0.298 . . . . 10.0 111.755 -179.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.15 -40.27 95.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.372 -0.376 . . . . 10.0 111.417 -179.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.9 m -94.0 6.96 46.83 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.897 -178.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 46.9 t30 55.85 49.25 16.43 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.239 0.542 . . . . 10.0 111.272 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.452 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 10.8 mtm -114.68 174.0 6.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.756 -179.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 26.6 mp0 -102.15 163.1 12.42 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.68 -179.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 45.9 tp -130.88 138.82 49.99 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.179 0.514 . . . . 10.0 111.134 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -124.54 96.23 4.82 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.432 -0.804 . . . . 10.0 109.142 178.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.496 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 4.7 t80 -92.31 98.34 11.44 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.427 -0.583 . . . . 10.0 109.427 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 15.0 m120 -96.89 24.03 6.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.122 0.487 . . . . 10.0 110.589 -179.316 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.496 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 44.4 mt -93.51 142.48 25.24 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.425 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.84 -29.84 58.59 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.898 2.399 . . . . 10.0 112.327 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.2 m -147.46 153.26 39.34 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.587 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.495 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 34.3 t0 -80.68 125.12 29.64 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -100.47 149.8 23.31 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.643 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.649 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 2.0 t -92.84 151.95 19.7 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.7 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -50.59 121.67 6.11 Favored 'General case' 0 C--N 1.337 0.042 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.868 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.0 pt -67.01 -29.57 46.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.562 . . . . 10.0 111.935 -179.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 141.72 -68.45 0.46 Allowed Glycine 0 CA--C 1.52 0.344 0 C-N-CA 120.375 -0.916 . . . . 10.0 113.2 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.17 -7.28 3.58 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.639 2.893 . . . . 10.0 113.868 -179.033 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.465 ' HA ' HD12 ' A' ' 96' ' ' ILE . 5.8 t -68.07 -32.79 57.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.239 0.542 . . . . 10.0 110.452 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.51 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.5 m -72.62 -13.73 61.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.938 -0.573 . . . . 10.0 111.436 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -89.5 -0.1 57.26 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.044 0.449 . . . . 10.0 110.562 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.526 HD13 HD12 ' A' ' 108' ' ' LEU . 51.6 mt -97.95 111.0 26.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.584 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.468 ' OG ' ' HG3' ' A' ' 56' ' ' GLN . 2.8 m -134.08 98.78 4.23 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.697 -179.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 12.8 t -129.76 155.69 45.52 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.442 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -90.24 -9.47 47.89 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.798 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.4 t -104.29 123.76 47.95 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.662 0.267 . . . . 10.0 110.908 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.407 HG13 HG11 ' A' ' 121' ' ' VAL . 13.1 p -65.99 -29.7 47.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-O 121.123 0.487 . . . . 10.0 110.104 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -69.93 -41.45 74.58 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.733 179.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -68.7 -39.43 80.5 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.83 -48.8 77.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.658 179.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.46 -35.38 80.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.324 0.583 . . . . 10.0 110.473 179.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 92.8 m -67.34 -47.5 70.28 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.46 -0.791 . . . . 10.0 110.802 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -69.6 -40.89 76.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.881 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . 0.526 HD12 HD13 ' A' ' 96' ' ' ILE . 2.5 mp -59.04 -48.28 82.17 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.773 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 59.2 m -59.55 -31.91 69.86 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 111.86 0.318 . . . . 10.0 111.86 -179.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.4 -37.42 83.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.375 0.607 . . . . 10.0 110.833 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 2.7 t -87.47 -42.74 15.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.521 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.48 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 13.2 m-30 -64.83 -26.63 68.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.166 -0.925 . . . . 10.0 112.504 -178.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -55.37 -31.42 61.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.774 0.321 . . . . 10.0 111.389 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.74 -11.54 59.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.91 0.386 . . . . 10.0 111.198 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 -109.96 -0.28 18.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.566 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 82.36 28.13 41.26 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.95 -0.643 . . . . 10.0 112.855 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.48 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 74.1 t -127.54 143.86 39.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.952 0.406 . . . . 10.0 110.338 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.9 m -142.47 138.83 31.28 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 178.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 9.9 m -126.32 143.24 40.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.407 0.623 . . . . 10.0 111.782 -178.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.2 m -150.84 139.85 21.02 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.429 178.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.407 HG11 HG13 ' A' ' 101' ' ' VAL . 2.3 p -102.48 121.0 53.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.3 m -139.91 124.51 18.2 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.767 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.4 48.62 7.63 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 123.537 0.523 . . . . 10.0 111.476 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.452 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 23.6 m120 57.69 33.01 22.7 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.783 -0.644 . . . . 10.0 111.498 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -137.19 129.9 30.24 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.6 -0.519 . . . . 10.0 109.6 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 37.3 mt -87.54 120.73 29.14 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 107.8 -1.185 . . . . 10.0 107.8 178.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.71 118.97 37.93 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.103 0.478 . . . . 10.0 111.591 -178.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.405 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 3.0 t -104.44 118.36 51.57 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.957 0 N-CA-C 108.187 -1.042 . . . . 10.0 108.187 178.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -131.01 131.25 23.09 Favored Pre-proline 0 C--N 1.317 -0.827 0 CA-C-O 120.741 0.305 . . . . 10.0 110.96 -178.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -72.14 134.38 23.03 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.467 2.111 . . . . 10.0 111.058 179.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.315 -0.912 0 N-CA-C 109.892 -0.41 . . . . 10.0 109.892 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 21.2 t80 . . . . . 0 N--CA 1.449 -0.486 0 CA-C-O 120.75 0.309 . . . . 10.0 110.45 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.6 m -73.92 115.6 13.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.077 0.465 . . . . 10.0 110.358 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.411 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 91.4 m-85 -84.19 105.27 14.92 Favored 'General case' 0 C--N 1.313 -1.022 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -141.05 147.27 38.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.314 -179.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.699 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -75.52 117.3 17.16 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.398 -0.593 . . . . 10.0 109.398 178.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 61.8 p -101.67 152.49 38.09 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 116.307 -0.406 . . . . 10.0 111.094 -178.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -64.98 -13.86 42.03 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.655 2.237 . . . . 10.0 112.416 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.5 ptp -86.78 -6.27 58.87 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.93 0.395 . . . . 10.0 110.447 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -84.14 -58.49 2.74 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 179.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 86.19 -60.24 4.6 Favored Glycine 0 N--CA 1.445 -0.754 0 CA-C-N 115.649 -0.705 . . . . 10.0 113.319 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 31.9 p -116.48 166.5 12.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.551 0.691 . . . . 10.0 112.705 -178.329 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.93 -46.25 82.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.368 -1.287 . . . . 10.0 111.392 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 29.9 ttmt -58.27 -56.7 18.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.922 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.1 m -56.49 -42.66 78.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.0 -0.546 . . . . 10.0 111.804 -179.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 50.2 ttp -59.77 -54.09 50.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.826 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.5 mt -64.81 -36.22 83.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.16 -0.473 . . . . 10.0 111.109 -179.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -60.18 -45.34 93.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.775 0.321 . . . . 10.0 110.323 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -66.3 -38.87 88.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.634 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 39.2 m0 -62.57 -53.74 50.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.325 0.583 . . . . 10.0 109.938 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.439 ' HB2' HD23 ' A' ' 126' ' ' LEU . . . -61.36 -39.88 92.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.225 -0.898 . . . . 10.0 111.637 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.69 -39.86 81.94 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.295 0.48 . . . . 10.0 112.295 -179.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -66.11 -36.16 82.43 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.87 0.322 . . . . 10.0 111.87 -178.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.423 ' HB2' ' SD ' ' A' ' 77' ' ' MET . 19.7 m -103.01 13.48 34.2 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 111.807 0.299 . . . . 10.0 111.807 -179.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 54.67 43.33 30.33 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.414 0.626 . . . . 10.0 111.29 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.459 ' HE1' HD11 ' A' ' 126' ' ' LEU . 64.2 mtp -102.97 160.49 14.57 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.205 -179.647 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -97.41 154.29 17.56 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 36.7 tp -122.01 133.89 54.81 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.483 0.659 . . . . 10.0 111.438 -179.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.451 ' HB2' HD13 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -114.76 95.39 5.21 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.145 -0.934 . . . . 10.0 109.03 179.04 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.504 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 9.8 t80 -99.94 95.79 7.12 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.987 0.422 . . . . 10.0 109.993 -179.427 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 20.8 m-20 -98.83 10.7 40.73 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.752 -179.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.504 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 40.4 mt -71.0 142.55 87.81 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.13 179.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.36 -39.23 92.63 Favored 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.842 2.361 . . . . 10.0 112.349 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 37.9 m -148.07 171.92 15.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.675 0.274 . . . . 10.0 110.585 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -82.32 135.57 35.18 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -113.17 128.62 56.53 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.999 -0.281 . . . . 10.0 110.279 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.0 OUTLIER -70.51 148.26 48.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.243 179.614 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.36 109.18 0.72 Allowed 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.407 HG12 ' H ' ' A' ' 90' ' ' ILE . 8.4 pt -55.94 -37.05 46.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.417 -0.81 . . . . 10.0 112.503 -178.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 151.95 -70.62 0.3 Allowed Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.193 -1.003 . . . . 10.0 112.995 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -55.31 -16.88 14.36 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.544 2.829 . . . . 10.0 113.422 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.488 HG12 ' HB2' ' A' ' 57' ' ' ALA . 21.4 t -59.94 -35.57 61.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.905 179.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.699 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.7 OUTLIER -71.4 -8.71 55.55 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.25 0.463 . . . . 10.0 112.25 -179.106 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.15 -1.98 57.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.885 0.374 . . . . 10.0 111.208 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 36.9 mt -93.78 107.05 18.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 109.695 -0.483 . . . . 10.0 109.695 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -133.97 91.54 2.83 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.141 0.496 . . . . 10.0 111.792 -179.257 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.6 t -130.33 155.2 46.73 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.117 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.3 p -87.33 -18.26 30.52 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 121.003 0.43 . . . . 10.0 110.522 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.5 m -88.72 108.53 19.53 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.648 179.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.411 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 11.3 p -57.36 -33.52 43.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.632 -178.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -67.72 -39.7 84.31 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -66.61 -42.89 86.13 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.29 -50.6 66.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.344 -0.844 . . . . 10.0 110.338 178.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.45 -35.94 79.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.996 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 48.0 m -64.53 -45.11 88.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.578 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -72.07 -38.07 69.49 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.597 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 62.8 mt -60.14 -50.72 72.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.666 179.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 72.2 m -58.34 -28.87 65.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.305 -0.407 . . . . 10.0 112.054 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.42 -37.24 82.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.19 0.519 . . . . 10.0 110.545 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 11.0 t -86.06 -41.01 14.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 121.424 0.63 . . . . 10.0 110.324 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.528 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 14.2 m-30 -66.56 -26.88 67.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.857 -1.065 . . . . 10.0 113.11 -178.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.91 -31.21 64.67 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.787 0.292 . . . . 10.0 111.787 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.22 -14.5 60.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.853 0.359 . . . . 10.0 111.232 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -107.83 -10.65 15.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.242 -0.436 . . . . 10.0 111.088 -179.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 95.2 31.79 7.41 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.645 -0.788 . . . . 10.0 113.155 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.528 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 69.1 t -131.1 142.43 43.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.871 0.367 . . . . 10.0 110.993 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.409 ' HB2' HG13 ' A' ' 131' ' ' VAL . 0.5 OUTLIER -135.46 138.02 42.77 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 178.517 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' ' 127' ' ' LEU . 14.4 m -130.99 143.72 40.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.143 0.496 . . . . 10.0 111.157 -179.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 19.9 m -152.64 153.38 33.21 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.865 179.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.441 HG22 ' CD1' ' A' ' 126' ' ' LEU . 5.7 t -106.1 118.16 53.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 68.7 m -140.43 118.46 11.89 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.561 -0.291 . . . . 10.0 111.05 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.88 51.06 4.86 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.607 -0.724 . . . . 10.0 112.021 179.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.7 t30 58.49 28.08 16.44 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.262 179.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -136.2 135.68 39.32 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.321 -0.4 . . . . 10.0 110.301 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.459 HD11 ' HE1' ' A' ' 77' ' ' MET . 2.5 mm? -88.84 121.71 31.48 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.916 -0.772 . . . . 10.0 108.916 178.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.451 HD13 ' HB2' ' A' ' 80' ' ' SER . 4.6 mm? -102.19 115.74 31.19 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.946 0.403 . . . . 10.0 110.412 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 2.7 t -112.02 118.38 57.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 N-CA-C 108.501 -0.926 . . . . 10.0 108.501 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -136.2 144.68 48.98 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-O 120.814 0.34 . . . . 10.0 111.114 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -75.8 141.63 24.63 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.254 1.969 . . . . 10.0 111.213 178.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.409 HG13 ' HB2' ' A' ' 118' ' ' SER . 7.6 m . . . . . 0 C--N 1.323 -0.579 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.504 179.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.9 t80 . . . . . 0 C--O 1.235 0.306 0 CA-C-O 121.058 0.456 . . . . 10.0 111.038 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.6 m -95.46 120.87 36.46 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.593 -0.731 . . . . 10.0 110.642 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.498 ' CE2' HG22 ' A' ' 101' ' ' VAL . 36.7 m-85 -82.11 112.29 19.02 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.314 -0.624 . . . . 10.0 109.314 179.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -153.05 160.33 42.95 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.188 -179.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.582 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -76.23 137.63 40.09 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.736 -0.468 . . . . 10.0 109.736 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.433 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 40.0 p -121.9 163.19 32.86 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.426 -178.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.433 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 71.7 Cg_endo -79.64 10.39 3.1 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 121.443 1.429 . . . . 10.0 112.15 179.013 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 22.1 mmt -112.62 -12.77 13.38 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 113.518 0.933 . . . . 10.0 113.518 -178.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.47 -66.17 0.66 Allowed 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.336 -0.546 . . . . 10.0 110.54 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.92 -63.73 0.27 Allowed Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 120.995 -0.621 . . . . 10.0 111.734 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 82.1 p -128.93 175.63 8.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.729 0.299 . . . . 10.0 110.893 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 50.7 tp -57.95 -41.96 83.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.526 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -60.0 -51.11 71.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.775 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.01 -41.34 97.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.308 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 41.1 ttp -61.41 -50.87 71.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.761 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 93.6 mt -63.77 -41.34 97.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.784 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -60.06 -41.59 92.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.531 179.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 70' ' ' ARG . 11.6 ttm180 -65.67 -44.62 85.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.465 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 44.9 m0 -58.69 -48.25 81.75 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.458 0.647 . . . . 10.0 110.093 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.93 -46.13 79.32 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.105 -0.952 . . . . 10.0 111.416 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -56.88 -45.32 82.63 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.359 0.503 . . . . 10.0 112.359 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -64.08 -32.1 73.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.147 0.498 . . . . 10.0 110.811 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.9 m -98.41 12.0 36.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.932 -0.577 . . . . 10.0 111.925 -178.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 56.06 43.41 27.06 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.363 0.601 . . . . 10.0 111.204 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 72.2 mtp -117.05 173.85 6.43 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.721 -179.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -114.45 166.82 11.29 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.558 -179.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.1 tp -136.62 138.65 41.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.961 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.492 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 35.5 m -121.4 96.93 5.28 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.378 -0.828 . . . . 10.0 110.475 179.471 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.49 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 8.0 t80 -89.67 108.17 19.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.033 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -103.84 12.84 33.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.971 0.415 . . . . 10.0 111.578 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.465 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 35.0 mt -87.09 144.97 37.15 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.796 -0.446 . . . . 10.0 109.796 179.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -57.69 -46.71 25.09 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.876 2.384 . . . . 10.0 112.845 -179.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.0 m -133.65 161.41 34.72 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.474 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.49 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 2.3 p30 -78.08 147.83 34.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.152 -0.476 . . . . 10.0 109.924 179.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -120.02 139.38 52.59 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.142 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.57 153.58 31.08 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.542 HD22 ' H ' ' A' ' 89' ' ' LEU . 0.5 OUTLIER -60.33 122.38 14.38 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 179.239 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.7 pt -62.7 -29.8 47.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 113.086 0.773 . . . . 10.0 113.086 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 144.85 -64.77 0.46 Allowed Glycine 0 CA--C 1.517 0.164 0 C-N-CA 120.054 -1.07 . . . . 10.0 112.749 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.419 ' HG2' HG11 ' A' ' 111' ' ' VAL . 33.8 Cg_endo -65.36 0.91 2.39 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.748 2.298 . . . . 10.0 112.847 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.8 t -67.8 -42.75 86.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.049 0.452 . . . . 10.0 110.365 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.582 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.7 OUTLIER -64.59 -15.08 60.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.321 179.096 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -80.31 -7.27 58.97 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.924 0.392 . . . . 10.0 110.573 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 29.8 mt -96.37 110.85 25.37 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 116.051 -0.522 . . . . 10.0 109.879 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.402 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 11.0 m -139.73 95.54 2.93 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.447 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.0 t -131.45 155.97 46.44 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.827 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -88.9 -14.44 36.78 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.086 0.47 . . . . 10.0 110.965 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.3 m -92.84 124.74 37.05 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.513 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.498 HG22 ' CE2' ' A' ' 55' ' ' TYR . 1.2 t -62.22 -46.33 96.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.12 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -60.86 -32.87 72.28 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.467 -0.788 . . . . 10.0 110.907 -179.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -71.97 -41.04 68.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.229 -0.441 . . . . 10.0 109.884 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.34 -50.17 75.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.698 -0.683 . . . . 10.0 110.664 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.77 -37.54 87.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.159 0.504 . . . . 10.0 110.694 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 37.4 m -63.76 -49.19 73.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.806 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.34 -40.37 93.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.492 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 47.7 mt -60.57 -51.09 70.89 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.331 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.4 m -58.5 -33.25 69.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.354 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.32 -40.19 93.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.939 0.4 . . . . 10.0 111.048 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.419 HG11 ' HG2' ' A' ' 92' ' ' PRO . 3.9 t -87.78 -39.76 13.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.359 0.6 . . . . 10.0 111.105 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.51 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 12.7 m-30 -66.58 -24.64 66.37 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.36 -0.836 . . . . 10.0 112.711 -178.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -51.43 -37.43 48.5 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.889 0.329 . . . . 10.0 111.889 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.66 -9.48 54.4 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.807 0.337 . . . . 10.0 111.592 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -112.35 2.33 16.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.864 0.364 . . . . 10.0 110.188 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 77.92 26.36 60.51 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 115.841 -0.618 . . . . 10.0 113.049 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.51 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 96.3 t -121.85 140.46 45.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.607 0.242 . . . . 10.0 110.734 -179.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . 0.472 ' HB2' HG13 ' A' ' 131' ' ' VAL . 3.4 t -139.21 140.72 37.84 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.563 -0.532 . . . . 10.0 109.563 179.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.449 HG12 HG22 ' A' ' 128' ' ' VAL . 9.8 m -131.19 139.81 50.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.897 0.379 . . . . 10.0 110.657 -179.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.1 m -142.89 156.83 44.98 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.605 -0.27 . . . . 10.0 110.382 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.53 HG22 ' CD2' ' A' ' 126' ' ' LEU . 5.3 t -109.43 114.44 46.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 108.65 -0.87 . . . . 10.0 108.65 179.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 15.8 m -132.83 118.2 18.68 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.668 -178.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 63.6 42.33 6.54 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.674 0.609 . . . . 10.0 110.752 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 5.4 t30 61.04 27.81 17.64 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.784 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.492 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 36.5 tttt -130.0 135.54 48.4 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.53 ' CD2' HG22 ' A' ' 121' ' ' VAL . 88.2 mt -88.55 122.63 32.22 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.704 0.288 . . . . 10.0 110.232 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -108.2 125.83 52.09 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.699 -179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.449 HG22 HG12 ' A' ' 119' ' ' VAL . 6.6 t -113.57 119.95 62.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.36 -0.607 . . . . 10.0 109.36 178.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -140.82 148.09 51.11 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.634 0.254 . . . . 10.0 110.51 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -76.89 147.2 26.88 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.378 2.052 . . . . 10.0 111.913 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . 0.472 HG13 ' HB2' ' A' ' 118' ' ' SER . 2.8 m . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.922 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.423 ' CD2' ' HB3' ' A' ' 74' ' ' ASP . 13.6 t80 . . . . . 0 C--O 1.234 0.239 0 CA-C-O 120.603 0.24 . . . . 10.0 110.364 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.1 m -79.14 118.49 21.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.284 0.564 . . . . 10.0 111.084 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -83.5 109.31 17.26 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.751 -0.658 . . . . 10.0 110.184 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.42 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 12.0 pt20 -147.36 154.82 41.36 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.829 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.44 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -85.42 124.59 32.18 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.049 0.452 . . . . 10.0 110.0 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.432 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 73.0 p -117.01 158.91 42.94 Favored Pre-proline 0 C--N 1.317 -0.807 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.225 -179.459 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . 0.432 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 45.2 Cg_endo -68.23 -7.98 21.55 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 121.997 1.798 . . . . 10.0 111.322 179.061 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 52.3 mtm -82.85 -20.33 35.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.82 179.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -75.64 -59.39 2.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.857 -0.61 . . . . 10.0 109.461 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 91.51 -61.98 2.77 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.799 -0.715 . . . . 10.0 112.938 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 49.5 p -124.45 166.29 16.27 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.939 0.399 . . . . 10.0 111.551 -179.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.461 HD13 ' HE2' ' A' ' 112' ' ' TYR . 45.2 tp -56.85 -44.73 82.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.492 -0.776 . . . . 10.0 111.217 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.452 ' O ' ' HG3' ' A' ' 69' ' ' GLU . 36.9 ttmt -59.87 -53.62 55.81 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.379 -179.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . 0.559 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 2.3 m -57.49 -43.81 84.46 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.423 -0.353 . . . . 10.0 111.069 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 52.0 ttp -57.63 -51.52 69.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.121 0.486 . . . . 10.0 110.407 179.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 77.0 mt -64.95 -36.86 85.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.131 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 22.3 mt-10 -63.86 -41.0 97.88 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 110.261 -0.274 . . . . 10.0 110.261 179.002 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.559 ' HG2' ' O ' ' A' ' 66' ' ' THR . 32.0 mmt180 -69.32 -39.26 78.33 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 179.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 37.6 m0 -61.93 -54.77 37.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.734 179.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.591 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -59.89 -44.11 94.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.531 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.95 -36.25 83.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.734 0.302 . . . . 10.0 111.541 -179.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 70' ' ' ARG . 0.5 OUTLIER -73.28 -12.89 61.01 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.887 0.375 . . . . 10.0 111.424 -179.304 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.5 m -120.58 12.28 11.48 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.437 -0.347 . . . . 10.0 111.312 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 62.2 t30 56.05 51.68 11.6 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.358 0.599 . . . . 10.0 110.619 179.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.422 ' HG2' ' OD1' ' A' ' 124' ' ' ASN . 71.1 mtp -124.27 171.17 10.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.984 -0.553 . . . . 10.0 111.029 -179.093 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.411 ' HB2' ' HG3' ' A' ' 125' ' ' LYS . 37.6 mm-40 -101.68 164.87 11.52 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.063 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.7 tp -141.52 142.48 33.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.344 0.593 . . . . 10.0 111.473 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.449 ' HB2' ' HG ' ' A' ' 127' ' ' LEU . 12.9 m -131.12 97.38 4.28 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.13 -0.941 . . . . 10.0 110.525 179.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.644 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 15.7 t80 -91.01 103.48 16.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.298 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -93.41 0.99 57.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.766 0.317 . . . . 10.0 111.65 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.644 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 2.1 mm? -74.33 137.13 75.01 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.316 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.56 -26.66 54.12 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.969 2.446 . . . . 10.0 112.577 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 57.2 m -141.19 161.92 36.71 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.946 0.403 . . . . 10.0 111.033 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.402 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 6.6 p-10 -85.91 143.67 28.07 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.974 179.262 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -121.37 134.91 55.13 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.223 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.07 161.37 29.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.57 -0.286 . . . . 10.0 110.371 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.98 107.96 3.33 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.0 pt -47.99 -46.13 12.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.621 -0.718 . . . . 10.0 112.533 -178.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 165.38 -69.33 0.19 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.044 -1.074 . . . . 10.0 112.881 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -56.41 -13.4 10.16 Favored 'Trans proline' 0 N--CA 1.478 0.583 0 C-N-CA 123.661 2.907 . . . . 10.0 113.39 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.421 ' H ' HG23 ' A' ' 93' ' ' VAL . 2.1 t -60.47 -36.31 68.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.246 0.546 . . . . 10.0 110.346 179.692 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.44 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.8 m -69.34 -12.0 61.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.605 -0.725 . . . . 10.0 111.51 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.48 -1.19 53.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.936 0.398 . . . . 10.0 110.921 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.42 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 53.6 mt -98.36 113.72 33.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.801 -0.444 . . . . 10.0 109.801 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.1 m -142.29 95.39 2.79 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.979 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.0 t -131.02 153.58 49.1 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.549 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.09 -8.71 58.54 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.903 0.382 . . . . 10.0 111.315 179.498 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.8 t -100.02 119.18 37.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.578 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 12.8 p -65.78 -30.85 51.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-O 121.024 0.44 . . . . 10.0 110.255 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -69.07 -41.94 76.88 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 52.9 tp60 -66.43 -40.9 89.79 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.597 178.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.61 -49.09 78.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.331 179.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.82 -35.96 79.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.169 0.509 . . . . 10.0 110.221 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 95.0 m -66.14 -49.29 67.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.965 179.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -65.8 -44.73 84.81 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.028 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 64.1 mt -59.85 -49.24 78.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.676 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 49.4 m -62.38 -23.45 66.82 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.551 0.204 . . . . 10.0 111.551 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.79 -41.43 78.74 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.837 0.351 . . . . 10.0 110.656 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.426 HG13 ' HD1' ' A' ' 112' ' ' TYR . 3.4 p -89.03 -32.63 5.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.408 0.623 . . . . 10.0 111.326 179.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.461 ' HE2' HD13 ' A' ' 64' ' ' LEU . 3.5 m-30 -77.67 -23.42 49.6 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.254 0.835 . . . . 10.0 113.254 -178.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.08 -49.32 42.28 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 111.78 0.289 . . . . 10.0 111.78 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.85 -22.86 67.07 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.112 0.482 . . . . 10.0 111.441 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -84.89 -15.02 45.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.264 0.554 . . . . 10.0 110.306 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 94.68 25.99 14.16 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.747 -0.739 . . . . 10.0 112.275 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . 0.424 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 95.4 t -129.54 138.39 54.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.929 0.395 . . . . 10.0 110.877 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.1 m -138.34 120.98 16.27 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.058 0.456 . . . . 10.0 110.314 178.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.512 HG12 HG13 ' A' ' 128' ' ' VAL . 3.9 m -104.78 137.46 33.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.171 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.96 140.47 23.38 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.191 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 1.7 p -107.96 123.2 63.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.186 0.517 . . . . 10.0 109.685 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 56.4 m -143.72 132.99 23.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.578 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 59.1 39.86 22.65 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.317 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . 0.422 ' OD1' ' HG2' ' A' ' 77' ' ' MET . 18.8 t30 63.81 24.18 13.68 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.488 -0.778 . . . . 10.0 111.048 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.411 ' HG3' ' HB2' ' A' ' 78' ' ' GLN . 41.5 tttt -128.03 133.13 49.08 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.251 -179.605 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.591 HD12 ' HB2' ' A' ' 72' ' ' ALA . 17.2 mt -89.04 121.44 31.38 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.595 -0.891 . . . . 10.0 108.595 178.425 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.449 ' HG ' ' HB2' ' A' ' 80' ' ' SER . 0.3 OUTLIER -117.34 122.95 45.31 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.174 0.511 . . . . 10.0 110.876 -179.358 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.531 ' CG1' HD21 ' A' ' 83' ' ' LEU . 1.8 t -111.26 121.03 63.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.632 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -134.94 146.05 57.09 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.076 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -76.54 150.77 32.09 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.316 2.011 . . . . 10.0 111.676 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.323 -0.576 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.659 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.8 t80 . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 109.931 -0.396 . . . . 10.0 109.931 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.8 m -76.95 122.81 25.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.728 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' TYR . . . . . 0.465 ' O ' ' HA ' ' A' ' 97' ' ' SER . 95.2 m-85 -89.96 121.99 32.56 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.562 -0.744 . . . . 10.0 109.979 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.415 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 19.8 pt20 -152.21 153.06 33.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.688 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ALA . . . . . 0.446 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -86.17 121.26 28.52 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 52.2 p -111.54 154.41 43.86 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-O 120.69 0.281 . . . . 10.0 111.322 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.92 -10.54 27.26 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.726 2.284 . . . . 10.0 111.83 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 21.4 mmt -82.4 -18.54 41.61 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.189 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -79.35 -52.78 7.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.694 -0.685 . . . . 10.0 109.575 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 92.82 -67.35 1.85 Allowed Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.464 -0.789 . . . . 10.0 112.855 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . 0.498 HG21 ' OD2' ' A' ' 86' ' ' ASP . 28.4 p -118.58 169.39 9.83 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.79 0.329 . . . . 10.0 111.512 -179.19 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.525 HD13 ' CE2' ' A' ' 112' ' ' TYR . 41.2 tp -59.35 -36.43 75.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.679 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -61.16 -58.3 8.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.527 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.39 -33.31 75.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.161 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.448 ' HB2' ' O ' ' A' ' 63' ' ' THR . 4.4 tmm? -63.03 -54.8 32.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.733 -0.667 . . . . 10.0 111.166 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.0 mp -68.42 -31.52 70.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.317 -0.401 . . . . 10.0 111.263 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -57.84 -43.5 85.88 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.706 -0.479 . . . . 10.0 109.706 178.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -68.47 -42.35 78.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.119 179.483 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 25.4 m0 -55.85 -55.42 32.67 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.624 -0.717 . . . . 10.0 110.683 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.82 -45.54 85.79 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.072 -0.967 . . . . 10.0 111.702 -178.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.95 -40.76 90.07 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.929 0.344 . . . . 10.0 111.929 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -66.24 -27.83 68.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.012 0.434 . . . . 10.0 111.51 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.405 ' HB2' ' SD ' ' A' ' 77' ' ' MET . 4.0 m -108.76 11.65 26.18 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 -178.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 55.55 48.42 18.76 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.589 0.709 . . . . 10.0 110.67 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.405 ' SD ' ' HB2' ' A' ' 75' ' ' SER . 59.1 mtp -114.65 168.09 10.18 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.164 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.424 ' HB3' ' HG3' ' A' ' 125' ' ' LYS . 2.0 mm-40 -99.88 158.99 15.42 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.655 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 26.8 tp -132.83 128.26 36.31 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.571 0.7 . . . . 10.0 110.935 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.418 ' HB2' HD13 ' A' ' 127' ' ' LEU . 69.4 m -114.96 94.75 4.89 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 114.972 -1.013 . . . . 10.0 109.427 178.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.5 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 12.5 t80 -94.45 101.46 13.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.808 -179.164 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -105.23 28.37 7.36 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.99 0.424 . . . . 10.0 111.473 -179.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.49 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 34.2 mt -96.01 145.85 30.27 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.052 179.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.4 -38.43 89.33 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 123.183 2.589 . . . . 10.0 112.547 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.4 m -150.73 171.09 17.71 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.992 0.425 . . . . 10.0 110.888 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.5 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 8.9 p-10 -83.1 131.56 35.14 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.718 -0.674 . . . . 10.0 109.839 179.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -103.79 131.74 50.7 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.747 -179.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.65 150.8 48.53 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.441 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LEU . . . . . 0.449 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -58.28 108.86 0.67 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 120.977 0.418 . . . . 10.0 110.09 178.481 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.2 pt -52.57 -37.93 25.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.071 -0.968 . . . . 10.0 112.91 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 141.17 -72.38 0.4 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.291 -0.957 . . . . 10.0 112.071 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -57.07 -17.05 23.3 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 123.039 2.493 . . . . 10.0 112.367 179.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 10.2 p -63.8 -32.0 55.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.512 0.672 . . . . 10.0 110.267 178.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.446 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.4 m -72.53 -7.42 49.93 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.153 -0.931 . . . . 10.0 111.08 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.2 -4.72 48.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.315 0.578 . . . . 10.0 110.237 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.415 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 65.1 mt -92.2 112.51 25.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 CA-C-N 115.422 -0.808 . . . . 10.0 109.82 -179.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.465 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 1.7 m -142.61 97.9 3.2 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.605 -0.725 . . . . 10.0 109.821 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.1 t -131.38 157.16 44.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.747 0.308 . . . . 10.0 110.888 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.03 -21.79 39.88 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.786 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.2 t -90.16 119.03 30.14 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.771 0.32 . . . . 10.0 110.491 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.0 p -65.04 -31.69 55.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.85 0.357 . . . . 10.0 110.556 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -68.9 -41.24 78.51 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 109.546 -0.539 . . . . 10.0 109.546 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -66.75 -41.43 87.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.845 179.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.57 -47.09 76.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.158 178.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.11 -35.21 80.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.295 178.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 86.0 m -65.58 -48.42 72.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.228 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -65.17 -37.56 87.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.089 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.8 mp -63.91 -52.78 58.29 Favored 'General case' 0 C--O 1.219 -0.508 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.22 178.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.6 m -57.91 -29.61 65.24 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.967 0.358 . . . . 10.0 111.967 -179.307 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.2 -45.78 91.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.255 0.55 . . . . 10.0 110.51 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.718 HG13 ' HD1' ' A' ' 112' ' ' TYR . 11.9 p -89.55 -22.65 6.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.756 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' TYR . . . . . 0.718 ' HD1' HG13 ' A' ' 111' ' ' VAL . 3.7 m-85 -83.13 -24.08 32.74 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.143 0.794 . . . . 10.0 113.143 -178.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.63 -40.11 38.23 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.077 0.399 . . . . 10.0 112.077 -179.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.47 -19.49 63.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.103 0.478 . . . . 10.0 111.402 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -93.72 -2.57 53.63 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.398 0.618 . . . . 10.0 109.632 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.22 23.33 52.01 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 115.466 -0.788 . . . . 10.0 112.625 179.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 60.8 t -124.55 140.25 48.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.026 0.441 . . . . 10.0 111.546 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 6.6 m -139.94 122.6 16.34 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.359 -0.608 . . . . 10.0 109.359 178.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 10.8 m -114.65 149.35 16.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.143 0.497 . . . . 10.0 111.358 -178.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.0 p -152.13 170.47 19.89 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.088 -0.506 . . . . 10.0 109.872 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' VAL . . . . . 0.503 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.5 t -125.7 119.07 53.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.173 -0.677 . . . . 10.0 109.173 179.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 15.3 m -128.73 109.62 11.47 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.028 -179.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 58.99 57.69 3.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.63 -0.714 . . . . 10.0 112.06 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 19.9 t30 61.13 21.6 12.0 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.569 -0.742 . . . . 10.0 111.782 178.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.424 ' HG3' ' HB3' ' A' ' 78' ' ' GLN . 47.8 tttt -125.54 133.12 52.45 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.984 -0.376 . . . . 10.0 109.984 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.503 ' CD2' HG22 ' A' ' 121' ' ' VAL . 69.6 mt -87.95 122.23 31.31 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.511 -0.551 . . . . 10.0 109.511 179.307 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.418 HD13 ' HB2' ' A' ' 80' ' ' SER . 3.9 mm? -107.93 117.24 33.6 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.533 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 11.5 t -109.05 118.06 55.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 108.515 -0.92 . . . . 10.0 108.515 178.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -134.19 141.66 40.24 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-O 120.766 0.317 . . . . 10.0 110.569 -179.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -81.31 145.21 14.97 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.313 2.009 . . . . 10.0 111.365 179.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 1.7 m . . . . . 0 C--N 1.323 -0.579 0 C-N-CA 120.942 -0.303 . . . . 10.0 110.617 179.381 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.729 0 N-CA-C 111.421 -0.671 . . . . 10.0 111.421 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.5 m -142.44 134.28 27.02 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.034 0.445 . . . . 10.0 111.157 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -125.64 76.11 1.54 Allowed 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.732 -0.84 . . . . 10.0 108.732 178.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 17.5 ttt -68.47 110.41 4.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.584 -0.735 . . . . 10.0 110.929 -178.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.52 105.92 5.87 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.194 -0.457 . . . . 10.0 110.793 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -77.57 137.54 63.23 Favored Pre-proline 0 C--N 1.323 -0.571 0 N-CA-C 109.774 -0.454 . . . . 10.0 109.774 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.11 111.66 0.81 Allowed 'Trans proline' 0 C--O 1.235 0.349 0 C-N-CA 122.835 2.356 . . . . 10.0 112.037 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -120.03 145.79 40.69 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 116.096 -0.502 . . . . 10.0 110.538 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -79.67 149.78 21.14 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.708 2.272 . . . . 10.0 112.209 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -89.14 171.63 9.67 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.951 -0.388 . . . . 10.0 109.951 179.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -125.47 153.6 43.27 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.292 -0.413 . . . . 10.0 110.658 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 148.08 -126.39 2.32 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.847 -0.692 . . . . 10.0 111.846 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -157.02 27.18 0.51 Allowed Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.471 -0.871 . . . . 10.0 112.59 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 34.3 ptt180 -78.06 -30.31 49.69 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.829 0.347 . . . . 10.0 110.773 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 15.5 m95 -72.9 -44.65 61.01 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.165 -0.47 . . . . 10.0 110.569 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.45 -21.69 60.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.17 -179.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 -74.6 102.69 4.64 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.154 0.502 . . . . 10.0 110.35 179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 20.2 m -106.69 146.14 13.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-N 115.376 -0.829 . . . . 10.0 110.648 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -111.93 125.72 54.36 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.996 -0.547 . . . . 10.0 110.385 -179.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 4.9 p-80 -165.11 175.71 9.14 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.011 -0.54 . . . . 10.0 109.906 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -135.58 113.34 10.98 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.919 0.39 . . . . 10.0 111.142 179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -86.53 -35.13 19.72 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.606 -0.887 . . . . 10.0 108.606 178.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -98.5 -170.19 1.91 Allowed 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 114.702 -1.135 . . . . 10.0 108.923 178.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.74 143.43 84.63 Favored Pre-proline 0 C--N 1.318 -0.784 0 C-N-CA 120.736 -0.385 . . . . 10.0 110.026 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -55.38 -59.64 0.73 Allowed 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.61 2.207 . . . . 10.0 112.494 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.5 m -144.92 99.77 3.39 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.984 0.421 . . . . 10.0 110.873 179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -84.84 97.95 10.02 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.302 -0.408 . . . . 10.0 111.066 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 pt -119.96 90.86 44.73 Favored Pre-proline 0 C--N 1.32 -0.699 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.351 179.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -76.02 52.08 3.32 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 123.452 2.768 . . . . 10.0 112.825 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 18.6 tp -159.79 146.14 16.06 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 115.383 -0.826 . . . . 10.0 109.651 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -69.51 105.64 2.71 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.675 -0.491 . . . . 10.0 109.675 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.45 129.76 43.59 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.405 -0.816 . . . . 10.0 111.047 -179.327 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.7 m -134.07 103.46 5.8 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.076 -0.511 . . . . 10.0 110.245 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.1 t80 -75.54 130.33 38.68 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.496 -0.774 . . . . 10.0 110.703 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 10.6 m -85.41 119.03 25.32 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.099 -0.5 . . . . 10.0 110.219 179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 98.8 m-85 -88.64 113.34 24.11 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.022 -0.733 . . . . 10.0 109.022 179.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -153.73 158.57 41.17 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.792 -0.64 . . . . 10.0 110.018 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.52 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -73.85 139.08 44.81 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.817 -0.809 . . . . 10.0 108.817 178.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.2 p -126.23 161.82 49.8 Favored Pre-proline 0 C--N 1.319 -0.725 0 CA-C-N 116.5 -0.318 . . . . 10.0 111.353 -177.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -75.53 12.33 1.38 Allowed 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 121.93 1.754 . . . . 10.0 112.326 179.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 16.2 ptt? -111.27 -17.17 13.23 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.426 0.528 . . . . 10.0 112.426 -179.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -76.17 -61.67 1.87 Allowed 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.17 -0.612 . . . . 10.0 110.669 -179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.18 -53.59 2.49 Favored Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 120.731 -0.747 . . . . 10.0 112.019 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 61.8 p -126.78 166.44 17.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.727 0.298 . . . . 10.0 111.058 -179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.401 HD13 ' CE2' ' A' ' 112' ' ' TYR . 62.6 tp -56.23 -45.35 79.97 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.815 -0.63 . . . . 10.0 111.168 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.9 tmtt? -56.48 -54.57 44.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.876 -0.602 . . . . 10.0 110.646 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.89 -35.99 78.06 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.073 -0.512 . . . . 10.0 111.586 -179.555 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.413 ' HE3' HD21 ' A' ' 108' ' ' LEU . 50.5 ttp -64.03 -50.5 68.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.367 -0.378 . . . . 10.0 110.218 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 71.3 mt -64.76 -34.75 79.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.248 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -60.0 -50.02 75.4 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 115.724 -0.671 . . . . 10.0 110.163 178.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -66.43 -40.69 89.65 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.99 -0.55 . . . . 10.0 111.235 -179.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 31.3 m0 -57.64 -54.3 48.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.152 0.501 . . . . 10.0 110.829 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.92 -42.4 81.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.699 -0.682 . . . . 10.0 111.944 -179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.42 -40.56 78.6 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.564 0.579 . . . . 10.0 112.564 -178.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -60.5 -39.33 87.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.905 0.383 . . . . 10.0 111.415 -179.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.403 ' HB2' ' HG3' ' A' ' 77' ' ' MET . 8.7 m -97.78 11.98 35.4 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.344 -0.389 . . . . 10.0 111.36 -179.273 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.4 m120 56.06 39.96 30.35 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.888 -0.596 . . . . 10.0 111.532 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.403 ' HG3' ' HB2' ' A' ' 75' ' ' SER . 5.2 mtm -102.88 164.09 11.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.783 -0.644 . . . . 10.0 109.488 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 -96.82 157.86 15.7 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.565 -0.288 . . . . 10.0 110.953 -178.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 34.0 tp -128.74 138.06 51.91 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.194 0.521 . . . . 10.0 110.649 -179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.24 96.16 4.98 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.515 -0.766 . . . . 10.0 109.121 178.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.509 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 16.4 t80 -95.45 98.83 10.84 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.67 -0.695 . . . . 10.0 109.708 -179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -101.77 37.87 1.74 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.858 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.509 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 44.2 mt -106.01 142.15 24.24 Favored Pre-proline 0 C--N 1.321 -0.649 0 N-CA-C 109.146 -0.687 . . . . 10.0 109.146 178.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -61.04 -30.31 89.33 Favored 'Trans proline' 0 CA--C 1.529 0.23 0 C-N-CA 122.764 2.31 . . . . 10.0 113.313 -179.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 9.2 m -145.69 166.85 24.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.893 0.378 . . . . 10.0 111.494 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -95.38 124.97 39.68 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.214 -0.662 . . . . 10.0 109.214 179.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -110.27 156.7 20.33 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.554 0.216 . . . . 10.0 110.714 -178.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.8 OUTLIER -79.99 177.02 9.22 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.29 -0.414 . . . . 10.0 110.727 179.574 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -74.98 134.54 41.45 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.012 -0.366 . . . . 10.0 110.012 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.41 HG12 ' H ' ' A' ' 90' ' ' ILE . 1.7 pt -65.87 -28.8 44.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 112.517 0.562 . . . . 10.0 112.517 -179.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 138.03 -62.72 0.57 Allowed Glycine 0 CA--C 1.52 0.36 0 C-N-CA 120.296 -0.954 . . . . 10.0 113.618 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.86 7.99 1.47 Allowed 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 122.534 2.156 . . . . 10.0 113.151 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 2.9 t -69.41 -45.63 78.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.939 0.4 . . . . 10.0 110.658 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.52 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.0 OUTLIER -65.77 -13.75 60.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.142 -0.481 . . . . 10.0 111.593 179.85 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.68 1.8 47.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.031 0.443 . . . . 10.0 110.875 179.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.418 HD13 HD12 ' A' ' 108' ' ' LEU . 46.6 mt -107.62 107.2 22.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.953 -0.567 . . . . 10.0 110.181 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -130.4 97.61 4.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.048 0.451 . . . . 10.0 111.128 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.2 t -130.74 155.95 45.78 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.114 -0.494 . . . . 10.0 110.711 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -90.12 -6.26 55.6 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.235 0.541 . . . . 10.0 110.816 179.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 19.4 t -98.46 116.24 30.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.738 -0.665 . . . . 10.0 110.287 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.8 p -65.15 -31.63 54.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.186 0.517 . . . . 10.0 110.059 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -68.12 -43.47 78.33 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.663 -0.699 . . . . 10.0 109.798 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.6 tp60 -67.77 -41.21 83.63 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.286 -0.416 . . . . 10.0 110.343 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.96 -49.15 72.1 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.165 -0.471 . . . . 10.0 110.413 179.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.16 -36.95 85.84 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.461 179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 98.9 m -63.37 -43.81 96.58 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.824 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -70.78 -41.36 71.81 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.087 -0.506 . . . . 10.0 110.454 179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.418 HD12 HD13 ' A' ' 96' ' ' ILE . 2.0 mp -61.92 -51.17 69.22 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.91 179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 4.7 p -58.31 -25.52 61.96 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.172 0.434 . . . . 10.0 112.172 -178.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.36 -43.65 66.52 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.029 0.443 . . . . 10.0 111.149 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.439 HG13 ' HD1' ' A' ' 112' ' ' TYR . 10.5 p -87.56 -24.5 6.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.203 0.525 . . . . 10.0 111.291 -179.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.439 ' HD1' HG13 ' A' ' 111' ' ' VAL . 8.0 m-85 -79.79 -24.28 41.57 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.019 -0.537 . . . . 10.0 111.795 -179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.485 ' O ' HG21 ' A' ' 133' ' ' VAL . . . -51.28 -36.43 42.27 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.438 -0.346 . . . . 10.0 111.643 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -63.65 -27.09 68.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.959 0.409 . . . . 10.0 111.664 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -91.97 -11.98 34.61 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.715 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.449 ' HA2' HG23 ' A' ' 131' ' ' VAL . . . 93.45 27.46 13.13 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.622 -0.799 . . . . 10.0 112.107 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 57.8 t -124.53 125.67 70.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.798 0.332 . . . . 10.0 111.076 -179.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 1.4 m -122.67 113.87 19.82 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.188 178.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 16.4 m -105.39 142.33 18.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.051 -0.522 . . . . 10.0 110.801 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 41.6 m -152.46 166.27 32.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.015 179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.504 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.5 t -117.73 128.4 74.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 N-CA-C 110.111 -0.329 . . . . 10.0 110.111 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 22.6 m -147.6 120.86 8.94 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.728 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 61.68 43.13 10.11 Favored 'General case' 0 N--CA 1.467 0.416 0 O-C-N 123.636 0.585 . . . . 10.0 111.559 179.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 19.1 m120 62.33 26.61 15.91 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 115.734 -0.666 . . . . 10.0 110.727 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -130.31 132.8 46.04 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.579 -0.737 . . . . 10.0 109.61 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.504 ' CD2' HG22 ' A' ' 121' ' ' VAL . 97.4 mt -88.61 122.72 32.36 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 108.62 -0.882 . . . . 10.0 108.62 179.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -112.79 122.76 48.59 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.331 0.586 . . . . 10.0 111.234 -178.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.2 t -108.17 119.21 57.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 115.513 -0.767 . . . . 10.0 109.269 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 11.3 mm-40 -128.45 138.49 33.16 Favored Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 110.032 -0.358 . . . . 10.0 110.032 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.425 ' HA ' ' O ' ' A' ' 116' ' ' GLY . 69.4 Cg_endo -77.96 135.02 13.66 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 121.98 1.786 . . . . 10.0 111.855 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.449 HG23 ' HA2' ' A' ' 116' ' ' GLY . 3.2 m -108.65 145.0 30.71 Favored Pre-proline 0 C--N 1.319 -0.727 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.347 179.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -77.99 103.21 1.67 Allowed 'Trans proline' 0 N--CA 1.459 -0.51 0 C-N-CA 122.465 2.11 . . . . 10.0 112.251 -179.496 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.485 HG21 ' O ' ' A' ' 113' ' ' ALA . 2.5 m -136.71 26.33 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.111 -0.495 . . . . 10.0 110.591 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 7.7 m -89.75 -24.19 21.59 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.911 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 14.1 m -150.08 101.01 2.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.931 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -79.79 -18.37 73.0 Favored Glycine 0 N--CA 1.451 -0.354 0 CA-C-N 115.937 -0.574 . . . . 10.0 112.789 -179.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -118.26 43.37 2.48 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.105 0.479 . . . . 10.0 110.657 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 1.3 pptp? -87.06 170.09 11.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.019 -0.537 . . . . 10.0 110.103 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 14.7 tp . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.641 -0.695 . . . . 10.0 109.6 179.504 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.718 0 N-CA-C 111.682 -0.567 . . . . 10.0 111.682 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.5 m -58.94 113.63 2.17 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.696 0.284 . . . . 10.0 110.421 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 31.1 t-80 -111.56 102.46 10.8 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.025 0.44 . . . . 10.0 110.51 -179.323 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 34.8 tpp -96.96 91.97 5.87 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.925 -0.579 . . . . 10.0 110.073 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' A' ' 25' ' ' LYS . 0.2 OUTLIER -86.71 -36.42 18.69 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.956 -0.565 . . . . 10.0 110.807 179.857 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.409 ' HB2' ' O ' ' A' ' 24' ' ' THR . 13.1 mmtm 68.67 134.77 0.04 OUTLIER Pre-proline 0 N--CA 1.465 0.278 0 O-C-N 124.044 0.84 . . . . 10.0 111.504 -179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -64.17 109.33 1.12 Allowed 'Trans proline' 0 N--CA 1.464 -0.231 0 C-N-CA 122.55 2.167 . . . . 10.0 111.866 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -129.83 142.28 44.79 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.638 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_endo -66.19 117.58 4.8 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.639 2.226 . . . . 10.0 111.457 -179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -70.23 -61.14 1.89 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.077 -0.51 . . . . 10.0 111.371 -179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 5.1 m-85 -153.04 175.76 12.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.344 -0.389 . . . . 10.0 110.064 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -92.58 41.52 2.75 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.977 -0.63 . . . . 10.0 112.087 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -86.95 -74.45 1.28 Allowed Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.723 -0.751 . . . . 10.0 112.233 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.4 tpp85 63.93 23.49 13.35 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 123.098 0.559 . . . . 10.0 111.606 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 50.4 m95 59.57 80.41 0.2 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-O 121.094 0.473 . . . . 10.0 110.855 -179.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -76.33 82.55 3.09 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.377 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -105.47 81.18 1.66 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.54 -0.754 . . . . 10.0 109.062 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -145.95 119.49 2.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.003 -0.544 . . . . 10.0 111.384 -179.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -146.81 116.54 7.17 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.322 -0.621 . . . . 10.0 109.322 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.0 p-80 -95.56 121.71 37.54 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.338 0.589 . . . . 10.0 111.241 -178.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 9.7 p90 -145.82 146.44 31.16 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.189 179.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -147.31 131.16 17.07 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.245 0.545 . . . . 10.0 110.301 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -136.2 166.54 23.18 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.818 -0.628 . . . . 10.0 110.676 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -139.6 141.85 29.67 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.036 -0.529 . . . . 10.0 109.87 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.73 65.11 6.7 Favored 'Trans proline' 0 N--CA 1.464 -0.234 0 C-N-CA 122.7 2.267 . . . . 10.0 112.489 -179.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.8 m -80.81 97.4 7.34 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.016 0.436 . . . . 10.0 111.198 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -119.32 144.47 46.82 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.148 -0.686 . . . . 10.0 109.148 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.0 pt -133.62 79.71 58.54 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-O 120.957 0.408 . . . . 10.0 111.003 -179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -72.13 106.11 1.97 Allowed 'Trans proline' 0 N--CA 1.462 -0.372 0 C-N-CA 122.564 2.176 . . . . 10.0 111.831 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 38.1 tp -126.64 144.99 50.74 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.037 -0.529 . . . . 10.0 110.166 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -107.43 133.54 51.78 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.512 -0.551 . . . . 10.0 109.512 179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.78 132.95 52.52 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.926 0.393 . . . . 10.0 111.183 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 10.0 m -138.6 94.48 2.85 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.864 -0.607 . . . . 10.0 109.652 179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -68.92 126.18 28.98 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.109 -0.496 . . . . 10.0 110.313 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 30.4 m -75.36 121.29 22.02 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.831 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -86.47 116.54 24.68 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.408 -0.814 . . . . 10.0 109.088 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -145.85 147.74 32.13 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.187 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.797 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -74.77 112.14 10.68 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.733 -0.469 . . . . 10.0 109.733 178.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.425 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 26.2 p -107.55 157.26 36.21 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 116.226 -0.443 . . . . 10.0 110.799 -179.143 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.425 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 37.3 Cg_endo -65.99 -11.21 30.03 Favored 'Trans proline' 0 C--N 1.344 0.333 0 C-N-CA 122.348 2.032 . . . . 10.0 111.255 178.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 51.3 mtt -77.74 -29.42 51.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.64 -0.709 . . . . 10.0 109.891 179.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -75.88 -51.67 12.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.741 -0.663 . . . . 10.0 109.221 179.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 81.2 -63.14 4.37 Favored Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.478 -0.783 . . . . 10.0 113.64 178.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 43.8 p -113.1 169.33 9.01 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.881 0.372 . . . . 10.0 111.67 -178.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.495 HD13 ' HE2' ' A' ' 112' ' ' TYR . 66.9 tp -63.46 -47.42 81.91 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.64 -0.709 . . . . 10.0 111.227 -179.468 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 34.1 ttmt -56.11 -55.99 26.28 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.382 -0.372 . . . . 10.0 111.222 -179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.0 m -61.37 -32.45 72.36 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.049 -0.523 . . . . 10.0 111.845 -179.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 55.9 ttp -68.99 -51.19 41.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.938 0.399 . . . . 10.0 110.35 179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 90.1 mt -62.35 -35.66 79.8 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.866 -0.606 . . . . 10.0 110.703 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -61.44 -40.94 96.31 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.318 -0.401 . . . . 10.0 110.558 179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.8 ttm-85 -68.66 -40.55 80.13 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.278 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.441 ' CZ3' ' HB1' ' A' ' 104' ' ' ALA . 43.7 m0 -64.13 -50.01 69.9 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.447 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.547 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -60.48 -37.14 80.1 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.082 -0.508 . . . . 10.0 111.199 179.376 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.45 -34.71 77.33 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.264 -0.425 . . . . 10.0 111.567 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -65.06 -41.32 95.21 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.093 -0.503 . . . . 10.0 111.331 -179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.76 7.69 45.59 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.33 0.492 . . . . 10.0 112.33 -177.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 60.72 53.22 4.04 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 121.59 0.71 . . . . 10.0 109.856 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.487 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 22.0 mtm -124.43 171.22 10.12 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.39 -0.823 . . . . 10.0 110.831 -179.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -106.24 171.11 7.53 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.468 -0.333 . . . . 10.0 110.585 179.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.3 tp -133.27 133.53 42.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.149 0.5 . . . . 10.0 111.578 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -119.24 95.9 4.99 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.467 -0.788 . . . . 10.0 109.506 178.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.467 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 6.7 t80 -88.98 98.52 11.8 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.697 -0.683 . . . . 10.0 109.394 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.419 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 64.3 m-80 -101.81 37.09 1.9 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.283 0.563 . . . . 10.0 110.898 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.437 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 33.7 mt -101.21 145.44 30.44 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.816 179.046 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -62.35 -40.29 41.06 Favored 'Trans proline' 0 N--CA 1.464 -0.232 0 C-N-CA 122.617 2.211 . . . . 10.0 111.531 179.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -138.72 141.85 38.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.727 -0.669 . . . . 10.0 110.083 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.467 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 15.1 t70 -78.56 131.31 36.72 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.741 -0.466 . . . . 10.0 109.741 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -100.58 148.19 25.09 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.111 0.482 . . . . 10.0 111.532 -178.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 6.9 m -81.84 147.52 29.31 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.594 -0.73 . . . . 10.0 110.494 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -54.31 123.81 14.02 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 121.097 0.475 . . . . 10.0 111.372 179.345 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.46 HD12 ' HG2' ' A' ' 92' ' ' PRO . 24.2 pt -80.99 -164.28 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.508 -0.769 . . . . 10.0 110.733 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -77.18 -68.84 1.46 Allowed Glycine 0 CA--C 1.522 0.511 0 C-N-CA 120.836 -0.697 . . . . 10.0 113.304 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.46 ' HG2' HD12 ' A' ' 90' ' ' ILE . 13.8 Cg_endo -56.96 -14.55 14.55 Favored 'Trans proline' 0 N--CA 1.477 0.517 0 C-N-CA 123.592 2.861 . . . . 10.0 115.267 -178.111 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.413 HG22 ' HB2' ' A' ' 57' ' ' ALA . 12.6 p -68.93 -40.49 81.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 121.303 0.573 . . . . 10.0 110.406 179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.797 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 2.1 m -67.82 -12.52 60.78 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.556 -0.747 . . . . 10.0 111.379 179.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.06 1.84 56.78 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.322 -0.399 . . . . 10.0 111.298 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 54.4 mt -96.69 111.39 26.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.254 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.7 m -130.11 100.67 5.5 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.675 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 15.4 t -129.72 155.46 45.87 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.272 -0.422 . . . . 10.0 110.785 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.64 10.09 38.0 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 112.085 0.402 . . . . 10.0 112.085 -179.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.6 t -125.55 127.49 46.47 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.679 0.276 . . . . 10.0 110.71 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 6.0 p -66.4 -28.59 43.93 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.252 0.548 . . . . 10.0 110.249 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -70.72 -44.83 66.08 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.588 -0.733 . . . . 10.0 109.565 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.6 tp60 -66.63 -38.62 87.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.871 -0.604 . . . . 10.0 109.902 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.441 ' HB1' ' CZ3' ' A' ' 71' ' ' TRP . . . -56.6 -50.42 72.03 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.718 -0.674 . . . . 10.0 110.864 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.48 -29.93 71.13 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-O 121.265 0.555 . . . . 10.0 110.551 179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 36.9 m -69.03 -50.85 44.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.67 -0.695 . . . . 10.0 110.972 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -67.73 -36.96 81.53 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.055 -0.52 . . . . 10.0 111.652 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 26.7 mt -59.51 -50.01 75.57 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.704 0.288 . . . . 10.0 110.814 179.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 14.6 m -60.52 -27.76 67.87 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.356 -0.384 . . . . 10.0 111.937 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.89 -41.67 77.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.825 0.345 . . . . 10.0 111.144 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 4.8 p -87.48 -35.55 8.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-O 121.037 0.446 . . . . 10.0 111.585 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.495 ' HE2' HD13 ' A' ' 64' ' ' LEU . 4.0 m-30 -71.49 -22.19 61.83 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 113.213 0.82 . . . . 10.0 113.213 -178.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.45 ' O ' HG21 ' A' ' 133' ' ' VAL . . . -55.39 -22.61 20.55 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.614 0.245 . . . . 10.0 111.334 179.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.07 -31.04 71.69 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-O 120.958 0.409 . . . . 10.0 110.615 179.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 26.5 mp0 -94.46 -24.11 17.44 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.314 0.578 . . . . 10.0 109.964 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 106.77 34.37 3.06 Favored Glycine 0 N--CA 1.444 -0.77 0 CA-C-N 115.613 -0.721 . . . . 10.0 112.484 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.447 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 75.8 t -124.44 135.96 62.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 120.743 0.306 . . . . 10.0 110.298 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.1 m -136.1 132.22 35.82 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.108 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 7.5 m -120.73 149.29 23.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.275 0.56 . . . . 10.0 111.87 -178.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 58.3 m -155.21 154.45 32.26 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.866 -0.606 . . . . 10.0 109.668 179.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 1.7 p -110.83 119.55 59.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-O 120.981 0.419 . . . . 10.0 109.896 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 41.0 m -137.14 128.47 28.14 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.938 -0.574 . . . . 10.0 110.221 -179.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 58.49 43.6 19.21 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 123.692 0.62 . . . . 10.0 111.447 179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.487 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 9.8 m-20 58.27 39.28 25.8 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.902 0.858 . . . . 10.0 110.193 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 69.5 tttt -145.3 128.94 17.14 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 114.892 -1.049 . . . . 10.0 109.239 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.547 HD12 ' HB2' ' A' ' 72' ' ' ALA . 20.7 mt -88.01 121.73 30.76 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 108.265 -1.013 . . . . 10.0 108.265 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.38 123.93 51.23 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-O 121.163 0.506 . . . . 10.0 111.428 -178.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.419 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 2.9 t -102.11 120.82 52.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.223 179.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -129.91 133.33 24.88 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.112 -179.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -79.23 131.9 9.99 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.113 1.875 . . . . 10.0 111.993 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 4.5 m -99.66 139.75 21.08 Favored Pre-proline 0 C--N 1.318 -0.803 0 CA-C-N 116.117 -0.492 . . . . 10.0 110.18 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -80.27 94.12 1.02 Allowed 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 122.637 2.225 . . . . 10.0 111.377 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.45 HG21 ' O ' ' A' ' 113' ' ' ALA . 6.0 m -126.49 24.55 2.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 121.249 0.547 . . . . 10.0 111.177 -179.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.52 -23.05 19.22 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.772 -179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.84 166.2 29.23 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.218 -179.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -90.62 -73.34 1.27 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.873 -0.68 . . . . 10.0 112.069 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -145.42 96.7 2.87 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.943 0.401 . . . . 10.0 110.535 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 9.9 ptmt -126.48 166.59 16.95 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.083 -0.508 . . . . 10.0 110.478 179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 31.0 tp . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.579 -0.724 . . . . 10.0 109.719 179.467 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.691 0 N-CA-C 111.957 -0.457 . . . . 10.0 111.957 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.9 m -105.33 154.39 20.34 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.959 -0.386 . . . . 10.0 109.959 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -64.92 135.67 55.96 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.091 -0.337 . . . . 10.0 110.091 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.5 mmt -76.48 -78.45 0.12 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.82 0.343 . . . . 10.0 110.742 -179.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 11.8 t -156.04 144.15 19.81 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.157 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 37.4 mtpt -104.98 140.66 21.3 Favored Pre-proline 0 C--N 1.322 -0.622 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.476 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -64.07 108.76 1.0 Allowed 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.801 2.334 . . . . 10.0 112.019 179.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.37 141.5 23.6 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.451 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_endo -64.1 123.66 12.24 Favored 'Trans proline' 0 C--O 1.237 0.435 0 C-N-CA 122.509 2.14 . . . . 10.0 111.681 -179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.79 -178.67 7.18 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.773 -0.649 . . . . 10.0 111.063 -179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 88.1 m-85 -127.33 154.1 45.37 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.711 -0.677 . . . . 10.0 110.444 -179.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -116.59 172.26 14.15 Favored Glycine 0 N--CA 1.444 -0.819 0 C-N-CA 120.936 -0.65 . . . . 10.0 111.786 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 89.55 15.0 59.09 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.948 -0.644 . . . . 10.0 111.988 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 33' ' ' ARG . 73.1 mtt180 -81.22 -14.12 57.85 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.992 0.425 . . . . 10.0 110.704 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 74.0 m95 -106.91 24.07 13.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.979 -0.555 . . . . 10.0 110.988 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 4.6 mtmp? -87.95 69.78 9.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.877 0.37 . . . . 10.0 110.995 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 -88.83 85.13 6.69 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.694 -0.484 . . . . 10.0 109.694 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.2 m -140.25 141.24 33.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.009 -0.541 . . . . 10.0 110.446 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -145.23 118.01 8.7 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.006 0.431 . . . . 10.0 110.552 179.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -84.25 59.53 5.41 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.18 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -78.32 119.37 21.57 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.581 -179.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -97.64 117.99 33.17 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.871 -0.604 . . . . 10.0 109.991 179.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -85.35 144.11 28.25 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.879 0.371 . . . . 10.0 111.13 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -157.38 143.49 12.89 Favored Pre-proline 0 C--N 1.322 -0.606 0 CA-C-N 115.602 -0.726 . . . . 10.0 110.428 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -70.72 117.22 5.02 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.487 2.125 . . . . 10.0 112.008 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.2 m -76.43 115.16 15.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.136 -0.484 . . . . 10.0 110.553 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -71.13 113.03 7.75 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.121 0.486 . . . . 10.0 110.618 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.7 pt -129.01 87.05 55.6 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.883 -0.599 . . . . 10.0 109.984 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_exo -70.85 81.91 1.04 Allowed 'Trans proline' 0 N--CA 1.464 -0.262 0 C-N-CA 123.127 2.551 . . . . 10.0 111.656 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 49' ' ' LEU . 0.3 OUTLIER -137.28 101.94 4.67 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.652 -0.704 . . . . 10.0 109.918 -179.876 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -99.5 149.4 23.26 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.612 -0.722 . . . . 10.0 109.646 179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.8 107.49 0.71 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.134 0.492 . . . . 10.0 111.009 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 9.8 m -146.94 88.25 1.73 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.771 -0.65 . . . . 10.0 109.959 179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -65.15 129.4 39.59 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.547 -0.751 . . . . 10.0 110.815 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.1 m -82.63 120.85 26.08 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.682 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 72.9 m-85 -86.81 113.14 22.38 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.022 -0.535 . . . . 10.0 110.11 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -152.07 151.39 31.04 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.476 -0.783 . . . . 10.0 109.721 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -85.33 125.84 33.26 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.889 -0.412 . . . . 10.0 109.889 179.298 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 37.7 p -105.31 149.56 37.88 Favored Pre-proline 0 C--N 1.321 -0.646 0 C-N-CA 120.885 -0.326 . . . . 10.0 110.704 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_endo -64.69 -12.29 33.15 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.643 2.228 . . . . 10.0 111.951 179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 40.1 mtt -85.25 -14.15 47.6 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.765 -0.652 . . . . 10.0 110.456 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -78.77 -48.64 14.47 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.259 -0.645 . . . . 10.0 109.259 179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.58 -64.18 4.34 Favored Glycine 0 N--CA 1.446 -0.66 0 CA-C-N 115.324 -0.853 . . . . 10.0 113.612 178.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 28.0 p -113.3 168.4 9.76 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 112.212 0.449 . . . . 10.0 112.212 -178.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 47.2 tp -66.01 -43.21 88.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.723 -0.671 . . . . 10.0 111.797 -179.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -55.25 -54.43 43.59 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.978 0.418 . . . . 10.0 110.42 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.1 m -64.75 -38.99 92.85 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.712 -0.676 . . . . 10.0 111.52 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.413 ' HB2' ' O ' ' A' ' 63' ' ' THR . 9.5 tmm? -61.89 -48.4 80.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.976 0.417 . . . . 10.0 111.164 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 57.6 mt -68.12 -31.35 70.88 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.029 -0.532 . . . . 10.0 111.319 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -62.24 -42.17 99.08 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.728 -0.471 . . . . 10.0 109.728 179.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' A' ' 74' ' ' ASP . 17.1 mmm-85 -60.6 -42.57 97.04 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.068 -0.515 . . . . 10.0 110.214 178.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 37.1 m0 -60.13 -55.29 35.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.59 -0.732 . . . . 10.0 111.07 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.49 -47.37 84.25 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.649 -0.705 . . . . 10.0 111.907 -179.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.46 -35.75 80.29 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.157 0.429 . . . . 10.0 112.157 -178.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.482 ' HB2' ' O ' ' A' ' 70' ' ' ARG . 0.4 OUTLIER -73.4 -23.97 60.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.756 0.312 . . . . 10.0 111.805 -179.211 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.4 t -108.63 7.15 26.45 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 120.854 -0.339 . . . . 10.0 111.555 -179.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 65.2 t30 62.18 38.84 13.33 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.606 0.717 . . . . 10.0 110.374 179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 68.3 mtp -111.08 173.6 6.26 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.689 -0.687 . . . . 10.0 110.219 -179.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.405 ' HB2' ' HG3' ' A' ' 125' ' ' LYS . 88.6 mm-40 -108.15 158.72 17.18 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.531 -0.304 . . . . 10.0 110.252 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.7 tp -133.07 136.91 46.18 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.984 0.421 . . . . 10.0 110.891 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.578 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 3.9 m -124.12 97.64 5.43 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.681 -0.691 . . . . 10.0 110.709 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.544 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 4.6 t80 -86.06 97.41 10.28 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.742 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -104.65 29.35 6.25 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.943 0.401 . . . . 10.0 111.03 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.544 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 57.4 mt -89.12 146.87 37.23 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.062 -0.517 . . . . 10.0 110.45 179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_endo -57.64 -35.85 98.7 Favored 'Trans proline' 0 C--N 1.343 0.249 0 C-N-CA 122.637 2.225 . . . . 10.0 111.856 179.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 32.0 m -151.31 155.98 39.85 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.904 -0.589 . . . . 10.0 109.924 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.417 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 37.7 t0 -77.84 130.83 37.14 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.603 -0.518 . . . . 10.0 109.603 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -104.73 140.04 38.65 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.03 0.443 . . . . 10.0 111.349 -178.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 2.9 m -81.27 149.04 29.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.74 -0.664 . . . . 10.0 110.34 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.436 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -55.28 112.81 1.18 Allowed 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 120.872 0.368 . . . . 10.0 110.817 179.564 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 11.0 pt -65.19 -36.72 78.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.862 -179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 149.36 -71.5 0.3 Allowed Glycine 0 CA--C 1.52 0.378 0 C-N-CA 120.38 -0.914 . . . . 10.0 113.335 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -50.78 -17.74 3.47 Favored 'Trans proline' 0 N--CA 1.48 0.694 0 C-N-CA 123.775 2.984 . . . . 10.0 113.832 -179.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.412 HG23 ' H ' ' A' ' 93' ' ' VAL . 0.4 OUTLIER -60.91 -37.26 76.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 121.118 0.485 . . . . 10.0 110.882 179.499 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -72.0 -9.08 57.88 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.979 -0.555 . . . . 10.0 111.494 -179.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -92.11 -0.93 57.44 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.164 0.507 . . . . 10.0 110.561 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.407 HD13 HD12 ' A' ' 108' ' ' LEU . 56.7 mt -100.34 116.39 43.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.962 -0.563 . . . . 10.0 109.525 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -142.49 95.48 2.8 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.037 -0.528 . . . . 10.0 110.736 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 11.9 t -130.91 154.32 48.22 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.142 -0.481 . . . . 10.0 110.449 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.02 -13.9 43.1 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.223 -0.444 . . . . 10.0 111.117 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 15.0 m -91.65 116.1 28.6 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.172 -0.467 . . . . 10.0 110.358 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.6 p -60.82 -36.48 71.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.298 -0.41 . . . . 10.0 111.351 -179.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -67.56 -38.06 83.56 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.125 0.488 . . . . 10.0 109.893 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -67.35 -42.63 83.2 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.885 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.62 -47.73 81.37 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.534 -0.757 . . . . 10.0 110.348 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.31 -34.05 76.86 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.767 -0.651 . . . . 10.0 110.482 179.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 81.8 m -68.58 -50.91 48.13 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.746 -0.661 . . . . 10.0 111.078 179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -64.04 -40.77 97.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.152 -0.476 . . . . 10.0 111.3 -179.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.407 HD12 HD13 ' A' ' 96' ' ' ILE . 2.1 mp -63.56 -49.28 74.05 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.581 -0.281 . . . . 10.0 110.513 179.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 28.4 m -61.38 -29.19 69.76 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 111.499 0.185 . . . . 10.0 111.499 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.15 -42.39 98.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.906 0.384 . . . . 10.0 110.785 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.6 p -88.61 -37.67 10.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 121.38 0.61 . . . . 10.0 111.245 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.555 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.5 m-30 -72.65 -23.13 60.86 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 113.994 1.109 . . . . 10.0 113.994 -177.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.29 -36.93 33.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.568 0.223 . . . . 10.0 111.216 179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.95 -32.23 70.38 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.948 0.404 . . . . 10.0 110.534 179.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -79.92 -9.85 59.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.439 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.445 ' HA2' HG23 ' A' ' 131' ' ' VAL . . . 89.28 26.77 24.87 Favored Glycine 0 N--CA 1.446 -0.677 0 CA-C-N 115.827 -0.624 . . . . 10.0 112.33 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.555 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 76.3 t -125.28 129.67 73.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.986 0.422 . . . . 10.0 111.053 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 8.0 t -127.46 113.07 15.7 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.288 -0.634 . . . . 10.0 109.288 179.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 2.6 m -102.28 135.72 37.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-O 121.168 0.509 . . . . 10.0 110.564 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -147.43 141.1 25.6 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.857 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.481 ' HB ' HD23 ' A' ' 126' ' ' LEU . 2.4 p -106.09 124.18 61.2 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-O 121.249 0.547 . . . . 10.0 109.68 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 64.5 m -142.47 123.12 14.18 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.768 -0.651 . . . . 10.0 110.72 -179.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.4 51.33 5.39 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.811 -0.631 . . . . 10.0 111.48 179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.6 m-20 57.41 28.87 16.04 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 115.711 -0.677 . . . . 10.0 111.815 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.578 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 50.5 tttt -136.29 131.82 34.91 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.321 -0.4 . . . . 10.0 109.991 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.481 HD23 ' HB ' ' A' ' 121' ' ' VAL . 37.7 mt -88.08 120.96 29.93 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.824 -0.806 . . . . 10.0 108.824 178.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -107.32 115.42 30.13 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.381 -179.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.409 HG12 HD21 ' A' ' 83' ' ' LEU . 2.2 t -100.64 116.57 44.37 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.954 0 N-CA-C 107.834 -1.173 . . . . 10.0 107.834 177.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -122.47 131.51 24.38 Favored Pre-proline 0 C--N 1.318 -0.792 0 CA-C-N 116.484 -0.325 . . . . 10.0 110.916 -177.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.434 ' HA ' ' O ' ' A' ' 116' ' ' GLY . 73.8 Cg_endo -79.07 131.85 10.13 Favored 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 122.122 1.881 . . . . 10.0 111.496 178.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.445 HG23 ' HA2' ' A' ' 116' ' ' GLY . 8.5 m -106.0 145.14 30.33 Favored Pre-proline 0 C--N 1.317 -0.847 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.424 -179.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -78.83 106.57 2.12 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.664 2.243 . . . . 10.0 111.807 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.451 ' HB ' ' H ' ' A' ' 134' ' ' SER . 1.8 m -135.27 -162.09 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.742 -0.663 . . . . 10.0 110.539 -179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.451 ' H ' ' HB ' ' A' ' 133' ' ' VAL . 3.7 m -125.82 30.89 5.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.817 0.341 . . . . 10.0 110.574 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 18.5 m 61.45 34.49 18.1 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.917 -0.583 . . . . 10.0 111.809 179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 88.32 48.89 3.88 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.613 -0.803 . . . . 10.0 112.728 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -140.26 122.67 16.04 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.681 0.277 . . . . 10.0 110.478 179.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -116.1 103.12 10.24 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.151 -0.477 . . . . 10.0 110.356 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 77.4 mt . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.613 -0.708 . . . . 10.0 110.118 179.638 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.788 0 N-CA-C 111.608 -0.597 . . . . 10.0 111.608 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 17.9 m -79.27 74.34 5.86 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.316 0.579 . . . . 10.0 110.921 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -115.74 141.44 48.08 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.623 -0.717 . . . . 10.0 109.517 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.3 ttt -66.21 -50.73 62.83 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.782 0.325 . . . . 10.0 110.359 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -75.79 89.49 2.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.267 178.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.482 ' HD2' ' O ' ' A' ' 84' ' ' PRO . 28.3 ttpp -97.31 107.79 40.69 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.163 -0.471 . . . . 10.0 110.848 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.13 140.92 46.33 Favored 'Trans proline' 0 C--O 1.236 0.397 0 C-N-CA 122.455 2.103 . . . . 10.0 111.993 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.455 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . . . -104.61 127.87 28.07 Favored Pre-proline 0 C--N 1.319 -0.72 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.845 -179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 5.5 Cg_exo -74.98 61.32 5.63 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 122.852 2.368 . . . . 10.0 111.874 179.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -83.48 170.53 14.34 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.008 -0.542 . . . . 10.0 110.658 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -128.48 100.7 5.88 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.912 -0.585 . . . . 10.0 109.543 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -70.5 -49.77 29.46 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.054 -0.593 . . . . 10.0 112.513 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -88.33 70.35 2.65 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.649 -0.786 . . . . 10.0 112.095 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 56.3 mtm180 -78.92 -167.88 1.27 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.365 0.126 . . . . 10.0 110.689 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 64.0 m95 63.54 31.1 14.99 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.192 0.52 . . . . 10.0 110.786 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -102.01 9.82 40.12 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.963 -0.562 . . . . 10.0 110.811 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -86.64 94.94 9.61 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.106 -0.497 . . . . 10.0 109.883 179.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 11.1 m -127.56 -26.36 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 116.201 -0.454 . . . . 10.0 111.122 -179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.8 t30 53.01 45.7 28.28 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.56 0.695 . . . . 10.0 110.586 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 5.9 t-160 -87.27 80.42 8.23 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.188 -0.914 . . . . 10.0 109.966 -179.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -146.06 113.75 6.4 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.875 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.04 -42.65 9.31 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.484 -0.326 . . . . 10.0 111.024 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.3 tt0 -166.5 170.3 12.96 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.489 -0.323 . . . . 10.0 110.152 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.61 149.71 83.56 Favored Pre-proline 0 C--N 1.327 -0.394 0 CA-C-N 116.259 -0.428 . . . . 10.0 110.765 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -58.47 -36.2 97.74 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.934 2.422 . . . . 10.0 112.137 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 m -137.11 127.17 26.01 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.944 -0.571 . . . . 10.0 109.951 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.42 ' H ' ' CD ' ' A' ' 46' ' ' GLU . 1.8 pm0 -79.71 72.48 6.41 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.738 0.78 . . . . 10.0 110.983 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 17.6 pt -131.61 153.59 81.58 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.081 -0.963 . . . . 10.0 109.906 179.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -75.72 74.42 4.37 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.472 2.114 . . . . 10.0 111.429 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.08 106.86 11.16 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.737 -0.665 . . . . 10.0 110.385 -179.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -123.14 114.33 20.18 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.674 -0.694 . . . . 10.0 109.791 179.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.48 123.9 21.3 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 120.959 0.409 . . . . 10.0 110.707 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -114.69 82.02 1.66 Allowed 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.272 -0.64 . . . . 10.0 109.272 179.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -82.79 131.76 35.19 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.455 -0.793 . . . . 10.0 111.08 -178.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.0 m -81.0 106.22 12.84 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 116.06 -0.518 . . . . 10.0 109.819 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -77.46 100.11 5.89 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.568 -0.742 . . . . 10.0 109.24 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.448 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 3.0 tt0 -141.86 142.35 33.11 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.98 -1.009 . . . . 10.0 110.223 -178.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.462 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -74.96 122.09 22.94 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.149 -0.685 . . . . 10.0 109.149 178.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 22.1 p -94.33 141.37 23.45 Favored Pre-proline 0 C--N 1.318 -0.802 0 CA-C-N 116.39 -0.368 . . . . 10.0 110.723 -179.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -70.26 0.72 5.61 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 122.63 2.22 . . . . 10.0 112.104 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 60.9 mtt -104.71 -6.3 20.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.005 -0.543 . . . . 10.0 110.737 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.54 ' OD1' ' HB ' ' A' ' 66' ' ' THR . 10.9 t70 -72.47 -69.57 0.4 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.831 0.348 . . . . 10.0 110.827 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.446 ' O ' HG22 ' A' ' 88' ' ' THR . . . 113.09 -42.35 1.98 Allowed Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.485 -0.865 . . . . 10.0 114.008 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.442 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 72.0 p -135.99 168.64 18.97 Favored 'General case' 0 C--O 1.225 -0.208 0 CA-C-N 118.454 1.127 . . . . 10.0 113.664 -177.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.461 HD13 ' HE2' ' A' ' 112' ' ' TYR . 60.2 tp -69.67 -48.29 60.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.048 -0.978 . . . . 10.0 111.121 179.278 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.55 ' HD3' ' CD1' ' A' ' 81' ' ' TYR . 25.6 tptp -58.37 -50.16 74.64 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.82 -0.627 . . . . 10.0 111.293 -178.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.54 ' HB ' ' OD1' ' A' ' 61' ' ' ASP . 62.8 m -60.48 -40.77 92.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.705 0.288 . . . . 10.0 110.906 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 47.7 ttp -61.55 -48.04 82.79 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.951 0.405 . . . . 10.0 110.213 178.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 79.6 mt -63.87 -37.53 87.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.84 -0.618 . . . . 10.0 110.496 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -62.04 -44.03 97.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.999 -0.546 . . . . 10.0 109.561 178.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.83 -43.89 97.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.392 179.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.417 ' CZ3' HD11 ' A' ' 108' ' ' LEU . 44.4 m0 -63.76 -50.79 67.68 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.461 -0.79 . . . . 10.0 111.078 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.564 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -63.41 -47.86 80.23 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.248 -0.433 . . . . 10.0 111.561 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.25 -41.38 88.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.693 0.282 . . . . 10.0 111.427 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -64.96 -37.57 88.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.951 0.405 . . . . 10.0 111.366 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 7.4 p -91.04 5.59 48.28 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.407 -0.36 . . . . 10.0 111.642 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 63.1 t30 60.47 32.73 20.59 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.629 0.728 . . . . 10.0 110.219 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.44 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 17.4 mtm -107.08 168.57 9.11 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.643 -0.708 . . . . 10.0 110.42 -179.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 19.8 mm100 -98.46 165.87 11.63 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.488 -0.324 . . . . 10.0 110.206 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 24.4 tp -133.86 131.23 38.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.123 0.487 . . . . 10.0 111.335 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -116.6 97.1 5.82 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.632 -0.713 . . . . 10.0 109.509 179.138 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.599 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 25.2 t80 -92.07 98.05 11.31 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.641 -0.708 . . . . 10.0 110.421 -179.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 96.9 m-20 -101.23 20.95 14.79 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.907 0.384 . . . . 10.0 111.122 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.599 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 31.4 mt -80.94 143.21 53.07 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.387 -0.37 . . . . 10.0 110.036 179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.482 ' O ' ' HD2' ' A' ' 25' ' ' LYS . 14.1 Cg_endo -57.3 -45.4 35.15 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.674 2.249 . . . . 10.0 112.448 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 3.1 m -135.93 168.26 19.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.982 0.42 . . . . 10.0 110.884 -179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.424 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 0.4 OUTLIER -79.57 135.03 36.5 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.011 -0.737 . . . . 10.0 109.011 178.593 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -115.62 162.89 16.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.878 0.37 . . . . 10.0 111.153 -179.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.446 HG22 ' O ' ' A' ' 62' ' ' GLY . 1.2 p -108.37 172.61 6.74 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.658 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.48 114.51 14.11 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.353 -0.61 . . . . 10.0 109.353 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.4 pt -62.41 -37.37 78.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 116.38 -0.373 . . . . 10.0 111.685 -179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 155.24 -71.73 0.26 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.551 -0.833 . . . . 10.0 112.805 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.33 -2.13 1.21 Allowed 'Trans proline' 0 N--CA 1.481 0.782 0 C-N-CA 123.649 2.899 . . . . 10.0 113.922 -179.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.412 ' H ' HG23 ' A' ' 93' ' ' VAL . 2.3 t -65.8 -44.12 93.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.892 0.377 . . . . 10.0 110.451 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.462 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.7 OUTLIER -65.17 -8.96 19.45 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 116.028 -0.533 . . . . 10.0 112.053 179.421 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.67 -10.95 54.95 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.063 0.459 . . . . 10.0 110.496 179.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.448 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 23.8 mt -90.16 107.56 18.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -136.21 91.96 2.73 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.029 0.443 . . . . 10.0 111.088 -179.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.0 t -132.33 155.76 47.81 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.58 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -90.75 -5.63 55.45 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.285 0.564 . . . . 10.0 110.567 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.6 t -95.67 115.58 27.63 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.436 -0.579 . . . . 10.0 109.436 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.508 HG13 HG11 ' A' ' 121' ' ' VAL . 13.9 p -64.1 -30.07 49.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 120.896 0.379 . . . . 10.0 110.405 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -68.71 -43.17 76.57 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.992 -0.549 . . . . 10.0 109.678 178.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -65.3 -42.62 92.88 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.055 -0.521 . . . . 10.0 109.989 178.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.66 -50.48 73.02 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.01 -0.541 . . . . 10.0 110.846 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.61 -35.2 77.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.235 0.54 . . . . 10.0 110.357 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 99.4 m -66.01 -49.72 66.77 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.619 -0.719 . . . . 10.0 110.74 179.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -63.32 -40.57 97.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.487 -179.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.417 HD11 ' CZ3' ' A' ' 71' ' ' TRP . 83.5 mt -61.33 -49.86 75.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.439 -0.346 . . . . 10.0 110.568 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.2 m -59.29 -27.7 66.09 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 112.081 0.4 . . . . 10.0 112.081 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.48 -42.57 78.5 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.972 0.415 . . . . 10.0 111.232 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -87.98 -29.6 5.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.971 0.415 . . . . 10.0 111.874 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.541 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.6 m-30 -81.07 -22.69 39.04 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 114.0 1.111 . . . . 10.0 114.0 -177.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.27 -30.23 11.37 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 111.74 0.274 . . . . 10.0 111.74 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.76 -39.6 73.15 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.056 0.455 . . . . 10.0 110.739 179.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 -74.91 -24.09 58.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.112 179.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.433 ' HA2' HG23 ' A' ' 131' ' ' VAL . . . 103.86 35.11 3.57 Favored Glycine 0 N--CA 1.445 -0.739 0 CA-C-N 115.515 -0.766 . . . . 10.0 112.381 179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.541 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 94.8 t -131.35 129.54 62.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.08 0.467 . . . . 10.0 111.116 -179.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 15.1 m -130.0 118.84 22.21 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.172 -0.677 . . . . 10.0 109.172 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.462 ' CG1' HG13 ' A' ' 128' ' ' VAL . 9.2 m -112.44 136.83 47.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.224 0.535 . . . . 10.0 112.04 -177.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 73.1 m -145.0 140.12 27.94 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.798 -0.637 . . . . 10.0 109.723 179.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.508 HG11 HG13 ' A' ' 101' ' ' VAL . 2.5 p -102.05 128.83 54.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 N-CA-C 109.856 -0.424 . . . . 10.0 109.856 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.1 m -151.12 130.88 13.18 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.223 -0.444 . . . . 10.0 111.06 -179.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 59.33 45.63 13.71 Favored 'General case' 0 C--O 1.235 0.298 0 O-C-N 123.684 0.615 . . . . 10.0 111.842 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.44 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 92.4 m-20 59.7 33.85 21.97 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.811 -0.631 . . . . 10.0 110.505 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.94 131.44 27.02 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.26 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.564 HD12 ' HB2' ' A' ' 72' ' ' ALA . 18.6 mt -89.53 120.97 31.3 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 107.587 -1.264 . . . . 10.0 107.587 177.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.86 119.91 40.95 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.306 0.574 . . . . 10.0 111.179 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.462 HG13 ' CG1' ' A' ' 119' ' ' VAL . 3.2 t -106.42 118.57 54.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-N 115.246 -0.888 . . . . 10.0 108.827 179.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -131.17 138.3 32.59 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-O 120.768 0.318 . . . . 10.0 110.782 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.49 138.71 13.95 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.2 1.933 . . . . 10.0 111.68 178.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.433 HG23 ' HA2' ' A' ' 116' ' ' GLY . 0.2 OUTLIER -102.83 152.42 38.47 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 110.041 -0.355 . . . . 10.0 110.041 179.285 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -67.22 106.22 1.15 Allowed 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.037 2.491 . . . . 10.0 112.658 -179.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 2.5 m -145.66 28.11 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.104 -0.498 . . . . 10.0 110.567 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 3.8 m -83.61 -10.24 58.37 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.98 -0.555 . . . . 10.0 111.126 -179.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.8 m -61.17 -43.48 98.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.143 -0.481 . . . . 10.0 110.909 179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -89.23 50.81 3.66 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.928 -0.654 . . . . 10.0 111.665 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -65.68 -26.83 67.96 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 -179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 79.8 mttt -68.6 127.66 33.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.382 -0.372 . . . . 10.0 110.123 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 76.1 mt . . . . . 0 C--O 1.248 0.986 0 CA-C-O 118.444 -0.789 . . . . 10.0 110.278 -179.565 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.75 0 N-CA-C 112.197 -0.361 . . . . 10.0 112.197 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.2 t -85.55 127.55 34.48 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.868 -0.419 . . . . 10.0 109.868 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -158.89 135.48 9.39 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.348 -0.387 . . . . 10.0 110.492 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.1 mtt -115.38 150.66 36.0 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.205 -0.452 . . . . 10.0 109.888 179.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.0 t -84.25 132.76 34.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.131 0.491 . . . . 10.0 110.012 179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 60.7 mttm -119.25 97.18 50.38 Favored Pre-proline 0 C--N 1.323 -0.563 0 CA-C-N 116.082 -0.508 . . . . 10.0 110.361 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_exo -71.87 93.54 0.71 Allowed 'Trans proline' 0 N--CA 1.463 -0.31 0 C-N-CA 122.84 2.36 . . . . 10.0 111.311 179.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -67.7 147.34 98.64 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.038 -0.528 . . . . 10.0 110.434 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -64.48 103.45 0.46 Allowed 'Trans proline' 0 C--O 1.236 0.415 0 C-N-CA 122.599 2.2 . . . . 10.0 112.02 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -112.15 -164.58 0.93 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.967 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -97.88 34.45 1.9 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.099 0.476 . . . . 10.0 110.687 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -88.86 90.34 1.65 Allowed Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.822 -0.626 . . . . 10.0 111.681 179.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 97.69 51.49 1.53 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.944 -0.646 . . . . 10.0 111.949 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 42.0 ttt180 -102.49 -25.32 13.65 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.776 0.322 . . . . 10.0 111.057 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 41.6 m95 -84.77 70.84 10.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.111 0.481 . . . . 10.0 110.635 -179.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -116.33 18.76 15.12 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.802 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -85.99 83.15 7.86 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.92 -0.4 . . . . 10.0 109.92 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -134.67 106.96 8.06 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 116.096 -0.502 . . . . 10.0 111.17 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -163.44 152.09 14.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.661 -0.699 . . . . 10.0 109.891 -179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -134.78 83.61 2.04 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.98 0.419 . . . . 10.0 110.829 -179.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -90.78 83.19 5.7 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.454 0.645 . . . . 10.0 110.024 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -131.17 109.61 10.56 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.483 -0.781 . . . . 10.0 110.143 -179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -141.94 156.53 45.48 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.718 0.294 . . . . 10.0 110.378 179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -162.44 144.81 8.44 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.559 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -67.69 94.99 0.39 Allowed 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 122.364 2.042 . . . . 10.0 111.204 179.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.1 m -113.41 100.23 8.38 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.845 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.7 150.78 39.19 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.192 -0.458 . . . . 10.0 109.906 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 1.7 pt -144.92 150.52 46.35 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.045 -0.525 . . . . 10.0 110.668 -179.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.75 146.35 95.78 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.902 2.401 . . . . 10.0 112.27 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.8 tt -131.62 85.4 2.25 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.976 -0.556 . . . . 10.0 110.437 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -113.47 93.9 4.61 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.747 -0.834 . . . . 10.0 108.747 178.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -55.42 107.57 0.34 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.856 -0.611 . . . . 10.0 111.983 -178.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.4 m -125.78 96.74 4.87 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-N 115.57 -0.741 . . . . 10.0 109.415 179.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 29.1 t80 -94.94 132.67 39.52 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.682 -0.69 . . . . 10.0 110.762 -179.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 11.9 m -75.1 110.93 9.83 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 121.194 0.521 . . . . 10.0 110.233 179.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -89.31 98.87 12.01 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.425 -0.807 . . . . 10.0 109.188 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -134.56 147.14 50.2 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.821 -0.627 . . . . 10.0 110.006 -179.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.41 ' HB2' ' SD ' ' A' ' 67' ' ' MET . . . -74.77 121.0 21.08 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.74 0.305 . . . . 10.0 110.418 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.425 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 81.3 p -107.1 158.47 32.89 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.354 -179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.425 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 50.6 Cg_endo -68.54 -4.14 12.46 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.286 1.991 . . . . 10.0 112.036 179.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 61.6 mtt -92.28 -18.66 23.08 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.825 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 57.5 m-20 -73.12 -55.64 6.2 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.419 0.628 . . . . 10.0 109.686 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 88.71 -64.21 3.46 Favored Glycine 0 N--CA 1.446 -0.657 0 CA-C-N 115.595 -0.73 . . . . 10.0 113.347 178.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 15.7 p -117.57 165.59 13.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.04 0.447 . . . . 10.0 112.088 -178.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.523 HD13 ' CE2' ' A' ' 112' ' ' TYR . 55.0 tp -57.89 -42.32 84.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.118 -0.946 . . . . 10.0 110.565 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.4 ' O ' ' HG3' ' A' ' 69' ' ' GLU . 58.0 tttt -60.89 -57.84 10.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.847 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.18 -38.38 73.54 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.278 -0.419 . . . . 10.0 111.165 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.41 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 51.7 ttp -63.52 -51.67 64.51 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.879 -0.601 . . . . 10.0 110.628 179.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 98.6 mt -64.2 -36.96 85.77 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.091 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 51.9 mt-10 -63.5 -38.86 92.76 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.206 0.526 . . . . 10.0 110.087 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? -71.65 -32.13 67.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.772 -0.649 . . . . 10.0 110.216 179.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 38.6 m0 -70.98 -55.12 9.01 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.754 179.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.05 -28.5 69.64 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.466 -0.788 . . . . 10.0 111.711 -179.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.13 -35.57 81.2 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.024 0.379 . . . . 10.0 112.024 -179.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -68.79 -37.81 79.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.86 0.362 . . . . 10.0 111.195 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.431 ' HB2' ' HG3' ' A' ' 77' ' ' MET . 0.1 OUTLIER -95.29 6.77 48.13 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.471 -179.284 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 63.9 t30 55.58 46.7 22.36 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.591 0.71 . . . . 10.0 110.577 179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.431 ' HG3' ' HB2' ' A' ' 75' ' ' SER . 22.1 mtm -111.1 165.67 11.7 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.524 -0.762 . . . . 10.0 110.324 -179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 20.6 mm-40 -98.81 154.47 17.98 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.196 -0.456 . . . . 10.0 110.32 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.9 tp -124.72 131.42 53.46 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.312 0.577 . . . . 10.0 110.5 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 61.8 m -113.03 96.21 5.82 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.321 -0.854 . . . . 10.0 110.104 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.506 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 15.9 t80 -91.31 98.47 11.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.695 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -101.37 30.76 4.04 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.98 0.419 . . . . 10.0 111.175 -179.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.506 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 43.8 mt -97.43 146.96 32.28 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.048 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -56.43 -41.63 74.13 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.943 2.429 . . . . 10.0 112.633 -179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 30.4 m -143.45 167.6 21.8 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.386 -0.37 . . . . 10.0 110.697 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.472 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 12.5 p-10 -83.9 129.04 34.94 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.012 -0.54 . . . . 10.0 109.636 179.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -105.27 136.98 43.79 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.316 -0.402 . . . . 10.0 110.775 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 1.3 p -76.09 155.4 34.77 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.445 -0.343 . . . . 10.0 110.999 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -56.74 116.43 3.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.511 -0.313 . . . . 10.0 110.179 178.865 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.2 pt -63.06 -33.88 63.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.148 -0.478 . . . . 10.0 111.711 -179.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 142.73 -67.48 0.46 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.471 -0.871 . . . . 10.0 113.157 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.71 -2.93 1.22 Allowed 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.838 3.025 . . . . 10.0 114.137 -179.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.436 HG23 ' H ' ' A' ' 93' ' ' VAL . 0.3 OUTLIER -68.7 -36.74 75.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.299 0.571 . . . . 10.0 110.274 179.577 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 22.8 m -72.64 -9.04 58.13 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.825 -0.625 . . . . 10.0 111.559 179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.22 -1.35 56.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.499 0.666 . . . . 10.0 109.917 179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.518 HD13 HD12 ' A' ' 108' ' ' LEU . 19.6 mt -106.07 105.56 18.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.261 -0.881 . . . . 10.0 109.931 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -124.95 89.59 3.09 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.166 -0.47 . . . . 10.0 110.148 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.9 t -121.98 153.78 38.08 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.969 0.414 . . . . 10.0 111.089 -179.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -92.94 -7.22 46.63 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.043 -0.526 . . . . 10.0 110.722 179.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.1 m -103.78 116.66 32.71 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.795 -0.639 . . . . 10.0 110.022 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.1 p -60.59 -32.5 51.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 CA-C-N 116.712 -0.222 . . . . 10.0 111.352 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -67.1 -40.79 86.95 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.857 0.36 . . . . 10.0 110.176 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -65.06 -41.2 95.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.11 -0.495 . . . . 10.0 109.939 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.42 -51.45 66.83 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.654 -0.703 . . . . 10.0 110.581 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.51 -32.47 73.39 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.197 0.522 . . . . 10.0 110.813 179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 88.3 m -66.83 -49.21 66.49 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.575 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -69.73 -37.23 76.42 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.947 -0.57 . . . . 10.0 111.353 -179.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.518 HD12 HD13 ' A' ' 96' ' ' ILE . 3.4 mp -61.47 -49.41 76.92 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.421 -0.354 . . . . 10.0 110.962 179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.0 m -59.22 -30.28 68.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.556 -0.293 . . . . 10.0 111.706 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.73 -47.05 79.68 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.901 0.381 . . . . 10.0 111.178 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.54 HG13 ' HD1' ' A' ' 112' ' ' TYR . 3.9 p -82.26 -35.89 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 121.139 0.495 . . . . 10.0 111.339 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.54 ' HD1' HG13 ' A' ' 111' ' ' VAL . 3.3 m-30 -72.06 -23.9 61.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.934 -0.575 . . . . 10.0 112.469 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -51.27 -31.33 20.77 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 111.892 0.33 . . . . 10.0 111.892 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -75.81 -20.9 57.84 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.144 0.497 . . . . 10.0 111.268 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 6.0 mm100 -94.69 -7.98 39.13 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.023 -0.535 . . . . 10.0 110.416 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 90.57 24.82 27.28 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-N 115.686 -0.688 . . . . 10.0 112.364 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.424 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 56.1 t -126.43 141.89 44.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.751 0.31 . . . . 10.0 111.0 -179.258 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 29.2 m -141.61 138.88 32.89 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 109.599 -0.519 . . . . 10.0 109.599 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 9.0 m -127.92 152.93 36.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.191 0.52 . . . . 10.0 111.872 -178.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.0 m -154.01 158.82 41.15 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.249 -0.432 . . . . 10.0 110.237 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.517 HG22 ' CD2' ' A' ' 126' ' ' LEU . 5.5 t -113.42 114.86 48.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.538 -0.912 . . . . 10.0 108.538 178.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 13.7 m -132.34 116.03 16.35 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.597 -0.274 . . . . 10.0 111.124 -178.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.45 51.68 5.12 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.848 -0.614 . . . . 10.0 111.121 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 26.8 m120 54.95 38.09 29.89 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.655 -0.702 . . . . 10.0 111.05 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 9.3 tttt -141.5 132.14 25.56 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.509 -0.769 . . . . 10.0 109.164 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.517 ' CD2' HG22 ' A' ' 121' ' ' VAL . 89.8 mt -88.96 121.61 31.49 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 109.303 -0.629 . . . . 10.0 109.303 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -108.03 115.76 30.72 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.947 -179.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.8 t -102.98 118.65 50.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 N-CA-C 108.321 -0.992 . . . . 10.0 108.321 178.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -133.78 138.4 30.82 Favored Pre-proline 0 C--N 1.317 -0.809 0 CA-C-O 120.841 0.353 . . . . 10.0 110.539 -178.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -77.06 146.39 25.56 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.212 1.942 . . . . 10.0 111.683 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -105.03 151.62 39.51 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 109.736 -0.468 . . . . 10.0 109.736 179.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -77.86 63.52 8.11 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.759 2.306 . . . . 10.0 113.329 -178.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 27.8 m -127.23 153.8 36.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.486 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 1.5 p -157.57 121.62 4.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.377 -0.374 . . . . 10.0 110.718 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 16.1 m -65.43 115.85 6.11 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.476 179.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 69.82 27.78 72.78 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 121.033 -0.603 . . . . 10.0 112.179 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 56.98 36.11 27.33 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 121.321 0.581 . . . . 10.0 110.924 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -98.45 118.02 34.19 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.804 -0.634 . . . . 10.0 110.612 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 29.8 tp . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.533 -0.746 . . . . 10.0 109.842 179.711 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.868 0 N-CA-C 112.242 -0.343 . . . . 10.0 112.242 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 11.9 m -82.5 148.7 27.97 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.035 -0.357 . . . . 10.0 110.035 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -156.57 167.9 29.03 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.619 -0.264 . . . . 10.0 110.345 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.7 mmt -72.73 99.16 2.54 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.216 -0.447 . . . . 10.0 110.47 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.8 m -95.93 92.67 6.61 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.107 0.479 . . . . 10.0 110.251 179.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 17.3 pttp -127.99 121.41 21.82 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.488 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -72.6 146.37 43.66 Favored 'Trans proline' 0 C--O 1.237 0.471 0 C-N-CA 122.748 2.298 . . . . 10.0 111.832 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 70.86 156.11 0.16 Allowed Pre-proline 0 C--O 1.235 0.306 0 O-C-N 123.724 0.64 . . . . 10.0 111.2 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 19.9 Cg_endo -61.09 170.57 4.77 Favored 'Trans proline' 0 C--O 1.237 0.466 0 C-N-CA 122.675 2.25 . . . . 10.0 113.04 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -73.5 174.2 8.56 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.514 -0.767 . . . . 10.0 111.221 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -111.12 140.53 45.59 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.905 -0.588 . . . . 10.0 110.342 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 154.62 -27.52 0.67 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.844 -0.693 . . . . 10.0 111.907 -179.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -136.02 32.92 2.45 Favored Glycine 0 N--CA 1.445 -0.728 0 N-CA-C 111.393 -0.683 . . . . 10.0 111.393 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 43.3 ttt180 -91.23 -8.18 49.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.113 0.483 . . . . 10.0 110.687 -179.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 74.3 m95 -124.86 41.92 3.4 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.166 0.507 . . . . 10.0 110.894 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -93.96 88.26 5.65 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.157 -0.474 . . . . 10.0 110.963 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -87.34 92.93 9.25 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.811 -0.631 . . . . 10.0 109.378 179.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.3 m -130.61 102.59 6.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.209 0.528 . . . . 10.0 111.321 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 20.2 p-10 -161.59 179.91 7.81 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.567 -0.742 . . . . 10.0 109.678 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -67.37 145.71 54.79 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.345 -0.243 . . . . 10.0 110.345 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -75.72 -76.45 0.15 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.611 -0.268 . . . . 10.0 111.372 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -155.82 133.21 10.9 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.755 0.312 . . . . 10.0 110.97 -179.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -134.84 157.27 47.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.987 0.422 . . . . 10.0 110.63 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -112.2 149.07 40.41 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-N 115.79 -0.641 . . . . 10.0 110.39 179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -65.51 114.56 2.94 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.671 2.247 . . . . 10.0 111.98 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 61.6 m -73.62 103.25 4.15 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.971 -0.559 . . . . 10.0 110.926 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -123.04 80.51 1.77 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.674 179.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 33.8 pt -98.46 149.02 35.32 Favored Pre-proline 0 C--N 1.32 -0.713 0 CA-C-N 116.066 -0.516 . . . . 10.0 110.97 -179.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_endo -64.4 125.09 14.39 Favored 'Trans proline' 0 C--O 1.236 0.382 0 C-N-CA 122.676 2.251 . . . . 10.0 111.998 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 63.5 tp -116.24 105.5 12.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.331 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -78.68 123.59 27.3 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.297 -0.631 . . . . 10.0 109.297 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.22 107.21 0.72 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.025 0.44 . . . . 10.0 110.643 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.2 m -127.73 85.38 2.35 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.931 -0.577 . . . . 10.0 109.945 -179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 23.9 t80 -86.07 118.45 25.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.491 -0.777 . . . . 10.0 110.719 -179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 60.4 m -72.66 113.8 10.1 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.216 0.531 . . . . 10.0 109.959 179.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -81.14 114.0 19.68 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.091 -0.959 . . . . 10.0 109.627 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -148.17 154.68 40.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.185 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -81.55 107.82 14.62 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.702 -0.481 . . . . 10.0 109.702 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.472 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 21.4 p -100.1 158.21 32.44 Favored Pre-proline 0 C--N 1.322 -0.629 0 CA-C-N 116.381 -0.372 . . . . 10.0 110.96 -178.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.472 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 40.5 Cg_endo -66.6 -8.43 21.0 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.904 2.403 . . . . 10.0 112.421 179.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 26.4 mmt -90.97 -7.62 51.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.035 0.445 . . . . 10.0 110.507 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -87.9 -58.78 2.44 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.391 -179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.31 -58.4 4.91 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.418 -0.896 . . . . 10.0 113.275 179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 28.9 p -121.49 168.16 12.02 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.044 0.449 . . . . 10.0 111.801 -179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.444 HD22 ' HE2' ' A' ' 112' ' ' TYR . 59.4 tp -61.81 -37.41 84.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.251 -0.886 . . . . 10.0 110.712 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.8 tmtt? -61.7 -55.12 33.7 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.198 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.26 -41.96 90.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.074 0.464 . . . . 10.0 111.109 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 47.8 ttp -61.0 -53.2 60.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.811 179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 87.6 mt -63.67 -36.23 83.14 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.37 -0.377 . . . . 10.0 111.029 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.438 ' OE2' HD23 ' A' ' 79' ' ' LEU . 44.2 mm-40 -59.29 -44.86 92.46 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.985 -0.376 . . . . 10.0 109.985 178.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -63.81 -45.29 90.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.36 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 42.8 m0 -57.41 -49.08 77.37 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.54 179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.87 -50.01 58.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.446 -0.797 . . . . 10.0 111.761 -179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.29 -45.55 87.73 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.273 0.471 . . . . 10.0 112.273 -178.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -64.17 -35.68 81.57 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.026 0.441 . . . . 10.0 111.237 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.6 m -90.67 5.14 49.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.044 -0.525 . . . . 10.0 111.57 -179.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 48.4 m-20 59.75 41.4 18.37 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.093 0.473 . . . . 10.0 111.218 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.479 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 24.0 mtm -117.94 173.18 6.92 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.655 -0.702 . . . . 10.0 109.913 179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -105.13 161.0 14.62 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.626 -0.261 . . . . 10.0 110.795 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.438 HD23 ' OE2' ' A' ' 69' ' ' GLU . 20.1 tp -132.15 134.61 45.61 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.375 0.607 . . . . 10.0 111.22 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 19.7 m -118.57 96.14 5.15 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.054 -0.975 . . . . 10.0 110.07 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.455 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 17.8 t80 -89.96 97.78 11.39 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.128 -0.693 . . . . 10.0 109.128 179.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -107.19 48.44 0.84 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.556 0.693 . . . . 10.0 110.53 -179.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.455 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 38.5 mt -108.31 153.96 41.66 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.206 -0.906 . . . . 10.0 109.329 179.258 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_endo -59.33 -38.19 86.21 Favored 'Trans proline' 0 CA--C 1.529 0.239 0 C-N-CA 122.568 2.179 . . . . 10.0 112.465 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 8.8 m -152.15 169.67 21.86 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.08 -0.341 . . . . 10.0 110.08 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.422 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 7.7 p-10 -78.4 143.51 36.74 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.816 -0.439 . . . . 10.0 109.816 178.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -121.15 138.72 54.07 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.466 -0.334 . . . . 10.0 111.017 -179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.484 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.7 OUTLIER -81.61 158.93 24.18 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 116.095 -0.502 . . . . 10.0 110.394 179.301 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.62 133.77 55.37 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.047 -0.353 . . . . 10.0 110.047 179.153 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.0 pt -78.35 -29.82 15.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 112.437 0.532 . . . . 10.0 112.437 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 144.34 -64.92 0.46 Allowed Glycine 0 CA--C 1.521 0.444 0 C-N-CA 120.043 -1.075 . . . . 10.0 113.74 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -68.16 6.78 0.76 Allowed 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 123.227 2.618 . . . . 10.0 113.762 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.429 ' HA ' HD12 ' A' ' 96' ' ' ILE . 2.9 t -76.88 -38.23 28.61 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-O 121.105 0.479 . . . . 10.0 110.115 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 41.8 m -67.69 -15.72 63.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.012 -0.54 . . . . 10.0 111.141 179.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -79.71 -9.83 59.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.149 0.499 . . . . 10.0 110.329 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.429 HD12 ' HA ' ' A' ' 93' ' ' VAL . 28.8 mt -94.78 113.51 29.39 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 109.454 -0.573 . . . . 10.0 109.454 179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.8 m -139.13 93.89 2.74 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.925 -0.58 . . . . 10.0 110.93 -179.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 15.3 t -131.21 155.67 46.66 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.481 179.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -90.88 -6.34 54.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.169 0.509 . . . . 10.0 111.101 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 14.4 m -100.68 114.95 29.12 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.559 179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.1 p -62.37 -30.92 50.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.47 -0.332 . . . . 10.0 111.183 -178.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -68.17 -40.85 82.17 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.758 -0.46 . . . . 10.0 109.758 178.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -67.03 -39.38 86.98 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.359 -0.608 . . . . 10.0 109.359 178.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.18 -50.33 74.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.536 -0.756 . . . . 10.0 110.266 178.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.63 -33.54 74.11 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.15 0.5 . . . . 10.0 110.396 179.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 97.8 m -64.5 -50.61 66.72 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.603 -0.726 . . . . 10.0 110.404 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -66.03 -44.15 85.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.85 -0.613 . . . . 10.0 110.173 179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -54.2 -54.24 42.55 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.633 -0.712 . . . . 10.0 110.953 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 24.7 m -62.06 -34.71 76.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.415 -0.357 . . . . 10.0 111.74 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -60.73 -37.1 80.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.151 0.501 . . . . 10.0 111.133 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 16.0 t -87.87 -49.29 14.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.2 0.524 . . . . 10.0 111.023 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.445 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.4 m-30 -62.25 -23.89 66.94 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.598 0.962 . . . . 10.0 113.598 -178.09 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.535 ' O ' HG21 ' A' ' 133' ' ' VAL . . . -54.96 -22.99 16.97 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.743 0.306 . . . . 10.0 111.14 179.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.06 -37.36 75.49 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.133 0.492 . . . . 10.0 110.474 179.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 -85.62 -23.1 27.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.733 -0.667 . . . . 10.0 110.46 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 107.54 30.73 3.96 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.63 -0.795 . . . . 10.0 113.034 179.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.445 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 86.9 t -125.09 135.5 63.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 120.776 0.322 . . . . 10.0 110.5 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 5.2 m -131.38 132.18 44.22 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.222 -0.444 . . . . 10.0 109.891 178.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 11.7 m -122.77 140.97 44.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.051 -0.522 . . . . 10.0 111.052 -178.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 6.0 m -145.41 163.47 34.52 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.403 -0.362 . . . . 10.0 110.408 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.473 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.3 t -118.59 127.75 75.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.551 -0.536 . . . . 10.0 109.551 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 20.3 m -145.58 119.33 9.23 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.7 -0.227 . . . . 10.0 111.061 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 58.39 48.6 12.07 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 123.206 0.602 . . . . 10.0 112.146 179.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.479 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 89.3 m-20 60.1 38.33 20.51 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.804 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 37.9 tttt -145.85 135.35 23.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.718 -0.674 . . . . 10.0 109.58 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.473 ' CD2' HG22 ' A' ' 121' ' ' VAL . 75.2 mt -92.27 123.34 35.53 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 116.376 -0.375 . . . . 10.0 110.189 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -106.38 116.9 32.73 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.23 -0.441 . . . . 10.0 110.297 -179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.9 t -105.73 119.67 55.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 N-CA-C 109.507 -0.553 . . . . 10.0 109.507 179.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -134.78 140.14 34.39 Favored Pre-proline 0 C--N 1.324 -0.516 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.824 -178.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -80.44 140.41 13.49 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 122.235 1.956 . . . . 10.0 111.275 178.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 3.9 m -108.64 145.55 31.85 Favored Pre-proline 0 C--N 1.323 -0.574 0 C-N-CA 120.96 -0.296 . . . . 10.0 110.935 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -78.71 89.07 1.39 Allowed 'Trans proline' 0 C--O 1.236 0.405 0 C-N-CA 122.906 2.404 . . . . 10.0 112.082 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.535 HG21 ' O ' ' A' ' 113' ' ' ALA . 19.7 m -134.56 176.9 7.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.61 -0.723 . . . . 10.0 110.294 -179.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 34.2 m -154.39 138.77 16.72 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.764 0.316 . . . . 10.0 110.845 179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 47.1 m -89.48 -16.07 31.62 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.004 0.431 . . . . 10.0 110.475 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 155.46 -67.38 0.3 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.816 -0.707 . . . . 10.0 112.08 179.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -148.52 -51.44 0.17 Allowed 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.892 0.377 . . . . 10.0 110.763 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 21.7 ttmm -95.74 159.01 15.19 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.048 -0.523 . . . . 10.0 110.397 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.187 0 CA-C-O 117.959 -1.02 . . . . 10.0 109.682 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.795 0 N-CA-C 111.98 -0.448 . . . . 10.0 111.98 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.5 m -84.55 94.3 8.55 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.983 0.421 . . . . 10.0 110.337 179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 9.2 p80 -100.62 70.12 1.43 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.406 0.622 . . . . 10.0 110.475 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 64.8 mtt -96.23 85.26 3.93 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.703 -0.681 . . . . 10.0 110.366 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.45 130.44 41.92 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.686 -0.688 . . . . 10.0 111.24 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 47.4 mttm -126.56 90.78 49.01 Favored Pre-proline 0 C--N 1.323 -0.586 0 CA-C-N 115.867 -0.606 . . . . 10.0 109.99 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -68.67 111.06 2.47 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.233 1.955 . . . . 10.0 111.914 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -69.15 148.22 97.6 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.204 179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -62.54 111.1 1.23 Allowed 'Trans proline' 0 N--CA 1.462 -0.352 0 C-N-CA 122.412 2.075 . . . . 10.0 112.026 -179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -76.86 -24.65 52.63 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.086 -0.506 . . . . 10.0 110.431 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -78.16 75.34 4.69 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.986 -0.552 . . . . 10.0 110.043 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -169.72 110.3 0.37 Allowed Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 121.005 -0.617 . . . . 10.0 111.704 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.9 30.31 76.84 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 121.248 -0.501 . . . . 10.0 112.335 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.1 mpt_? -103.22 -39.25 6.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.228 0.537 . . . . 10.0 111.033 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 70.6 m95 -78.83 2.42 20.02 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.729 -0.669 . . . . 10.0 111.25 -178.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.6 ptpt -92.62 -1.59 56.77 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.966 -0.561 . . . . 10.0 110.502 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -67.28 142.44 56.87 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.472 -0.331 . . . . 10.0 110.172 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -146.43 158.41 11.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.944 -179.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -108.12 -18.7 13.71 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.166 179.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 21.5 m-70 -150.24 135.32 17.82 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.621 179.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 16.9 p90 -85.76 -32.71 21.7 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.998 0.427 . . . . 10.0 110.971 -179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -121.95 116.01 23.57 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.079 -0.509 . . . . 10.0 110.287 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -118.07 154.29 32.31 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.698 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -165.5 147.51 6.39 Favored Pre-proline 0 N--CA 1.44 -0.953 0 CA-C-N 115.576 -0.738 . . . . 10.0 109.881 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -61.76 93.3 0.12 Allowed 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.883 2.388 . . . . 10.0 112.144 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.6 m -83.75 94.04 8.07 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.13 0.491 . . . . 10.0 110.836 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -107.75 94.76 5.25 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.893 -0.594 . . . . 10.0 110.303 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 pt -121.4 111.72 33.24 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-N 115.97 -0.559 . . . . 10.0 110.618 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -69.8 101.3 0.9 Allowed 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 122.485 2.123 . . . . 10.0 111.74 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.432 HD22 ' HA ' ' A' ' 49' ' ' LEU . 0.5 OUTLIER -141.05 111.01 6.56 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.076 -0.511 . . . . 10.0 109.835 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -98.79 140.25 33.26 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.247 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.05 121.74 16.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.969 0.414 . . . . 10.0 110.876 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 49.5 m -154.91 104.11 2.46 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.085 -0.507 . . . . 10.0 110.277 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -72.93 124.63 25.82 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.174 -0.467 . . . . 10.0 110.199 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 13.2 m -77.24 123.11 26.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.495 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -92.15 117.4 29.82 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.712 -0.477 . . . . 10.0 109.712 179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -158.61 165.61 34.05 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.959 -0.564 . . . . 10.0 110.595 -179.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.817 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -78.56 124.48 28.2 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.717 -0.846 . . . . 10.0 108.717 177.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.431 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 44.8 p -104.86 163.48 17.1 Favored Pre-proline 0 C--N 1.313 -0.982 0 CA-C-N 116.294 -0.412 . . . . 10.0 110.748 -178.097 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.431 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 95.6 Cg_endo -80.53 12.26 2.63 Favored 'Trans proline' 0 CA--C 1.53 0.291 0 C-N-CA 121.787 1.658 . . . . 10.0 112.074 178.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 21.4 ptm -112.32 -18.35 12.52 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 -178.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.76 -62.89 1.19 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.835 0.35 . . . . 10.0 111.517 -179.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 98.0 -49.37 1.4 Allowed Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.511 -0.852 . . . . 10.0 112.129 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 32.5 p -130.74 168.92 16.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 117.028 0.414 . . . . 10.0 110.511 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.55 HD13 ' HE2' ' A' ' 112' ' ' TYR . 59.8 tp -57.49 -44.77 85.23 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.983 -0.553 . . . . 10.0 111.271 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -59.23 -53.49 57.63 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.162 -0.472 . . . . 10.0 110.835 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -33.32 71.18 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.482 -0.326 . . . . 10.0 111.677 -179.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 51.3 ttp -69.23 -49.96 51.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.101 0.477 . . . . 10.0 110.042 179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 91.4 mt -65.11 -33.9 77.12 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.704 -0.68 . . . . 10.0 110.655 179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -61.34 -39.77 91.79 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 109.766 -0.457 . . . . 10.0 109.766 178.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.2 ttm-85 -65.89 -42.14 90.63 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 10.0 110.005 178.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 43.0 m0 -62.46 -51.85 65.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.174 179.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.441 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -63.0 -44.99 94.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.57 -0.741 . . . . 10.0 111.838 -179.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.02 -47.83 84.6 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 111.796 0.295 . . . . 10.0 111.796 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.04 -20.23 62.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.912 0.387 . . . . 10.0 111.36 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.5 t -96.93 -1.81 45.0 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.317 -0.402 . . . . 10.0 110.738 179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 9.8 m120 60.44 41.39 16.03 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.525 0.679 . . . . 10.0 110.172 -179.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 26.8 mtm -121.17 168.82 11.16 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.303 -0.862 . . . . 10.0 110.453 -179.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -98.42 160.52 14.23 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.269 -0.423 . . . . 10.0 110.084 179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 34.5 tp -129.44 134.15 47.68 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.78 0.324 . . . . 10.0 110.577 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.475 ' HB2' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -121.14 97.37 5.49 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.027 179.157 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.574 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 20.6 t80 -84.12 98.22 9.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.556 -0.747 . . . . 10.0 109.587 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.51 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 84.8 m-20 -100.38 37.54 1.66 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.073 0.463 . . . . 10.0 110.462 -179.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.574 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 26.6 mt -103.42 150.83 38.4 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-N 116.062 -0.517 . . . . 10.0 109.868 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -64.65 -34.48 51.25 Favored 'Trans proline' 0 CA--C 1.531 0.326 0 C-N-CA 122.579 2.186 . . . . 10.0 112.939 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.9 m -148.05 172.68 13.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.666 0.27 . . . . 10.0 110.752 -179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -83.88 130.99 34.9 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.273 -0.64 . . . . 10.0 109.273 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -114.78 149.84 36.33 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.964 0.411 . . . . 10.0 111.309 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -89.96 169.46 11.2 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.708 -0.678 . . . . 10.0 110.219 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.62 129.7 38.21 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.807 -0.812 . . . . 10.0 108.807 178.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 3.2 pt -67.1 -28.55 43.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 112.084 0.401 . . . . 10.0 112.084 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 145.8 -70.75 0.36 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.525 -0.845 . . . . 10.0 112.905 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.92 5.14 0.68 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 123.237 2.625 . . . . 10.0 113.435 -179.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 3.8 t -67.68 -39.23 81.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.034 0.445 . . . . 10.0 110.185 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.817 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 9.1 m -68.19 -11.06 58.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.056 -0.52 . . . . 10.0 111.375 179.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -88.77 -6.68 57.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.889 0.376 . . . . 10.0 110.628 179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 42.1 mt -93.93 107.52 19.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 N-CA-C 109.156 -0.683 . . . . 10.0 109.156 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.0 m -141.17 104.74 4.69 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 111.955 0.354 . . . . 10.0 111.955 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.4 t -132.42 157.2 45.16 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.107 -0.497 . . . . 10.0 109.785 178.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.78 -11.71 47.26 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.848 0.356 . . . . 10.0 111.613 179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.6 m -98.38 118.57 35.34 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.456 -0.338 . . . . 10.0 110.212 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.8 p -61.46 -32.69 54.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 120.748 0.309 . . . . 10.0 111.342 -179.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -66.93 -43.2 83.88 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 179.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -66.91 -40.31 87.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.769 179.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.08 -46.72 75.48 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.852 -0.613 . . . . 10.0 110.364 178.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.01 -36.36 84.16 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.788 -0.642 . . . . 10.0 110.166 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 39.0 m -64.85 -50.64 65.84 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.801 -0.636 . . . . 10.0 110.886 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -66.12 -44.43 84.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.945 -0.57 . . . . 10.0 111.398 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.439 ' HB3' ' CG2' ' A' ' 119' ' ' VAL . 3.2 tp -58.07 -48.1 81.17 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 120.945 0.402 . . . . 10.0 110.165 179.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 70.4 m -61.46 -31.2 71.16 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.686 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.4 -39.45 94.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.15 0.5 . . . . 10.0 110.953 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.1 t -86.91 -34.91 7.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 115.759 -0.655 . . . . 10.0 110.926 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.55 ' HE2' HD13 ' A' ' 64' ' ' LEU . 3.6 m-30 -79.75 -23.87 41.95 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 113.576 0.954 . . . . 10.0 113.576 -177.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.484 ' O ' HG21 ' A' ' 133' ' ' VAL . . . -49.46 -42.23 42.56 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.059 0.392 . . . . 10.0 112.059 -179.555 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -70.36 -21.91 62.84 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.032 0.444 . . . . 10.0 111.336 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -87.83 -12.83 43.81 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.591 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 96.46 18.71 29.83 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.954 -0.641 . . . . 10.0 112.392 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.462 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 57.6 t -123.52 137.37 56.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 120.881 0.372 . . . . 10.0 111.005 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.1 m -138.52 122.3 17.61 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.543 -0.539 . . . . 10.0 109.543 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.439 ' CG2' ' HB3' ' A' ' 108' ' ' LEU . 6.0 m -107.16 139.56 28.37 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.941 -179.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 37.2 m -149.58 144.02 25.95 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.434 -0.348 . . . . 10.0 110.409 179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 2.1 p -106.08 122.24 59.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.522 -0.547 . . . . 10.0 109.522 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 44.7 m -140.4 124.34 17.4 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.935 -0.575 . . . . 10.0 110.415 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 62.73 46.58 5.16 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 123.68 0.613 . . . . 10.0 110.839 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 20.3 m-20 54.02 40.78 31.97 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.823 0.821 . . . . 10.0 110.394 -179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.472 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 57.2 tttt -143.08 129.06 19.57 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.809 -1.087 . . . . 10.0 108.929 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.441 HD12 ' HB2' ' A' ' 72' ' ' ALA . 21.7 mt -88.45 122.22 31.69 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 109.036 -0.727 . . . . 10.0 109.036 179.614 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.475 HD22 ' HB2' ' A' ' 80' ' ' SER . 14.8 mt -114.25 134.18 55.11 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-O 120.971 0.415 . . . . 10.0 110.52 -178.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.51 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 2.5 t -111.39 119.03 58.88 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 N-CA-C 108.293 -1.003 . . . . 10.0 108.293 178.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 18.2 mp0 -125.63 135.88 27.57 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-O 120.776 0.322 . . . . 10.0 110.969 -178.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -79.72 134.83 11.12 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.194 1.929 . . . . 10.0 111.682 178.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.8 m -106.1 147.1 34.22 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 116.113 -0.494 . . . . 10.0 110.61 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -77.86 94.15 1.08 Allowed 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 122.693 2.262 . . . . 10.0 112.783 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.484 HG21 ' O ' ' A' ' 113' ' ' ALA . 4.6 m -135.49 31.52 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.107 0.48 . . . . 10.0 110.804 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 70.6 m -116.04 37.41 3.67 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.299 179.507 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 3.4 m -79.4 -29.84 42.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.008 0.432 . . . . 10.0 110.36 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -109.66 -48.18 0.81 Allowed Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.951 -0.642 . . . . 10.0 112.057 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -87.82 171.84 10.08 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.417 0.151 . . . . 10.0 110.604 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -161.68 132.81 5.26 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.767 -0.197 . . . . 10.0 110.555 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 27.7 tp . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.566 -0.73 . . . . 10.0 110.411 179.566 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.713 0 N-CA-C 111.709 -0.556 . . . . 10.0 111.709 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 7.6 m -69.95 147.8 49.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.007 0.432 . . . . 10.0 111.164 -179.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 67.7 m80 -125.63 157.22 37.78 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.187 -0.46 . . . . 10.0 110.607 -179.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 24.3 ttt -86.99 70.37 10.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.074 0.464 . . . . 10.0 110.11 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.5 t -173.57 149.55 1.67 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.748 -0.66 . . . . 10.0 109.957 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 70.7 tttt -138.75 126.13 13.29 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 116.582 -0.281 . . . . 10.0 110.889 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -77.67 167.88 23.37 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.662 2.241 . . . . 10.0 111.949 179.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 68.59 156.82 0.15 Allowed Pre-proline 0 N--CA 1.465 0.318 0 O-C-N 123.794 0.684 . . . . 10.0 111.331 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -78.94 56.45 6.01 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.419 2.079 . . . . 10.0 112.416 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -71.22 -42.3 69.11 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.864 -179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -77.51 -4.58 46.34 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.891 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 107.43 -126.46 8.38 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.997 -0.62 . . . . 10.0 111.816 -179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 91.41 10.18 62.37 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.628 -0.796 . . . . 10.0 112.569 179.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.4 ' HD3' ' O ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -75.94 -30.43 58.7 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.768 -0.456 . . . . 10.0 109.768 -179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 42.6 m95 -71.5 -33.18 69.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.791 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 5.6 ptpt -86.1 -7.43 58.59 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.207 -0.451 . . . . 10.0 111.017 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 4.4 t-160 -83.54 85.79 7.2 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.22 0.533 . . . . 10.0 109.761 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 17.8 m -133.15 161.3 41.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.352 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 24.7 p-10 -97.77 128.01 44.12 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.95 0.405 . . . . 10.0 110.048 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 19.8 t-80 -89.4 59.65 4.9 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.354 0.597 . . . . 10.0 110.143 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 68.9 m-85 -137.05 115.17 11.59 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.647 -0.706 . . . . 10.0 109.993 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -82.94 97.55 8.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.405 -179.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -149.22 163.2 38.33 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.694 -0.685 . . . . 10.0 110.014 -179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -78.16 142.38 63.72 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.46 -0.337 . . . . 10.0 110.387 179.514 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -66.79 -33.86 32.85 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.482 2.121 . . . . 10.0 111.526 179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.7 m -116.89 82.95 1.89 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.006 179.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -68.64 110.24 4.17 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.663 -0.699 . . . . 10.0 111.218 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.416 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 22.8 pt -112.44 137.62 21.66 Favored Pre-proline 0 C--N 1.319 -0.741 0 CA-C-N 115.839 -0.619 . . . . 10.0 109.949 179.045 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 47' ' ' ILE . 23.4 Cg_exo -64.9 150.23 88.41 Favored 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 122.484 2.123 . . . . 10.0 111.824 179.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 18.0 tp -112.75 79.43 1.23 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.328 0.585 . . . . 10.0 110.453 179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -75.45 125.03 28.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.531 -0.759 . . . . 10.0 109.864 179.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.33 118.2 9.67 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.999 0.428 . . . . 10.0 111.738 -179.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 4.7 m -141.89 77.9 1.61 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.459 0.647 . . . . 10.0 109.713 179.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -75.36 135.24 40.84 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.104 -0.953 . . . . 10.0 111.039 -179.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.5 m -87.1 117.73 26.02 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.414 179.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -83.3 123.53 29.71 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.807 -0.633 . . . . 10.0 109.385 179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -155.53 149.76 25.8 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.047 -0.524 . . . . 10.0 109.969 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.476 ' HB2' ' SD ' ' A' ' 67' ' ' MET . . . -84.8 130.22 34.71 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.786 0.327 . . . . 10.0 110.529 179.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 48.0 p -107.74 153.72 41.35 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 116.232 -0.44 . . . . 10.0 110.052 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -71.55 5.92 2.18 Favored 'Trans proline' 0 CA--C 1.53 0.308 0 C-N-CA 122.386 2.058 . . . . 10.0 111.819 179.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 46.3 mtt -105.97 -12.42 15.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.825 -0.625 . . . . 10.0 110.752 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -69.05 -52.04 32.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.019 0.437 . . . . 10.0 110.505 -179.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 97.74 -68.46 0.75 Allowed Glycine 0 N--CA 1.444 -0.806 0 C-N-CA 120.511 -0.852 . . . . 10.0 112.816 179.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.433 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 67.6 p -126.83 170.34 12.3 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.084 0.469 . . . . 10.0 112.199 -178.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 54.1 tp -57.38 -43.06 83.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.898 -1.046 . . . . 10.0 110.764 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -59.94 -52.44 65.4 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.015 -0.538 . . . . 10.0 110.945 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.01 -43.05 91.5 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.132 -0.485 . . . . 10.0 111.256 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.476 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 50.8 ttp -63.36 -52.33 62.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.69 -0.686 . . . . 10.0 111.117 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.426 ' HB3' HD13 ' A' ' 79' ' ' LEU . 74.9 mt -62.51 -36.78 83.65 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.31 -0.404 . . . . 10.0 111.24 -179.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -60.01 -44.01 94.84 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.784 -0.45 . . . . 10.0 109.784 178.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 10.7 ttm180 -65.27 -41.76 93.91 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.789 -0.641 . . . . 10.0 110.467 179.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 42.7 m0 -61.48 -50.2 73.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.567 179.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -68.41 -36.6 79.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.802 -0.635 . . . . 10.0 111.702 -179.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.1 -41.1 87.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.518 -0.31 . . . . 10.0 111.813 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -56.28 -39.56 72.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.355 -0.384 . . . . 10.0 111.572 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.415 ' HB2' ' HG3' ' A' ' 77' ' ' MET . 67.7 m -101.8 14.09 32.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.447 -0.342 . . . . 10.0 111.792 -179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 54.99 38.08 29.94 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.068 0.461 . . . . 10.0 111.252 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.415 ' HG3' ' HB2' ' A' ' 75' ' ' SER . 11.8 mtm -95.88 173.15 7.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.931 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.465 ' HB2' ' HG3' ' A' ' 125' ' ' LYS . 14.0 mt-30 -103.88 156.42 17.85 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.355 -0.384 . . . . 10.0 110.945 -179.416 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.426 HD13 ' HB3' ' A' ' 68' ' ' LEU . 23.8 tp -128.52 132.79 48.31 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.089 0.471 . . . . 10.0 110.186 178.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.44 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 75.6 m -120.16 97.16 5.46 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.398 -0.819 . . . . 10.0 110.852 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.564 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 9.0 t80 -87.03 98.5 11.31 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.848 -0.614 . . . . 10.0 110.283 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.531 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 37.0 m-80 -99.83 21.97 11.77 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.07 0.462 . . . . 10.0 110.701 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.564 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 41.8 mt -90.27 141.5 27.66 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 115.997 -0.547 . . . . 10.0 109.672 179.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -61.88 -34.1 82.7 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.695 2.264 . . . . 10.0 112.82 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -138.95 165.63 26.59 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.872 0.368 . . . . 10.0 110.951 -179.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.433 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 6.5 m-20 -86.44 136.62 33.04 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.023 -0.732 . . . . 10.0 109.023 179.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -119.22 140.03 50.9 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.252 -0.579 . . . . 10.0 111.496 -179.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.433 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.8 OUTLIER -79.92 158.13 26.73 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.761 -0.654 . . . . 10.0 110.06 179.405 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.45 122.63 15.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.988 0.423 . . . . 10.0 110.313 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.553 HD13 ' NE2' ' A' ' 115' ' ' GLN . 4.7 pt -62.5 -30.77 49.91 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.788 -0.642 . . . . 10.0 111.878 -179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 140.64 -65.76 0.51 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.452 -0.88 . . . . 10.0 113.152 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_endo -60.88 -5.55 4.84 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 123.37 2.713 . . . . 10.0 113.604 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.431 ' H ' HG23 ' A' ' 93' ' ' VAL . 1.6 t -64.16 -39.26 84.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.277 0.561 . . . . 10.0 109.91 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 66.0 m -71.72 -6.14 39.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.8 -0.636 . . . . 10.0 111.419 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.2 -8.42 39.36 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.27 0.557 . . . . 10.0 110.156 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.512 HD13 HD12 ' A' ' 108' ' ' LEU . 56.2 mt -92.74 109.49 21.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.16 -0.682 . . . . 10.0 109.16 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -131.72 95.37 3.71 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.133 -0.485 . . . . 10.0 111.016 -178.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.8 t -131.1 156.25 45.56 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.796 -0.638 . . . . 10.0 110.869 179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -90.49 -10.52 43.35 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-O 121.13 0.49 . . . . 10.0 110.311 178.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 29.6 t -96.01 118.54 32.81 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.351 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 11.0 p -64.22 -30.23 49.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 121.088 0.47 . . . . 10.0 110.295 179.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -69.77 -44.62 69.76 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.755 -0.657 . . . . 10.0 109.49 179.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -63.18 -41.62 99.23 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.772 -0.649 . . . . 10.0 109.868 179.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.46 -49.38 76.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.81 -0.632 . . . . 10.0 110.607 179.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.28 -37.26 84.82 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.069 0.461 . . . . 10.0 110.488 179.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 91.1 m -64.94 -48.79 72.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.691 -0.686 . . . . 10.0 110.544 179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -64.63 -40.76 96.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.766 -0.652 . . . . 10.0 110.934 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.512 HD12 HD13 ' A' ' 96' ' ' ILE . 3.0 mp -60.71 -53.97 50.93 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 116.153 -0.476 . . . . 10.0 109.85 179.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 19.8 m -55.85 -30.83 62.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.579 0.228 . . . . 10.0 111.54 -179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.32 -44.12 92.51 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.767 0.318 . . . . 10.0 111.098 179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.475 HG13 ' HD1' ' A' ' 112' ' ' TYR . 8.7 p -90.15 -21.85 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 CA-C-O 121.008 0.432 . . . . 10.0 111.929 -179.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.475 ' HD1' HG13 ' A' ' 111' ' ' VAL . 6.3 m-85 -82.41 -25.04 34.05 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.461 0.541 . . . . 10.0 112.461 -179.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.481 ' O ' HG21 ' A' ' 133' ' ' VAL . . . -52.68 -33.7 48.55 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.119 0.414 . . . . 10.0 112.119 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.48 -25.64 67.58 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.811 0.339 . . . . 10.0 111.383 179.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.553 ' NE2' HD13 ' A' ' 90' ' ' ILE . 1.8 mp0 -92.07 -19.9 21.85 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.191 0.519 . . . . 10.0 109.682 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 100.82 30.27 6.17 Favored Glycine 0 N--CA 1.446 -0.676 0 CA-C-N 115.496 -0.775 . . . . 10.0 112.428 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 94.4 t -125.83 140.05 49.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.899 0.381 . . . . 10.0 110.753 -179.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 9.5 m -137.03 131.8 33.34 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.16 -0.473 . . . . 10.0 109.821 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 127' ' ' LEU . 6.4 m -122.95 140.01 47.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 121.014 0.435 . . . . 10.0 111.165 -178.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 13.6 m -144.69 163.55 33.66 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.504 -0.316 . . . . 10.0 110.517 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.525 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.2 t -116.65 115.19 48.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 N-CA-C 109.414 -0.588 . . . . 10.0 109.414 179.258 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 19.9 m -136.39 116.65 13.55 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.608 -0.269 . . . . 10.0 110.728 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 59.0 54.25 5.12 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.716 -0.675 . . . . 10.0 111.768 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 55.42 33.53 21.11 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.763 -0.653 . . . . 10.0 111.569 179.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.465 ' HG3' ' HB2' ' A' ' 78' ' ' GLN . 19.4 tttt -138.83 130.79 27.96 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.382 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.525 ' CD2' HG22 ' A' ' 121' ' ' VAL . 91.1 mt -89.6 121.82 32.16 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.873 -0.788 . . . . 10.0 108.873 179.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.425 ' O ' ' HA ' ' A' ' 119' ' ' VAL . 4.0 mm? -103.01 115.68 31.07 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.872 -178.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.531 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 3.6 t -105.93 117.82 52.37 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 107.57 -1.27 . . . . 10.0 107.57 177.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -136.42 142.83 40.95 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-O 120.699 0.285 . . . . 10.0 111.186 -178.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -81.54 130.56 7.0 Favored 'Trans proline' 0 N--CA 1.451 -0.981 0 C-N-CA 122.269 1.979 . . . . 10.0 111.028 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.466 ' HA ' ' HD3' ' A' ' 132' ' ' PRO . 1.7 m -97.68 141.5 23.09 Favored Pre-proline 0 C--N 1.316 -0.856 0 CA-C-N 116.182 -0.463 . . . . 10.0 110.547 -179.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 131' ' ' VAL . 3.5 Cg_exo -76.87 74.02 5.11 Favored 'Trans proline' 0 N--CA 1.461 -0.408 0 C-N-CA 122.784 2.323 . . . . 10.0 110.886 179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.481 HG21 ' O ' ' A' ' 113' ' ' ALA . 15.6 m -109.41 166.05 5.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.838 -0.619 . . . . 10.0 111.299 -179.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -152.51 44.4 0.69 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.666 -0.697 . . . . 10.0 109.478 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -74.45 162.5 28.77 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.945 -1.025 . . . . 10.0 110.717 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 76.31 25.24 66.41 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.858 -0.687 . . . . 10.0 112.204 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -112.13 -35.45 5.64 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.034 0.445 . . . . 10.0 110.654 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -103.36 -10.18 18.85 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.448 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.098 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.534 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.696 0 N-CA-C 112.162 -0.375 . . . . 10.0 112.162 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.9 m -88.09 144.94 26.21 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.891 -0.411 . . . . 10.0 109.891 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 -77.04 76.71 3.59 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.874 -0.417 . . . . 10.0 109.874 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 40.1 ttm -101.21 114.29 28.12 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.094 -0.503 . . . . 10.0 110.468 -179.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 13.7 t -99.29 -2.56 36.2 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.14 -0.482 . . . . 10.0 111.086 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? -124.79 106.11 29.44 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.907 -0.588 . . . . 10.0 110.229 -179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -68.11 133.02 27.59 Favored 'Trans proline' 0 C--O 1.236 0.388 0 C-N-CA 122.566 2.177 . . . . 10.0 112.265 -179.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -125.79 142.86 43.36 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 116.123 -0.489 . . . . 10.0 110.578 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -75.49 165.83 29.82 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 122.621 2.214 . . . . 10.0 111.838 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -72.24 148.32 45.62 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.622 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -79.71 -15.34 57.7 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.262 -0.426 . . . . 10.0 111.166 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -178.93 -133.16 1.87 Allowed Glycine 0 N--CA 1.445 -0.723 0 C-N-CA 121.036 -0.602 . . . . 10.0 111.702 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -142.84 54.86 0.59 Allowed Glycine 0 N--CA 1.443 -0.897 0 C-N-CA 120.801 -0.714 . . . . 10.0 111.572 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.0 ptt180 -67.1 -25.28 66.14 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.065 0.459 . . . . 10.0 110.357 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 26.2 m95 -82.35 -5.97 58.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.843 -0.617 . . . . 10.0 110.372 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -120.28 62.14 0.85 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.956 -0.565 . . . . 10.0 109.727 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -84.12 107.93 16.74 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.222 -0.445 . . . . 10.0 111.02 -179.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.2 m -142.92 118.07 4.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.539 -0.755 . . . . 10.0 109.712 179.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -85.77 112.09 20.76 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 116.071 -0.513 . . . . 10.0 112.101 -178.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 18.3 p80 -147.66 -34.8 0.24 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.362 -0.835 . . . . 10.0 109.758 178.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -153.95 55.05 0.72 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.828 -0.805 . . . . 10.0 108.828 179.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.07 -16.22 61.04 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.205 -0.907 . . . . 10.0 111.237 -178.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -98.26 170.47 8.85 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.027 -0.533 . . . . 10.0 111.088 -179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -161.47 147.08 10.71 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.518 -0.765 . . . . 10.0 109.665 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -62.1 -47.57 10.08 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.449 2.099 . . . . 10.0 111.734 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.3 m -136.71 106.09 6.08 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 116.127 -0.488 . . . . 10.0 110.24 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -130.36 116.73 18.71 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.129 0.49 . . . . 10.0 110.038 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 13.3 pt -134.45 139.16 31.88 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.792 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -67.38 102.52 0.7 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.597 2.198 . . . . 10.0 112.04 179.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.492 HD23 ' HA ' ' A' ' 49' ' ' LEU . 5.7 mt -133.68 105.5 6.87 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.191 -0.459 . . . . 10.0 111.079 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -104.44 110.45 22.72 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.573 -0.528 . . . . 10.0 109.573 179.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.65 117.95 9.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.497 -0.774 . . . . 10.0 111.341 -179.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 37.6 m -151.76 107.33 3.34 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.868 -0.605 . . . . 10.0 110.224 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.1 t80 -80.07 126.57 31.23 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.455 -0.793 . . . . 10.0 110.412 -179.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.5 m -77.24 115.56 17.12 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.242 -0.435 . . . . 10.0 110.568 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.51 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 93.0 m-85 -85.87 115.72 23.68 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.824 -0.625 . . . . 10.0 109.915 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.415 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 10.7 pt20 -146.36 160.32 42.2 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.905 -0.589 . . . . 10.0 110.52 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.427 ' HB2' ' SD ' ' A' ' 67' ' ' MET . . . -92.7 114.81 27.47 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.097 -0.501 . . . . 10.0 110.158 179.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 69.9 p -97.09 153.91 38.33 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 116.408 -0.36 . . . . 10.0 110.836 -179.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -65.42 -16.43 54.18 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.399 2.066 . . . . 10.0 111.638 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 19.0 ptt? -86.2 -6.5 58.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.701 -0.681 . . . . 10.0 110.682 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -79.44 -56.99 3.92 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 109.187 -0.671 . . . . 10.0 109.187 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 92.86 -69.07 1.69 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.849 -0.691 . . . . 10.0 113.229 178.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 35.5 p -118.91 166.22 13.1 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.179 0.514 . . . . 10.0 111.993 -178.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.523 HD13 ' CE2' ' A' ' 112' ' ' TYR . 61.4 tp -56.64 -40.69 75.87 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.852 -1.067 . . . . 10.0 111.06 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -61.53 -51.98 66.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.716 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -61.97 -40.29 95.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.004 0.43 . . . . 10.0 111.318 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.427 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 54.4 ttp -62.2 -53.67 51.89 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.831 -0.622 . . . . 10.0 111.131 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.7 mt -63.82 -33.65 76.14 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.244 -0.435 . . . . 10.0 111.024 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -59.11 -43.24 91.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.18 -0.464 . . . . 10.0 110.327 179.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.3 ttm-85 -67.7 -44.31 78.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.947 -0.57 . . . . 10.0 110.481 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 40.2 m0 -56.65 -52.3 65.41 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.946 -0.57 . . . . 10.0 111.037 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.77 -45.42 82.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.687 -0.688 . . . . 10.0 111.555 -179.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.92 -40.54 93.56 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.736 0.303 . . . . 10.0 111.62 -179.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -60.62 -41.85 95.69 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.163 -0.472 . . . . 10.0 111.425 -179.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 20.0 m -98.94 12.32 36.25 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.229 0.455 . . . . 10.0 112.229 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 57.66 41.14 25.88 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.371 0.605 . . . . 10.0 111.389 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 60.3 mtp -104.27 173.48 6.29 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.607 -0.724 . . . . 10.0 110.023 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -104.94 158.06 16.79 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.511 -0.313 . . . . 10.0 110.769 179.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 19.8 tp -129.5 136.24 49.63 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.412 0.625 . . . . 10.0 111.577 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.463 ' HB2' ' HG ' ' A' ' 127' ' ' LEU . 1.8 m -124.22 95.34 4.51 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.036 -0.984 . . . . 10.0 109.525 179.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.524 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 12.6 t80 -91.79 97.88 11.27 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.537 -0.542 . . . . 10.0 109.537 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 38.9 m-80 -101.26 31.33 3.73 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.149 0.499 . . . . 10.0 111.065 -178.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.524 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 64.2 mt -96.03 140.54 22.32 Favored Pre-proline 0 C--N 1.322 -0.628 0 N-CA-C 109.459 -0.571 . . . . 10.0 109.459 179.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.59 -30.83 93.13 Favored 'Trans proline' 0 N--CA 1.466 -0.137 0 C-N-CA 122.778 2.319 . . . . 10.0 112.187 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 17.0 m -149.88 170.5 18.66 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.224 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.463 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 4.9 p-10 -87.06 147.28 25.75 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.953 -0.567 . . . . 10.0 109.699 179.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -124.55 141.22 52.25 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.297 -0.411 . . . . 10.0 110.71 -179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -83.9 151.15 25.25 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.994 -0.548 . . . . 10.0 111.093 -179.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.404 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -56.05 120.77 8.0 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 116.263 -0.426 . . . . 10.0 110.125 178.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.435 HD13 ' NE2' ' A' ' 115' ' ' GLN . 3.2 pt -67.96 -29.62 45.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 112.567 0.58 . . . . 10.0 112.567 -179.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.421 ' H ' HG23 ' A' ' 93' ' ' VAL . . . 140.35 -65.27 0.52 Allowed Glycine 0 CA--C 1.521 0.427 0 C-N-CA 120.577 -0.82 . . . . 10.0 112.789 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -63.59 -0.85 2.72 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.913 2.409 . . . . 10.0 112.89 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.421 HG23 ' H ' ' A' ' 91' ' ' GLY . 2.0 t -67.34 -38.21 80.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.118 0.485 . . . . 10.0 109.907 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 74.3 m -68.83 -11.69 60.74 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.543 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -84.16 -6.75 59.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.164 0.507 . . . . 10.0 110.064 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.415 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 34.8 mt -94.76 105.25 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 CA-C-N 115.782 -0.645 . . . . 10.0 109.6 179.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 5.0 m -139.5 96.02 3.02 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.101 -0.5 . . . . 10.0 110.374 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.0 t -131.32 156.32 45.69 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.998 -0.546 . . . . 10.0 110.59 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -84.54 -13.41 51.89 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.085 0.469 . . . . 10.0 110.753 179.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 12.9 t -94.49 114.69 26.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.96 -0.564 . . . . 10.0 110.105 179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.51 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 9.3 p -65.07 -30.99 52.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.993 0.425 . . . . 10.0 109.943 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -67.78 -43.27 80.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.861 -0.609 . . . . 10.0 109.79 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -66.79 -40.38 88.1 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.958 -0.565 . . . . 10.0 110.272 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.92 -50.81 67.9 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.832 -0.622 . . . . 10.0 110.751 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.93 -31.51 72.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.909 -0.587 . . . . 10.0 110.918 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 54.4 m -66.69 -45.42 78.89 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.156 0.503 . . . . 10.0 110.395 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -71.23 -41.33 70.29 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.942 -0.572 . . . . 10.0 110.714 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 19.2 mt -58.07 -48.66 79.47 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 10.0 111.391 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.434 ' O ' ' HB2' ' A' ' 113' ' ' ALA . 4.9 p -62.83 -22.79 66.9 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.038 0.384 . . . . 10.0 112.038 -179.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.77 -43.71 45.14 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.282 0.563 . . . . 10.0 110.494 179.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 13.6 t -78.96 -32.52 15.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 121.58 0.705 . . . . 10.0 110.707 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.523 ' CE2' HD13 ' A' ' 64' ' ' LEU . 3.1 m-85 -81.16 -21.94 39.33 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.28 -0.873 . . . . 10.0 112.574 -178.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.434 ' HB2' ' O ' ' A' ' 109' ' ' SER . . . -52.84 -27.95 20.63 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.772 0.286 . . . . 10.0 111.772 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -72.4 -21.36 61.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.073 0.463 . . . . 10.0 111.123 179.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.435 ' NE2' HD13 ' A' ' 90' ' ' ILE . 2.4 mp0 -95.44 -25.99 16.03 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.981 -0.554 . . . . 10.0 109.691 179.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 107.41 34.06 2.99 Favored Glycine 0 N--CA 1.448 -0.539 0 CA-C-N 115.62 -0.718 . . . . 10.0 112.291 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.472 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 72.2 t -128.87 128.07 67.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.682 0.277 . . . . 10.0 111.104 -179.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.4 m -123.47 104.29 8.99 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.21 0.529 . . . . 10.0 110.179 178.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.47 HG12 HG13 ' A' ' 128' ' ' VAL . 5.2 m -94.23 139.7 17.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.981 -0.554 . . . . 10.0 110.924 179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -147.11 152.49 38.56 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.391 -0.368 . . . . 10.0 110.045 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.433 HG22 ' CD2' ' A' ' 126' ' ' LEU . 2.9 t -110.12 120.69 61.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 108.622 -0.881 . . . . 10.0 108.622 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 17.5 m -136.91 115.87 12.32 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.544 -0.298 . . . . 10.0 111.103 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 63.21 48.56 3.64 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.669 -0.696 . . . . 10.0 111.523 179.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 16.0 t30 60.73 23.54 13.42 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.889 -0.596 . . . . 10.0 111.082 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 40.9 tttt -126.74 131.0 51.43 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.688 -0.687 . . . . 10.0 109.475 179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.433 ' CD2' HG22 ' A' ' 121' ' ' VAL . 95.2 mt -88.09 121.62 30.71 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 108.822 -0.807 . . . . 10.0 108.822 179.315 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.463 ' HG ' ' HB2' ' A' ' 80' ' ' SER . 0.3 OUTLIER -117.46 119.52 35.31 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.201 0.524 . . . . 10.0 111.035 -179.031 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.515 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 2.8 t -102.89 119.67 51.62 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 CA-C-N 115.644 -0.707 . . . . 10.0 109.104 178.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -127.66 132.99 24.62 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-O 120.909 0.385 . . . . 10.0 110.815 -179.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.53 132.44 12.22 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 122.7 2.266 . . . . 10.0 112.554 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 1.1 m -96.61 148.3 34.23 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.053 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -79.76 72.72 6.37 Favored 'Trans proline' 0 N--CA 1.459 -0.505 0 C-N-CA 122.57 2.18 . . . . 10.0 112.62 -179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 27.5 m -127.34 162.91 31.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.291 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 2.2 m -89.41 107.15 18.9 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.777 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -67.54 -21.96 65.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.309 0.576 . . . . 10.0 110.729 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -152.88 -160.82 9.88 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 111.043 -0.823 . . . . 10.0 111.043 179.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -71.84 84.46 0.93 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.932 0.396 . . . . 10.0 110.456 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 53.4 mttm -137.73 156.53 47.89 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.882 -0.599 . . . . 10.0 110.727 -179.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 28.1 tp . . . . . 0 C--O 1.25 1.116 0 CA-C-O 118.577 -0.725 . . . . 10.0 110.093 179.962 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.534 0 N-CA-C 111.681 -0.568 . . . . 10.0 111.681 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.7 m -61.19 -47.27 86.9 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.688 0.28 . . . . 10.0 111.242 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 -78.54 86.2 4.57 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.356 -0.384 . . . . 10.0 110.673 -179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 65.2 mtt -71.84 147.16 47.44 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.369 -0.378 . . . . 10.0 110.601 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.5 t -164.65 150.58 10.37 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.083 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.1 pttm -142.09 108.67 5.85 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-O 120.969 0.414 . . . . 10.0 110.743 -179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -75.02 128.7 11.68 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 122.555 2.17 . . . . 10.0 112.233 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -136.08 155.68 77.44 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 116.239 -0.437 . . . . 10.0 110.049 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.16 102.7 0.19 Allowed 'Trans proline' 0 C--O 1.235 0.36 0 C-N-CA 122.609 2.206 . . . . 10.0 112.147 179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -99.22 -57.11 2.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.028 -0.533 . . . . 10.0 110.401 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -164.48 127.14 2.36 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.812 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -76.6 -76.06 0.85 Allowed Glycine 0 N--CA 1.443 -0.863 0 C-N-CA 120.724 -0.75 . . . . 10.0 112.735 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 64.97 54.21 29.27 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.807 -0.711 . . . . 10.0 111.578 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -100.48 -176.98 3.36 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 110.25 -0.278 . . . . 10.0 110.25 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 51.8 m95 59.76 42.77 16.26 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.926 -0.579 . . . . 10.0 110.324 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -98.31 -173.12 2.49 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.794 -0.639 . . . . 10.0 110.607 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.3 t-160 57.68 67.93 0.91 Allowed 'General case' 0 C--O 1.233 0.204 0 O-C-N 123.897 0.748 . . . . 10.0 109.81 -179.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -144.76 118.09 2.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.628 -0.714 . . . . 10.0 110.676 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.7 t30 -152.33 125.28 8.52 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.834 -0.621 . . . . 10.0 109.918 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 10.9 t-80 -128.56 16.23 6.48 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.432 0.634 . . . . 10.0 109.598 179.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -89.66 97.28 11.1 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.642 -0.708 . . . . 10.0 110.129 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -131.08 75.55 1.66 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.921 -0.581 . . . . 10.0 110.004 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -157.39 159.85 37.82 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.964 -0.562 . . . . 10.0 110.442 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -110.8 149.9 41.04 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.968 -0.56 . . . . 10.0 110.561 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -62.09 -53.9 1.77 Allowed 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.308 2.005 . . . . 10.0 111.036 178.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.4 m -111.87 94.88 5.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.876 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -79.98 -37.82 33.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.063 -0.517 . . . . 10.0 110.309 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.465 HD13 ' H ' ' A' ' 47' ' ' ILE . 0.2 OUTLIER -65.86 152.02 94.0 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 115.635 -0.711 . . . . 10.0 110.794 -179.847 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -52.28 114.61 1.73 Allowed 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.017 2.478 . . . . 10.0 111.998 179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 31.3 tp -95.34 93.57 7.34 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 115.634 -0.712 . . . . 10.0 109.907 -179.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -84.36 124.83 31.71 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.977 -0.556 . . . . 10.0 109.78 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.75 105.52 0.31 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.06 0.457 . . . . 10.0 111.713 -179.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.4 m -132.49 90.43 2.78 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.636 -0.711 . . . . 10.0 109.436 179.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -71.15 129.61 39.38 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.497 -0.774 . . . . 10.0 111.235 -179.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.8 m -87.72 113.79 23.73 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 115.778 -0.646 . . . . 10.0 110.093 179.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -80.47 108.55 14.19 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.901 -0.59 . . . . 10.0 110.095 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.444 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 16.6 pt20 -141.99 159.56 41.98 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.112 -0.495 . . . . 10.0 110.886 179.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.637 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -92.92 126.97 38.26 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.03 -0.532 . . . . 10.0 109.842 178.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.404 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 16.2 p -118.31 158.86 45.57 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 116.115 -0.493 . . . . 10.0 109.972 -179.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.404 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 56.1 Cg_endo -72.04 -0.96 9.3 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 122.183 1.922 . . . . 10.0 111.495 178.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 68.5 mtm -90.31 -26.83 19.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.444 -0.798 . . . . 10.0 110.259 179.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -65.79 -50.08 66.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.729 -0.669 . . . . 10.0 109.964 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 93.43 -66.11 1.77 Allowed Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.589 -0.815 . . . . 10.0 113.153 178.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 29.9 p -125.35 173.93 8.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.143 0.497 . . . . 10.0 111.86 -178.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 46.1 tp -62.75 -41.22 99.1 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 115.006 -0.997 . . . . 10.0 110.491 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -61.31 -54.74 40.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.965 -0.561 . . . . 10.0 110.841 -179.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -57.92 -42.09 84.04 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.183 -0.462 . . . . 10.0 111.402 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 57.3 ttp -61.2 -51.5 68.73 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.108 -0.496 . . . . 10.0 110.488 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 86.4 mt -64.03 -38.04 89.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.094 -0.503 . . . . 10.0 111.116 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -60.34 -44.8 95.17 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 120.853 0.359 . . . . 10.0 110.311 179.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.0 mtp85 -68.98 -42.16 76.9 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.44 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 31.2 m0 -55.69 -48.54 74.92 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.43 0.633 . . . . 10.0 109.863 178.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.504 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -68.55 -51.84 38.52 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.158 -0.928 . . . . 10.0 111.613 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.27 -46.28 72.63 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.057 0.391 . . . . 10.0 112.057 -179.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -60.75 -40.19 91.52 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.94 0.4 . . . . 10.0 111.571 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.4 m -93.14 9.71 34.8 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.159 -0.473 . . . . 10.0 111.887 -178.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 56.14 48.25 17.86 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.482 0.658 . . . . 10.0 110.45 -179.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 81.1 mtp -116.2 173.54 6.53 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.047 -0.979 . . . . 10.0 109.88 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -108.83 160.74 15.74 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.433 -0.348 . . . . 10.0 110.228 179.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 19.9 tp -133.71 143.0 48.23 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.291 0.567 . . . . 10.0 110.773 -179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.474 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 31.7 m -127.91 96.06 4.38 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.042 -0.981 . . . . 10.0 109.595 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.521 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 13.8 t80 -93.02 98.16 11.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.791 -0.641 . . . . 10.0 109.441 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 52.3 m-80 -98.64 22.07 10.45 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.075 0.464 . . . . 10.0 111.159 -179.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.521 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 48.0 mt -88.01 143.59 33.37 Favored Pre-proline 0 C--N 1.321 -0.636 0 N-CA-C 109.565 -0.532 . . . . 10.0 109.565 179.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_endo -61.71 -30.79 85.66 Favored 'Trans proline' 0 N--CA 1.465 -0.162 0 C-N-CA 122.633 2.222 . . . . 10.0 112.881 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.3 m -148.27 167.73 24.39 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.608 -0.269 . . . . 10.0 110.576 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.451 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 3.8 p-10 -83.47 146.16 28.55 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.227 -0.657 . . . . 10.0 109.227 178.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -129.16 149.56 50.91 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 110.241 -0.281 . . . . 10.0 110.241 -179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.58 169.95 11.28 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.131 -0.486 . . . . 10.0 110.79 -179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -74.19 144.28 44.84 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.813 -0.44 . . . . 10.0 109.813 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.7 pt -83.64 -36.15 12.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.337 -0.392 . . . . 10.0 111.71 -179.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 155.07 -67.92 0.3 Allowed Glycine 0 N--CA 1.453 -0.19 0 C-N-CA 120.297 -0.954 . . . . 10.0 113.13 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.5 -12.13 13.11 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 123.395 2.73 . . . . 10.0 113.468 -179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.402 HG23 ' H ' ' A' ' 93' ' ' VAL . 2.9 t -63.75 -39.49 85.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 121.028 0.442 . . . . 10.0 110.357 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.637 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.3 m -69.08 -7.53 36.7 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 10.0 111.843 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.99 -3.28 48.73 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.035 0.445 . . . . 10.0 110.604 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.444 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 52.2 mt -95.79 113.47 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.74 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 2.0 m -141.98 91.52 2.36 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.065 -0.516 . . . . 10.0 110.34 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 11.9 t -129.97 155.8 45.5 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.397 -0.365 . . . . 10.0 110.299 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.81 -10.77 54.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.037 0.446 . . . . 10.0 111.071 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.5 t -93.54 113.26 25.34 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.873 -0.603 . . . . 10.0 109.776 179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 9.2 p -65.25 -28.94 45.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.054 0.454 . . . . 10.0 110.439 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 61.7 mt-30 -70.51 -39.64 73.98 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.013 -0.539 . . . . 10.0 109.81 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . 0.427 ' O ' ' HB ' ' A' ' 106' ' ' THR . 53.7 tp60 -69.99 -41.0 74.96 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.952 -0.567 . . . . 10.0 110.047 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.99 -50.03 73.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.51 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.47 -30.75 71.82 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.074 -0.512 . . . . 10.0 110.367 179.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.427 ' HB ' ' O ' ' A' ' 103' ' ' GLN . 55.5 m -64.34 -51.07 65.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.824 -0.625 . . . . 10.0 110.811 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -68.09 -39.75 82.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.299 -0.409 . . . . 10.0 111.153 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.449 ' HB3' HG21 ' A' ' 119' ' ' VAL . 1.6 mp -60.95 -50.9 71.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.199 -0.455 . . . . 10.0 111.126 179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 13.0 p -63.54 -31.93 73.24 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 121.102 -0.239 . . . . 10.0 111.247 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.23 -40.79 98.44 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.391 -0.368 . . . . 10.0 111.146 -179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.587 HG13 ' HD1' ' A' ' 112' ' ' TYR . 12.0 p -89.28 -24.31 5.98 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 CA-C-O 120.945 0.403 . . . . 10.0 111.942 -179.233 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.587 ' HD1' HG13 ' A' ' 111' ' ' VAL . 3.4 m-30 -83.35 -24.26 32.15 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.575 0.954 . . . . 10.0 113.575 -179.07 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -50.04 -32.62 15.91 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 112.394 0.516 . . . . 10.0 112.394 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.64 -18.94 62.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.903 0.382 . . . . 10.0 111.386 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -98.03 -0.26 44.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.021 0.439 . . . . 10.0 110.182 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.85 21.25 56.25 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.975 -0.631 . . . . 10.0 112.887 179.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 92.5 t -121.49 128.64 75.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 120.805 0.336 . . . . 10.0 110.554 -179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.9 m -126.96 104.17 7.86 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 120.982 0.42 . . . . 10.0 110.728 179.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.659 HG12 HG13 ' A' ' 128' ' ' VAL . 27.7 m -94.59 148.26 5.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.768 -0.651 . . . . 10.0 111.012 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 18.9 m -154.62 175.89 13.09 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.887 -0.783 . . . . 10.0 108.887 179.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 13.9 p -142.62 125.77 14.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-O 121.526 0.679 . . . . 10.0 110.268 179.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 19.6 m -113.25 108.31 17.09 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.246 -0.888 . . . . 10.0 109.36 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 64.57 -89.61 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 O-C-N 123.755 0.66 . . . . 10.0 111.346 -179.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 27.9 m-20 -132.76 23.96 4.31 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.188 0.518 . . . . 10.0 109.843 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.474 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 38.6 tttt -125.72 127.91 46.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.875 -0.602 . . . . 10.0 111.032 -179.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.504 HD12 ' HB2' ' A' ' 72' ' ' ALA . 36.0 mt -87.31 122.28 30.87 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.463 -0.939 . . . . 10.0 108.463 178.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -107.12 115.58 30.43 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.179 0.514 . . . . 10.0 111.121 -178.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.659 HG13 HG12 ' A' ' 119' ' ' VAL . 5.7 t -112.4 117.91 56.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 108.268 -1.012 . . . . 10.0 108.268 178.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -137.66 143.33 40.13 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-O 120.602 0.239 . . . . 10.0 110.456 -178.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -81.03 142.53 13.76 Favored 'Trans proline' 0 N--CA 1.454 -0.834 0 C-N-CA 122.519 2.146 . . . . 10.0 111.932 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.405 HG23 HG22 ' A' ' 133' ' ' VAL . 3.3 m -108.63 143.27 27.19 Favored Pre-proline 0 C--N 1.32 -0.696 0 CA-C-N 116.353 -0.385 . . . . 10.0 110.14 179.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -76.61 73.21 5.3 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.708 2.272 . . . . 10.0 112.695 -179.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.405 HG22 HG23 ' A' ' 131' ' ' VAL . 25.7 m -126.91 169.77 17.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 115.573 -0.739 . . . . 10.0 110.084 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 12.9 m -81.06 98.1 7.82 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.138 0.495 . . . . 10.0 111.094 -179.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -93.18 -43.91 8.61 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.942 -0.572 . . . . 10.0 109.997 179.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 162.72 179.29 37.2 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.673 -0.694 . . . . 10.0 111.679 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -66.96 120.49 13.7 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.833 0.349 . . . . 10.0 111.412 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -102.26 -29.27 11.78 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.838 -0.619 . . . . 10.0 109.75 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.434 HD13 ' HA ' ' A' ' 139' ' ' LEU . 2.4 mm? . . . . . 0 C--O 1.248 0.977 0 CA-C-O 118.527 -0.749 . . . . 10.0 110.261 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.733 0 N-CA-C 111.859 -0.496 . . . . 10.0 111.859 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -62.25 -29.23 70.26 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.909 0.385 . . . . 10.0 111.209 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 47.7 m80 -125.5 157.2 37.61 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.013 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -74.9 99.13 3.72 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.805 -0.443 . . . . 10.0 109.805 179.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.83 89.72 2.34 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.009 0.433 . . . . 10.0 111.306 -179.534 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 44.9 tttp -91.22 125.18 59.27 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.374 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -70.63 105.83 1.7 Allowed 'Trans proline' 0 N--CA 1.462 -0.376 0 C-N-CA 122.666 2.244 . . . . 10.0 111.561 179.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -74.95 138.8 72.91 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 115.908 -0.587 . . . . 10.0 110.745 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 80.2 Cg_endo -80.81 36.56 0.63 Allowed 'Trans proline' 0 N--CA 1.462 -0.356 0 C-N-CA 122.758 2.305 . . . . 10.0 111.514 179.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -86.1 93.38 8.99 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.429 -0.805 . . . . 10.0 110.309 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -151.99 76.78 1.19 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.22 0.533 . . . . 10.0 111.065 -179.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -113.13 131.11 9.85 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.793 -0.718 . . . . 10.0 111.515 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 97.3 49.66 1.83 Allowed Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.486 -0.864 . . . . 10.0 111.936 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 33' ' ' ARG . 13.4 ttt180 -64.73 -39.59 93.89 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.201 0.524 . . . . 10.0 109.666 179.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 11.3 p-90 -141.58 134.1 28.32 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.382 -0.826 . . . . 10.0 109.834 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 12.1 pttp -153.8 81.67 1.15 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.47 0.652 . . . . 10.0 110.578 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -98.6 96.67 8.11 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.321 -0.854 . . . . 10.0 109.697 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -141.92 122.79 12.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.252 -179.347 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -161.38 128.99 4.15 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.656 178.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -151.93 87.66 1.36 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.897 -0.592 . . . . 10.0 110.358 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -153.94 75.09 1.01 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.289 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -93.39 92.89 7.86 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.039 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -116.52 153.38 32.28 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.915 -0.584 . . . . 10.0 110.601 -179.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -163.84 149.5 9.35 Favored Pre-proline 0 C--N 1.317 -0.827 0 CA-C-N 115.552 -0.749 . . . . 10.0 110.151 179.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 17.6 Cg_endo -57.89 103.43 0.14 Allowed 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.854 2.37 . . . . 10.0 111.931 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 8.1 m -75.77 103.1 5.71 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.958 -179.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -139.17 114.1 9.38 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.286 0.565 . . . . 10.0 110.84 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.0 pt -134.85 68.44 71.17 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.735 -0.666 . . . . 10.0 110.694 179.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -68.77 130.92 21.52 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.657 2.238 . . . . 10.0 112.027 -179.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -109.81 71.58 0.77 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.054 -0.521 . . . . 10.0 109.94 -179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 28.4 t80 -115.43 117.01 29.2 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 179.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.61 125.61 24.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.646 0.26 . . . . 10.0 110.653 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.9 m -144.38 105.67 4.23 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.127 0.489 . . . . 10.0 111.063 -179.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 27.5 t80 -78.38 123.57 27.14 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.287 -0.634 . . . . 10.0 109.287 178.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.6 m -79.83 121.02 24.88 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.86 0.362 . . . . 10.0 111.032 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -90.99 111.64 23.19 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.631 179.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -146.08 147.83 32.0 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.847 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.493 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -81.7 115.25 20.86 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.048 -0.524 . . . . 10.0 110.362 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 73.2 p -96.61 152.23 38.43 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.24 -0.436 . . . . 10.0 109.873 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.93 -18.38 64.66 Favored 'Trans proline' 0 CA--C 1.527 0.159 0 C-N-CA 122.225 1.95 . . . . 10.0 112.041 179.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.0 ptt? -89.6 2.92 54.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 10.0 111.515 -179.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.604 ' HA ' ' NH1' ' A' ' 70' ' ' ARG . 28.9 m-20 -82.09 -52.21 7.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.262 0.553 . . . . 10.0 109.808 178.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.08 -66.98 2.97 Favored Glycine 0 N--CA 1.446 -0.663 0 CA-C-N 115.534 -0.757 . . . . 10.0 113.697 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.5 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 24.4 p -122.34 165.92 15.51 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.663 0.616 . . . . 10.0 112.663 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.518 HD13 ' CE2' ' A' ' 112' ' ' TYR . 33.2 tp -62.42 -42.05 99.16 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.819 -1.082 . . . . 10.0 111.143 179.646 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 51.8 tttt -57.99 -55.37 35.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.739 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 6.6 m -59.63 -41.22 89.96 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.116 -0.493 . . . . 10.0 111.155 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 57.6 ttp -63.54 -52.53 60.74 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 10.0 110.856 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 70.8 mt -62.1 -40.24 95.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.369 -0.378 . . . . 10.0 111.286 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -60.54 -43.39 97.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.501 -0.318 . . . . 10.0 110.312 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.604 ' NH1' ' HA ' ' A' ' 61' ' ' ASP . 97.2 mtt180 -66.85 -42.5 85.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.25 -0.432 . . . . 10.0 110.225 179.287 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 36.1 m0 -58.83 -54.13 50.58 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.081 -0.509 . . . . 10.0 110.605 179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.96 -40.16 96.88 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.627 -0.715 . . . . 10.0 111.687 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.11 -40.74 94.96 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.771 0.32 . . . . 10.0 111.311 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.69 -21.14 64.44 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.119 -0.491 . . . . 10.0 111.408 -179.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.408 ' HB2' ' SD ' ' A' ' 77' ' ' MET . 1.5 m -109.35 7.09 24.94 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.526 -0.306 . . . . 10.0 111.706 -179.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 61.4 t30 56.46 48.22 17.26 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.837 0.827 . . . . 10.0 110.655 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.408 ' SD ' ' HB2' ' A' ' 75' ' ' SER . 72.7 mtp -116.89 173.19 6.78 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.16 -0.927 . . . . 10.0 110.128 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.424 ' HB3' ' HE3' ' A' ' 125' ' ' LYS . 29.3 mm-40 -106.1 159.48 16.04 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.067 -0.515 . . . . 10.0 109.969 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 17.7 tp -134.8 138.77 44.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.319 0.581 . . . . 10.0 111.669 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.426 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 1.4 m -123.74 96.59 5.02 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 115.527 -0.761 . . . . 10.0 110.08 179.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.625 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 8.7 t80 -91.65 102.82 15.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.864 -178.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.482 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 37.1 m-80 -104.85 33.49 3.59 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.009 0.433 . . . . 10.0 110.908 -179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.528 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 55.6 mt -102.94 146.88 33.23 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 116.338 -0.392 . . . . 10.0 110.018 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.97 -34.54 94.98 Favored 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.735 2.29 . . . . 10.0 112.321 179.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.3 m -152.5 166.59 31.51 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.36 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.625 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 9.5 p-10 -84.92 128.75 34.76 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.858 -0.793 . . . . 10.0 108.858 178.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -100.39 136.99 39.42 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.381 -0.372 . . . . 10.0 111.18 -178.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.5 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.9 OUTLIER -72.59 154.99 40.5 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.967 -0.56 . . . . 10.0 110.518 179.181 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.11 114.84 3.34 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 179.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 5.3 pt -59.74 -32.83 50.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 112.501 0.556 . . . . 10.0 112.501 -178.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 149.26 -70.75 0.31 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.578 -0.82 . . . . 10.0 112.66 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -60.14 -4.69 3.21 Favored 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 123.511 2.807 . . . . 10.0 113.48 -179.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.414 HG23 ' H ' ' A' ' 93' ' ' VAL . 2.9 t -64.97 -36.04 76.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 121.308 0.575 . . . . 10.0 110.236 179.349 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.493 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.7 OUTLIER -67.22 -14.14 62.63 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.544 -0.753 . . . . 10.0 111.677 -179.342 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -87.67 1.56 53.39 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.876 0.37 . . . . 10.0 111.1 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 40.3 mt -98.51 110.28 25.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 109.345 -0.613 . . . . 10.0 109.345 179.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.1 t -141.12 93.99 2.65 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.771 -0.65 . . . . 10.0 110.543 -178.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.8 t -132.19 156.78 45.83 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.511 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -89.5 -13.69 36.91 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.052 0.453 . . . . 10.0 110.791 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.5 114.06 26.34 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.831 -0.622 . . . . 10.0 110.336 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.5 p -62.2 -33.83 60.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-O 120.832 0.348 . . . . 10.0 110.854 -179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -64.18 -39.38 93.87 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.948 -0.569 . . . . 10.0 110.122 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -72.53 -42.1 65.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.305 -0.407 . . . . 10.0 109.999 179.176 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.77 -51.09 66.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.052 -0.522 . . . . 10.0 110.91 179.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.74 -33.08 74.85 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.958 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 95.9 m -67.59 -47.12 70.65 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.101 -0.499 . . . . 10.0 110.669 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.406 ' O ' HG23 ' A' ' 111' ' ' VAL . 14.4 mt-10 -66.26 -40.08 89.9 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.31 -0.404 . . . . 10.0 110.262 179.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.402 ' O ' ' HB2' ' A' ' 112' ' ' TYR . 30.7 mt -61.24 -49.6 76.47 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.934 179.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.429 ' O ' ' HB2' ' A' ' 113' ' ' ALA . 4.6 p -64.17 -22.14 66.82 Favored 'General case' 0 C--N 1.332 -0.157 0 N-CA-C 111.765 0.283 . . . . 10.0 111.765 -179.217 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.49 -46.82 52.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.09 0.471 . . . . 10.0 110.311 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 107' ' ' GLU . 4.7 t -75.78 -47.74 32.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 121.678 0.752 . . . . 10.0 110.334 179.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.518 ' CE2' HD13 ' A' ' 64' ' ' LEU . 3.6 m-30 -64.33 -21.11 66.5 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.928 -1.033 . . . . 10.0 113.254 -178.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.447 ' O ' HG21 ' A' ' 133' ' ' VAL . . . -52.18 -28.55 18.64 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 111.806 0.298 . . . . 10.0 111.806 179.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.12 -23.72 54.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.148 0.499 . . . . 10.0 111.101 179.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 17.8 mp0 -89.75 -6.92 55.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.873 -0.603 . . . . 10.0 110.298 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 89.11 27.38 23.53 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.72 -0.752 . . . . 10.0 111.994 -179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.453 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 97.0 t -127.8 134.51 65.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.849 0.357 . . . . 10.0 110.605 -179.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 14.4 m -136.16 105.15 5.91 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.267 0.556 . . . . 10.0 110.614 179.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.518 HG12 HG13 ' A' ' 128' ' ' VAL . 13.2 m -97.45 150.09 4.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.522 -0.763 . . . . 10.0 111.145 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 15.1 m -155.66 170.82 21.13 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.366 -0.605 . . . . 10.0 109.366 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.432 HG22 ' CD2' ' A' ' 126' ' ' LEU . 2.8 t -120.96 129.47 75.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.208 -0.664 . . . . 10.0 109.208 179.158 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 25.3 m -145.25 117.32 8.32 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 120.717 0.294 . . . . 10.0 111.268 -179.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.56 50.68 5.59 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.551 -0.749 . . . . 10.0 111.901 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 30.5 t30 59.48 25.86 14.72 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 115.37 -0.832 . . . . 10.0 111.394 179.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.426 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 56.7 tttt -131.54 137.64 48.57 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.245 -0.65 . . . . 10.0 109.245 179.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.432 ' CD2' HG22 ' A' ' 121' ' ' VAL . 97.3 mt -87.91 122.16 31.2 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.116 -0.698 . . . . 10.0 109.116 179.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -103.91 115.76 31.05 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.899 -0.591 . . . . 10.0 110.317 -178.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.518 HG13 HG12 ' A' ' 119' ' ' VAL . 10.6 t -108.54 118.22 55.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 N-CA-C 108.552 -0.907 . . . . 10.0 108.552 178.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -137.71 139.64 27.41 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.682 -0.236 . . . . 10.0 110.436 -178.65 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -79.13 154.4 25.29 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.736 2.29 . . . . 10.0 112.098 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 2.0 m -121.99 144.61 41.62 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 116.266 -0.425 . . . . 10.0 110.074 179.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -82.72 85.78 1.57 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 122.821 2.347 . . . . 10.0 111.803 -179.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.447 HG21 ' O ' ' A' ' 113' ' ' ALA . 16.0 m -124.89 175.97 6.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.814 -0.63 . . . . 10.0 111.156 -178.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.32 164.19 31.51 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.069 -0.514 . . . . 10.0 110.21 179.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.4 m -76.17 -34.9 59.36 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.71 0.291 . . . . 10.0 111.277 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -75.56 102.53 1.51 Allowed Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.736 -0.745 . . . . 10.0 112.561 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -92.55 -29.5 16.15 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.007 0.432 . . . . 10.0 110.85 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.92 173.8 8.03 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.984 -0.553 . . . . 10.0 110.292 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 93.6 mt . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.479 -0.772 . . . . 10.0 110.127 179.387 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 111.924 -0.47 . . . . 10.0 111.924 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.8 m -82.67 122.63 28.39 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.759 0.314 . . . . 10.0 110.403 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 9.6 m170 -106.51 159.35 16.24 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.378 -0.373 . . . . 10.0 110.706 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 8.4 ptt? -123.98 168.61 12.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.49 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.18 145.87 28.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.907 -0.588 . . . . 10.0 111.081 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.03 142.95 14.7 Favored Pre-proline 0 C--N 1.327 -0.381 0 CA-C-N 116.223 -0.444 . . . . 10.0 110.4 -179.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -77.74 -171.27 1.14 Allowed 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.771 2.314 . . . . 10.0 112.42 -179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -145.89 142.88 18.36 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 116.296 -0.411 . . . . 10.0 110.571 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -59.03 119.95 7.51 Favored 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 122.534 2.156 . . . . 10.0 112.25 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -81.49 169.64 16.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.32 -0.4 . . . . 10.0 110.606 179.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -127.31 158.04 38.28 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.936 -0.574 . . . . 10.0 110.025 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 177.61 133.15 1.8 Allowed Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 120.275 -0.964 . . . . 10.0 112.575 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -76.57 82.22 1.07 Allowed Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 111.704 -0.558 . . . . 10.0 111.704 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -108.51 -2.58 18.81 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.772 0.32 . . . . 10.0 111.148 -179.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -96.04 -1.7 48.3 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.3 -0.409 . . . . 10.0 111.333 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.6 mttp -80.48 89.96 5.65 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.805 -0.443 . . . . 10.0 109.805 179.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.5 t-160 -86.96 98.83 11.47 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.797 -0.638 . . . . 10.0 110.268 -179.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -141.12 135.93 32.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.137 0.494 . . . . 10.0 111.029 179.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -85.13 -49.51 8.19 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.837 -0.62 . . . . 10.0 110.117 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 34.0 m-70 -149.04 163.76 36.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.179 -179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -93.88 70.03 3.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.203 0.525 . . . . 10.0 109.92 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -78.54 104.2 8.98 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.905 -0.589 . . . . 10.0 111.107 -179.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -86.04 -30.73 22.42 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.6 -0.519 . . . . 10.0 109.6 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -159.6 153.79 20.06 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 115.618 -0.719 . . . . 10.0 109.6 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.96 -30.93 92.82 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.377 2.052 . . . . 10.0 112.098 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 10.5 t -174.39 161.18 3.34 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.726 -0.67 . . . . 10.0 109.314 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -117.06 79.02 1.27 Allowed 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.201 0.524 . . . . 10.0 110.065 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 29.0 pt -110.88 152.46 43.6 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 115.977 -0.556 . . . . 10.0 110.678 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.85 141.67 59.93 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.159 1.906 . . . . 10.0 110.601 178.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.68 110.05 21.98 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.176 0.513 . . . . 10.0 110.105 -179.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -99.33 130.17 45.59 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 115.675 -0.693 . . . . 10.0 110.523 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -82.99 141.84 31.8 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.974 -0.557 . . . . 10.0 110.954 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 16.1 m -136.54 97.26 3.52 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.203 0.525 . . . . 10.0 109.772 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -79.02 127.99 32.68 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.586 -0.734 . . . . 10.0 111.329 -179.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.7 m -84.39 117.74 23.81 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.143 178.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.437 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 93.0 m-85 -84.99 116.18 23.24 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.847 -0.615 . . . . 10.0 110.006 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -153.08 146.88 25.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.142 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.407 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -81.11 136.63 35.94 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.904 -0.406 . . . . 10.0 109.904 179.169 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 80.3 p -119.52 157.91 50.52 Favored Pre-proline 0 C--N 1.32 -0.711 0 CA-C-N 116.341 -0.391 . . . . 10.0 110.354 -179.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -68.61 -8.16 22.43 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.405 2.07 . . . . 10.0 111.802 179.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 60.3 mtt -84.72 -17.36 38.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.972 -0.558 . . . . 10.0 110.496 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -73.27 -49.21 28.91 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.47 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.62 -61.64 4.54 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.871 -0.68 . . . . 10.0 112.413 179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.438 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 24.4 p -121.55 170.37 9.75 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.872 0.368 . . . . 10.0 111.085 -179.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.437 HD22 ' O ' ' A' ' 64' ' ' LEU . 1.7 tm? -67.15 -39.09 86.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.655 -0.702 . . . . 10.0 110.226 179.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.41 -55.14 38.64 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.301 -0.409 . . . . 10.0 110.129 179.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.9 m -65.09 -27.47 68.78 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.238 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.403 ' HB2' ' O ' ' A' ' 63' ' ' THR . 9.7 tmm? -69.78 -55.27 10.31 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.115 -0.493 . . . . 10.0 110.371 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 43.0 mt -64.53 -32.74 74.52 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 120.669 0.271 . . . . 10.0 111.087 179.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -60.5 -39.06 86.38 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.636 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 59.7 ttp85 -70.18 -41.73 73.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.434 . . . . 10.0 110.222 179.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 29.1 m0 -58.02 -48.72 79.22 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.715 -0.675 . . . . 10.0 110.473 179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.505 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -68.97 -42.46 76.59 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.553 -0.749 . . . . 10.0 111.626 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.42 -40.76 79.04 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.364 0.505 . . . . 10.0 112.364 -178.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -63.13 -38.23 90.37 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 111.854 0.316 . . . . 10.0 111.854 -179.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 10.2 m -98.75 11.63 38.03 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.435 -0.348 . . . . 10.0 111.817 -178.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 60.5 t30 58.14 30.1 18.86 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.482 0.658 . . . . 10.0 110.762 179.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 73.1 mtp -92.9 169.67 10.27 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.671 -0.695 . . . . 10.0 110.698 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -106.71 151.09 25.59 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.192 -0.458 . . . . 10.0 111.043 -179.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 41.9 tp -116.08 126.54 53.89 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.288 0.566 . . . . 10.0 111.117 179.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.412 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 0.5 OUTLIER -108.97 95.87 5.94 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.867 -0.79 . . . . 10.0 108.867 178.725 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.564 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 7.7 t80 -93.41 101.82 14.04 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.884 -0.598 . . . . 10.0 110.088 -179.056 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 60.7 m-80 -100.68 31.07 3.65 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.326 0.584 . . . . 10.0 110.452 -179.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.536 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 32.1 mt -105.57 151.24 39.75 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.606 -0.725 . . . . 10.0 109.716 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.74 -27.68 21.47 Favored 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 122.542 2.161 . . . . 10.0 112.918 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 18.0 m -153.75 167.24 30.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.646 0.26 . . . . 10.0 110.76 -179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.564 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 6.6 p-10 -93.04 146.3 23.73 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.43 -0.581 . . . . 10.0 109.43 178.441 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.428 ' HE2' HD13 ' A' ' 83' ' ' LEU . 9.2 m-85 -124.78 157.93 34.57 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.416 -0.356 . . . . 10.0 110.237 -179.229 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.438 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.6 OUTLIER -81.76 163.79 22.15 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.156 -0.475 . . . . 10.0 111.087 179.702 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.46 119.35 15.49 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.656 -0.498 . . . . 10.0 109.656 179.373 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 6.4 pt -57.41 -34.92 47.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 112.439 0.533 . . . . 10.0 112.439 -179.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 152.31 -72.84 0.27 Allowed Glycine 0 CA--C 1.518 0.279 0 C-N-CA 120.06 -1.067 . . . . 10.0 113.261 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -61.54 -3.25 3.21 Favored 'Trans proline' 0 N--CA 1.478 0.588 0 C-N-CA 123.374 2.716 . . . . 10.0 113.903 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.1 t -61.62 -41.24 89.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.237 0.541 . . . . 10.0 110.64 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.407 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.9 OUTLIER -73.09 -7.11 49.87 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.804 -0.635 . . . . 10.0 111.613 -179.88 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.09 2.28 56.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.927 0.394 . . . . 10.0 111.017 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 32.5 mt -104.6 113.76 42.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 116.021 -0.536 . . . . 10.0 109.558 179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.4 m -138.34 99.47 3.86 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.004 0.431 . . . . 10.0 111.868 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 8.8 t -131.52 156.24 46.05 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.039 -0.528 . . . . 10.0 110.535 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.56 -13.12 43.78 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.043 0.449 . . . . 10.0 110.903 178.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 17.0 t -93.13 116.82 29.4 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.119 -0.491 . . . . 10.0 110.219 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.437 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 14.6 p -65.1 -30.38 50.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.921 0.391 . . . . 10.0 110.206 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -68.44 -42.35 79.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.954 -0.567 . . . . 10.0 109.825 179.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -68.75 -43.37 75.96 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.919 -0.582 . . . . 10.0 109.937 178.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.02 -48.34 73.51 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.785 -0.643 . . . . 10.0 110.626 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.72 -39.61 92.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.024 -0.535 . . . . 10.0 110.573 179.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 62.2 m -65.69 -48.0 73.53 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.807 -0.633 . . . . 10.0 111.0 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -65.75 -38.71 89.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.334 -0.394 . . . . 10.0 111.045 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.411 ' HA ' HD23 ' A' ' 108' ' ' LEU . 16.7 mt -62.54 -48.89 77.51 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.749 -0.463 . . . . 10.0 109.749 178.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 23.8 m -58.95 -33.01 70.13 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.854 -0.612 . . . . 10.0 111.227 179.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.25 -40.51 94.3 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.933 0.396 . . . . 10.0 110.999 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 3.2 t -84.85 -40.72 15.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.49 0.662 . . . . 10.0 110.852 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.433 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 8.3 m-30 -69.64 -25.46 63.93 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.249 -0.887 . . . . 10.0 112.647 -178.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.576 ' O ' HG21 ' A' ' 133' ' ' VAL . . . -50.05 -42.27 49.42 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.295 0.48 . . . . 10.0 112.295 -179.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.37 -23.84 67.43 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.723 0.268 . . . . 10.0 111.723 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -95.1 -3.79 47.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.839 0.352 . . . . 10.0 110.928 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 88.62 23.8 35.22 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.715 -0.755 . . . . 10.0 113.237 179.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.433 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 88.6 t -126.33 139.76 50.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.965 0.412 . . . . 10.0 110.578 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 35.0 m -142.28 140.84 32.33 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 110.068 -0.345 . . . . 10.0 110.068 178.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.437 HG12 HG22 ' A' ' 128' ' ' VAL . 11.0 m -126.5 134.23 66.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.103 0.478 . . . . 10.0 111.55 -178.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.8 m -140.1 143.71 36.41 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.191 -0.67 . . . . 10.0 109.191 179.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.468 ' HB ' HD23 ' A' ' 126' ' ' LEU . 3.1 p -107.75 127.58 63.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-O 121.275 0.559 . . . . 10.0 110.039 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.4 m -145.99 130.53 17.83 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.598 -0.728 . . . . 10.0 110.153 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.32 39.51 18.77 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.564 0.54 . . . . 10.0 111.089 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 14.4 m120 62.67 28.84 16.76 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.65 -0.705 . . . . 10.0 110.986 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.412 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 66.7 tttt -130.81 132.25 45.13 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.651 -0.704 . . . . 10.0 109.867 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.505 HD12 ' HB2' ' A' ' 72' ' ' ALA . 48.9 mt -87.88 122.11 31.11 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.298 -1.001 . . . . 10.0 108.298 179.097 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.14 115.52 27.65 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-O 121.062 0.458 . . . . 10.0 111.286 -178.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.437 HG22 HG12 ' A' ' 119' ' ' VAL . 3.2 t -97.17 119.91 45.82 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 N-CA-C 108.742 -0.836 . . . . 10.0 108.742 178.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -132.6 128.48 20.98 Favored Pre-proline 0 C--N 1.32 -0.685 0 N-CA-C 109.943 -0.392 . . . . 10.0 109.943 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -73.23 131.22 16.23 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.311 2.008 . . . . 10.0 112.087 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -89.85 149.55 42.14 Favored Pre-proline 0 C--N 1.318 -0.771 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.315 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -79.26 73.34 6.06 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 122.843 2.362 . . . . 10.0 113.263 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.576 HG21 ' O ' ' A' ' 113' ' ' ALA . 16.2 m -129.03 132.0 67.61 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 120.877 0.37 . . . . 10.0 110.7 179.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 9.0 m -164.03 159.53 20.72 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.007 -0.542 . . . . 10.0 109.789 179.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.75 115.39 3.95 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 123.224 0.328 . . . . 10.0 110.669 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 105.01 93.36 2.3 Favored Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.933 -0.651 . . . . 10.0 111.582 -179.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -120.43 99.6 6.66 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.79 0.328 . . . . 10.0 110.528 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 7.3 tmtm? -81.22 78.06 8.05 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.159 -0.473 . . . . 10.0 110.383 -179.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' A' ' 139' ' ' LEU . 1.5 mm? . . . . . 0 C--O 1.247 0.939 0 CA-C-O 118.578 -0.725 . . . . 10.0 109.968 179.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.79 0 N-CA-C 111.816 -0.514 . . . . 10.0 111.816 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.3 m -126.48 103.08 7.41 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.914 0.388 . . . . 10.0 110.662 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 24.1 p-80 -69.41 148.3 49.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.933 -0.576 . . . . 10.0 110.707 179.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 22.8 ptt? -157.71 153.02 25.97 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.374 -0.376 . . . . 10.0 110.532 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 4.9 m -137.46 113.68 10.01 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.463 -0.335 . . . . 10.0 110.643 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -121.61 82.89 41.14 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.248 -0.433 . . . . 10.0 110.511 179.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -95.61 172.99 1.14 Allowed 'Trans proline' 0 N--CA 1.452 -0.916 0 C-N-CA 123.116 2.544 . . . . 10.0 111.904 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -136.39 139.83 30.81 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-O 120.657 0.265 . . . . 10.0 110.506 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -75.47 122.91 7.26 Favored 'Trans proline' 0 N--CA 1.46 -0.495 0 C-N-CA 122.716 2.277 . . . . 10.0 112.28 -179.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -104.41 162.35 13.3 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.175 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -137.65 66.85 1.44 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.266 0.555 . . . . 10.0 109.97 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -71.42 116.57 6.23 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.532 -0.758 . . . . 10.0 111.662 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 115.13 15.84 7.57 Favored Glycine 0 N--CA 1.447 -0.633 0 C-N-CA 120.747 -0.739 . . . . 10.0 111.724 -179.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -75.54 -17.1 60.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.056 0.455 . . . . 10.0 110.533 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 74.9 m95 -99.57 6.5 45.76 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.1 -0.5 . . . . 10.0 109.966 179.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.0 mmtt -82.34 12.96 3.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.935 -0.575 . . . . 10.0 111.219 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -72.35 121.89 20.25 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.843 -0.429 . . . . 10.0 109.843 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 7.0 m -134.41 155.0 38.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.796 -0.638 . . . . 10.0 109.662 179.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 43.8 t30 -154.23 110.43 3.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.091 0.472 . . . . 10.0 111.076 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 35.5 m80 -121.99 98.66 6.05 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 109.134 -0.691 . . . . 10.0 109.134 179.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 21.4 p90 -104.96 33.14 3.76 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.033 -0.531 . . . . 10.0 111.025 -178.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -74.15 109.8 7.93 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.999 -0.546 . . . . 10.0 110.677 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -140.52 178.17 7.5 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.773 -0.649 . . . . 10.0 109.583 179.375 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -68.51 146.03 97.51 Favored Pre-proline 0 C--N 1.319 -0.734 0 N-CA-C 110.147 -0.316 . . . . 10.0 110.147 179.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -64.98 -13.97 42.67 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.825 2.35 . . . . 10.0 112.451 -179.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 15.2 t -169.94 162.7 9.34 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.72 -0.673 . . . . 10.0 109.576 179.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -121.34 88.31 2.91 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.019 0.438 . . . . 10.0 110.432 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.6 pt -127.26 76.11 76.62 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 115.798 -0.637 . . . . 10.0 110.305 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.42 111.16 3.22 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 122.644 2.229 . . . . 10.0 112.494 -179.44 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -130.72 100.54 5.33 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.178 0.513 . . . . 10.0 110.006 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -127.35 86.82 2.54 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.745 -0.661 . . . . 10.0 110.378 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -113.98 118.17 33.39 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-O 120.994 0.426 . . . . 10.0 111.334 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 12.8 m -147.85 91.05 1.89 Allowed 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.099 -0.704 . . . . 10.0 109.099 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -68.39 125.97 28.12 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.808 -0.633 . . . . 10.0 111.467 -179.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.4 m -86.19 122.21 29.86 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.76 -0.655 . . . . 10.0 110.4 179.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.425 ' OH ' ' HB3' ' A' ' 75' ' ' SER . 67.4 m-85 -87.68 114.12 24.0 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.95 -0.568 . . . . 10.0 109.741 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -146.64 145.18 29.96 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.91 -0.586 . . . . 10.0 109.994 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -79.18 123.54 27.49 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.536 -0.542 . . . . 10.0 109.536 178.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.449 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 50.6 p -111.06 158.16 36.68 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-O 120.66 0.267 . . . . 10.0 111.04 -178.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.449 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 35.6 Cg_endo -64.25 -20.19 66.57 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.431 2.087 . . . . 10.0 111.321 178.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -66.28 -35.1 79.54 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.918 -0.771 . . . . 10.0 108.918 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -75.11 -56.07 5.1 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.484 -0.932 . . . . 10.0 108.484 178.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.63 -56.13 3.39 Favored Glycine 0 N--CA 1.45 -0.406 0 CA-C-N 115.309 -0.86 . . . . 10.0 113.536 178.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 63.5 p -108.04 166.03 11.03 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.062 0.458 . . . . 10.0 111.883 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 31.6 tp -61.92 -48.12 81.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.143 -0.935 . . . . 10.0 111.553 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -58.09 -54.55 45.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.77 -0.195 . . . . 10.0 111.133 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.3 m -58.41 -37.84 76.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.98 0.419 . . . . 10.0 111.497 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 10.1 tmm? -68.84 -52.29 31.41 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.054 -0.521 . . . . 10.0 111.002 -179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 26.8 mt -63.64 -34.13 77.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.519 -0.309 . . . . 10.0 111.09 -179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -62.24 -43.38 98.97 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.71 -0.478 . . . . 10.0 109.71 178.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.9 mmm180 -64.48 -43.04 95.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.717 -0.674 . . . . 10.0 110.076 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 21.3 m0 -60.03 -54.48 45.53 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.719 -0.673 . . . . 10.0 110.985 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.562 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -62.94 -36.82 84.69 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.982 -0.554 . . . . 10.0 111.655 -179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.83 -44.05 97.16 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.811 0.339 . . . . 10.0 111.158 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.04 -34.56 77.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.303 -0.408 . . . . 10.0 111.55 -179.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.425 ' HB3' ' OH ' ' A' ' 55' ' ' TYR . 4.7 p -91.51 0.77 57.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.415 -0.357 . . . . 10.0 111.551 -179.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 56.29 46.41 21.18 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 121.569 0.699 . . . . 10.0 109.705 -179.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.508 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 21.9 mtm -115.37 168.07 10.3 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.439 -0.8 . . . . 10.0 110.698 -179.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -93.79 150.08 20.69 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.125 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 22.4 tp -124.06 134.66 53.35 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.92 0.39 . . . . 10.0 110.174 179.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.62 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 1.6 m -121.46 95.98 4.9 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.7 -0.682 . . . . 10.0 109.987 179.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.512 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 11.6 t80 -90.83 96.78 10.81 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.273 -0.64 . . . . 10.0 109.273 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -98.92 22.52 10.09 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.258 0.552 . . . . 10.0 110.841 -179.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.512 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 63.5 mt -87.56 138.33 31.81 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.786 -0.643 . . . . 10.0 109.537 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 26.7 Cg_endo -61.44 -35.78 81.15 Favored 'Trans proline' 0 C--O 1.235 0.332 0 C-N-CA 123.08 2.52 . . . . 10.0 113.122 -179.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 5.8 m -137.51 168.71 19.11 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.143 0.497 . . . . 10.0 111.037 -179.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -82.78 143.81 30.59 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.524 -0.762 . . . . 10.0 109.574 178.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.461 ' CE2' HD13 ' A' ' 83' ' ' LEU . 48.4 m-85 -124.12 145.43 49.28 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.482 -0.326 . . . . 10.0 110.193 179.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 1.5 m -97.82 151.57 20.06 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.995 -0.548 . . . . 10.0 110.882 -179.413 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.54 112.73 1.7 Allowed 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 120.875 0.369 . . . . 10.0 110.126 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.0 pt -62.64 -33.8 61.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 112.68 0.622 . . . . 10.0 112.68 -178.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 151.02 -64.78 0.38 Allowed Glycine 0 CA--C 1.519 0.332 0 C-N-CA 120.172 -1.013 . . . . 10.0 113.455 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -60.56 -13.98 28.45 Favored 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.883 2.389 . . . . 10.0 113.16 -179.232 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.441 ' HA ' HD12 ' A' ' 96' ' ' ILE . 4.4 t -64.91 -35.5 75.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.213 -0.449 . . . . 10.0 110.862 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.93 -11.48 60.8 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.827 -0.624 . . . . 10.0 111.427 -179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.12 2.95 55.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.341 -0.39 . . . . 10.0 111.392 -179.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.599 HD13 HD12 ' A' ' 108' ' ' LEU . 39.3 mt -98.0 108.36 21.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.533 -0.303 . . . . 10.0 110.273 -179.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -131.72 100.43 5.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.243 -0.435 . . . . 10.0 111.755 -179.196 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.2 t -132.54 155.59 48.36 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.417 -0.356 . . . . 10.0 110.579 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -91.05 -1.63 57.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.846 0.355 . . . . 10.0 111.484 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 5.4 t -109.01 121.44 45.13 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.467 -0.333 . . . . 10.0 110.279 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 7.4 p -65.58 -30.78 51.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.83 0.348 . . . . 10.0 110.733 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -68.88 -46.28 68.8 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 109.663 -0.495 . . . . 10.0 109.663 179.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -65.12 -36.38 84.08 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.827 -0.624 . . . . 10.0 109.329 178.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -60.34 -51.12 70.86 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.673 -0.694 . . . . 10.0 110.229 178.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.81 -33.38 75.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.632 179.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 51.5 m -66.91 -46.32 75.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.222 -0.444 . . . . 10.0 110.775 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -70.99 -36.81 72.63 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.864 -0.607 . . . . 10.0 110.277 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.599 HD12 HD13 ' A' ' 96' ' ' ILE . 2.9 mp -62.75 -47.61 82.8 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.02 -0.536 . . . . 10.0 110.751 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.1 p -62.45 -29.84 70.81 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 116.734 -0.212 . . . . 10.0 111.281 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.04 -35.74 81.37 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.166 0.508 . . . . 10.0 110.791 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 45.6 t -84.94 -41.65 15.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-O 121.409 0.624 . . . . 10.0 110.264 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.531 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 12.1 m-30 -68.3 -26.75 65.79 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.166 -0.924 . . . . 10.0 112.273 -178.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -51.02 -44.69 61.05 Favored 'General case' 0 C--N 1.33 -0.279 0 O-C-N 123.07 0.231 . . . . 10.0 111.468 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -67.62 -23.4 65.35 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.891 0.377 . . . . 10.0 111.265 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 37.7 mm-40 -89.38 -12.46 40.32 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.352 -0.385 . . . . 10.0 110.786 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 96.13 22.28 20.45 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.604 -0.808 . . . . 10.0 112.809 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.531 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 90.3 t -127.61 145.41 35.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 120.872 0.367 . . . . 10.0 110.052 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 19.2 m -139.44 117.92 12.14 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.996 0.427 . . . . 10.0 110.269 178.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.469 HG12 HG13 ' A' ' 128' ' ' VAL . 28.0 m -108.48 144.98 16.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.778 -0.647 . . . . 10.0 111.46 -179.536 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 48.5 m -155.47 142.46 19.12 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.885 -0.783 . . . . 10.0 108.885 178.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.516 ' HB ' HD23 ' A' ' 126' ' ' LEU . 2.6 p -104.44 117.39 49.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 109.32 -0.622 . . . . 10.0 109.32 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 16.6 m -132.52 118.93 19.87 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.834 -0.621 . . . . 10.0 111.252 -178.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.28 51.93 5.19 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 123.916 0.76 . . . . 10.0 112.402 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.508 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 78.3 m-20 60.44 33.89 20.59 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 116.059 -0.518 . . . . 10.0 111.594 179.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.62 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 64.2 tttt -143.69 129.28 19.14 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.166 -0.47 . . . . 10.0 109.789 179.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.562 HD12 ' HB2' ' A' ' 72' ' ' ALA . 36.7 mt -88.26 121.22 30.4 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.604 -0.888 . . . . 10.0 108.604 179.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 127' ' ' LEU . 2.3 mm? -103.39 116.54 32.6 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.954 -0.566 . . . . 10.0 110.667 -179.062 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.469 HG13 HG12 ' A' ' 119' ' ' VAL . 2.8 t -111.43 118.01 56.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 N-CA-C 108.64 -0.874 . . . . 10.0 108.64 178.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -143.39 148.43 44.03 Favored Pre-proline 0 C--N 1.322 -0.625 0 CA-C-O 120.686 0.279 . . . . 10.0 111.144 -178.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -79.06 143.58 18.04 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 122.552 2.168 . . . . 10.0 110.911 178.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -99.85 155.19 36.74 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 116.523 -0.308 . . . . 10.0 110.202 179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.31 72.14 3.56 Favored 'Trans proline' 0 CA--C 1.531 0.367 0 C-N-CA 122.771 2.314 . . . . 10.0 112.387 -179.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 21.2 m -137.94 -179.1 2.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.485 -0.779 . . . . 10.0 109.613 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 48.8 m -148.38 100.96 3.2 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.959 0.409 . . . . 10.0 110.586 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.04 121.43 26.05 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.867 -179.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 84.41 46.57 5.76 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.6 -0.81 . . . . 10.0 111.778 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -83.54 94.7 8.11 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.994 0.426 . . . . 10.0 110.422 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -77.21 138.7 39.6 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.559 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 31.1 mt . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.283 -0.865 . . . . 10.0 110.116 179.747 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.685 0 N-CA-C 111.981 -0.448 . . . . 10.0 111.981 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 m -90.13 -25.88 20.48 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.763 0.316 . . . . 10.0 110.848 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -155.91 167.71 29.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.328 -0.396 . . . . 10.0 110.203 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.7 ptt? -83.43 -2.01 54.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.398 -0.365 . . . . 10.0 111.212 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.79 100.49 5.49 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.908 0.385 . . . . 10.0 111.029 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 15.8 mmtt -98.9 154.98 37.11 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 116.343 -0.39 . . . . 10.0 110.245 -179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -71.94 70.29 2.92 Favored 'Trans proline' 0 C--O 1.236 0.394 0 C-N-CA 122.594 2.196 . . . . 10.0 112.186 179.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.28 151.46 21.34 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.056 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.87 -158.86 0.07 OUTLIER 'Trans proline' 0 CA--C 1.532 0.382 0 C-N-CA 122.481 2.12 . . . . 10.0 112.413 179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -75.25 -173.13 1.93 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.227 -0.442 . . . . 10.0 110.763 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -58.42 -41.57 85.29 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 120.99 0.424 . . . . 10.0 110.458 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -120.78 166.53 13.9 Favored Glycine 0 N--CA 1.442 -0.922 0 N-CA-C 111.123 -0.791 . . . . 10.0 111.123 179.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 76.39 75.23 0.89 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.624 -0.798 . . . . 10.0 111.358 -179.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -84.46 -170.84 3.3 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.487 0.184 . . . . 10.0 110.987 -179.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 77.0 m95 64.51 39.42 6.82 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.394 0.616 . . . . 10.0 110.081 -179.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -127.94 29.28 5.45 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.451 -0.795 . . . . 10.0 109.963 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -85.43 89.7 7.76 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.59 -0.732 . . . . 10.0 110.191 179.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.58 99.37 4.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 CA-C-N 115.729 -0.669 . . . . 10.0 110.683 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.2 p-10 -150.56 8.25 0.59 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.998 -0.547 . . . . 10.0 110.636 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 69.7 t60 -74.48 99.79 3.67 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.081 0.467 . . . . 10.0 110.19 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -92.62 136.01 33.6 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.639 -0.709 . . . . 10.0 110.664 -179.522 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -117.6 -12.76 10.29 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.623 0.725 . . . . 10.0 109.176 178.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -64.11 143.93 57.5 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 114.688 -1.142 . . . . 10.0 110.689 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -157.08 150.97 19.4 Favored Pre-proline 0 C--N 1.313 -1.018 0 CA-C-N 115.415 -0.811 . . . . 10.0 110.161 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.32 96.65 0.11 Allowed 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 122.574 2.183 . . . . 10.0 111.731 179.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 7.4 m -93.92 84.93 4.63 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.814 -0.63 . . . . 10.0 110.286 -179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -107.93 90.7 3.38 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.924 -0.58 . . . . 10.0 110.212 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 32.2 pt -104.38 140.04 20.68 Favored Pre-proline 0 C--N 1.319 -0.734 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.166 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -62.17 110.4 1.02 Allowed 'Trans proline' 0 N--CA 1.464 -0.243 0 C-N-CA 122.504 2.136 . . . . 10.0 111.38 179.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mt -120.74 59.5 0.92 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.048 -0.524 . . . . 10.0 111.078 -179.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -67.52 116.53 8.36 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.498 -0.556 . . . . 10.0 109.498 179.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.11 111.64 1.4 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.125 -0.489 . . . . 10.0 110.482 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.4 m -132.23 97.91 4.26 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.168 0.508 . . . . 10.0 110.869 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -75.58 114.41 14.12 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.844 -0.616 . . . . 10.0 110.207 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 13.9 m -69.0 114.96 7.76 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 121.343 0.592 . . . . 10.0 110.256 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.501 ' O ' ' HA ' ' A' ' 97' ' ' SER . 52.0 m-85 -79.59 115.49 19.24 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.526 -0.761 . . . . 10.0 110.865 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -150.69 148.94 29.19 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.642 -0.708 . . . . 10.0 109.73 179.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -84.34 119.3 24.92 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.258 -0.645 . . . . 10.0 109.258 178.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 51.8 p -104.32 153.5 38.99 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 116.538 -0.301 . . . . 10.0 110.833 -179.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -64.42 -13.11 36.56 Favored 'Trans proline' 0 N--CA 1.465 -0.149 0 C-N-CA 122.67 2.246 . . . . 10.0 111.701 179.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 24.7 mmt -79.35 -21.96 45.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.848 -0.615 . . . . 10.0 110.313 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 64.1 m-20 -75.31 -51.56 12.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.386 -0.598 . . . . 10.0 109.386 179.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 89.94 -65.25 2.95 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.918 -0.658 . . . . 10.0 112.846 178.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.473 HG22 HG23 ' A' ' 88' ' ' THR . 30.0 p -117.22 169.73 9.23 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.018 0.437 . . . . 10.0 111.666 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.403 HD13 ' CE2' ' A' ' 112' ' ' TYR . 60.4 tp -62.85 -38.87 92.54 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.453 -0.794 . . . . 10.0 110.821 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -61.42 -52.17 65.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.946 -0.57 . . . . 10.0 110.474 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.24 -35.47 81.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.273 -0.422 . . . . 10.0 111.546 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 11.0 tmm? -68.06 -50.62 54.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 10.0 110.849 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 88.2 mt -63.23 -35.85 81.71 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.842 0.353 . . . . 10.0 110.229 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -61.53 -38.13 86.28 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.365 -0.606 . . . . 10.0 109.365 178.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.433 HH11 ' HD3' ' A' ' 70' ' ' ARG . 3.8 tpp180 -68.17 -46.27 71.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.457 -0.792 . . . . 10.0 110.037 179.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 32.5 m0 -57.33 -50.94 71.33 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.827 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.52 -41.77 83.88 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.892 -0.594 . . . . 10.0 111.858 -179.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.83 -41.03 96.07 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.82 0.343 . . . . 10.0 111.668 -179.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -68.75 -34.07 74.96 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.316 -0.402 . . . . 10.0 111.266 -179.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 2.9 m -94.01 2.9 55.98 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.316 -0.402 . . . . 10.0 111.802 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 67.2 t30 57.74 55.26 5.61 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.366 0.603 . . . . 10.0 110.4 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 19.5 mtm -129.59 173.13 10.89 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.034 -179.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -98.72 155.12 17.49 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.553 -0.294 . . . . 10.0 110.264 179.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.0 tp -132.2 135.57 46.42 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.919 0.39 . . . . 10.0 110.997 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.608 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 1.1 m -122.74 96.78 5.16 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.842 -0.617 . . . . 10.0 110.523 179.183 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.514 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 27.7 t80 -88.16 98.88 11.8 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.745 -0.662 . . . . 10.0 109.534 179.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -107.72 33.45 4.06 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.779 0.323 . . . . 10.0 111.463 -178.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.449 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 39.4 mt -88.06 150.28 47.13 Favored Pre-proline 0 C--N 1.322 -0.596 0 N-CA-C 110.322 -0.251 . . . . 10.0 110.322 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -63.14 -29.56 74.4 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.577 2.185 . . . . 10.0 112.262 179.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.1 m -152.36 166.28 32.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.268 -0.424 . . . . 10.0 110.412 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.514 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 0.6 OUTLIER -87.97 140.44 29.5 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.202 -0.666 . . . . 10.0 109.202 178.507 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 41.5 m-85 -120.98 144.94 48.24 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.935 0.398 . . . . 10.0 111.231 -178.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.473 HG23 HG22 ' A' ' 63' ' ' THR . 0.2 OUTLIER -84.73 161.13 20.13 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.73 -0.668 . . . . 10.0 110.242 179.766 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -57.09 117.81 4.39 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-O 121.138 0.495 . . . . 10.0 110.573 179.125 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.6 pt -61.68 -35.97 70.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.407 -0.815 . . . . 10.0 112.162 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 137.87 -69.01 0.5 Allowed Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.633 -0.794 . . . . 10.0 112.285 -179.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.27 -13.12 36.25 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.718 2.278 . . . . 10.0 112.389 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.36 -32.46 53.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.631 0.729 . . . . 10.0 110.196 178.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.68 -10.58 59.84 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.834 -1.075 . . . . 10.0 111.261 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -92.32 -1.19 57.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.059 0.456 . . . . 10.0 110.715 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 56.9 mt -98.24 113.36 32.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.958 -0.565 . . . . 10.0 109.567 179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.501 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 1.6 m -140.66 96.72 3.07 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.285 -0.416 . . . . 10.0 110.753 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 13.7 t -127.02 155.72 42.78 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.246 -0.434 . . . . 10.0 110.698 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.46 -5.05 52.71 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.356 -0.383 . . . . 10.0 111.972 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 62.3 m -100.27 119.38 38.31 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.906 -0.405 . . . . 10.0 109.906 179.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.4 HG22 ' HE2' ' A' ' 55' ' ' TYR . 0.8 OUTLIER -56.72 -49.29 78.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.136 -0.484 . . . . 10.0 111.913 -178.979 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -62.07 -33.52 74.56 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.776 -0.647 . . . . 10.0 111.403 -178.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -73.36 -39.76 64.91 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.945 -0.391 . . . . 10.0 109.945 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.96 -48.74 79.08 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.951 -0.568 . . . . 10.0 110.216 179.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.11 -43.53 98.18 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.878 -0.601 . . . . 10.0 110.575 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 84.6 m -62.6 -44.75 95.52 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.963 179.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -66.15 -39.55 89.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.179 -0.464 . . . . 10.0 110.707 179.667 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.444 HD23 ' HA ' ' A' ' 108' ' ' LEU . 15.2 mt -61.06 -53.59 55.25 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.954 -0.387 . . . . 10.0 109.954 178.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 20.7 m -57.6 -31.78 66.55 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.328 -0.396 . . . . 10.0 111.589 -179.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.98 -39.12 91.1 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.192 0.52 . . . . 10.0 110.789 179.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 6.4 t -90.61 -29.86 4.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.833 -0.622 . . . . 10.0 111.553 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.405 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 3.1 m-85 -82.17 -24.04 35.2 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 114.465 1.283 . . . . 10.0 114.465 -177.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.76 -38.42 33.81 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 112.291 0.478 . . . . 10.0 112.291 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -65.97 -18.93 65.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.058 0.456 . . . . 10.0 111.717 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -97.71 -4.2 37.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.978 0.418 . . . . 10.0 110.209 179.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.4 ' HA2' HG23 ' A' ' 131' ' ' VAL . . . 84.91 27.4 34.51 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.956 -0.64 . . . . 10.0 112.272 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.405 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 67.6 t -124.61 136.06 61.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 CA-C-O 120.814 0.34 . . . . 10.0 110.642 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 29.4 m -140.39 123.18 16.38 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.935 0.397 . . . . 10.0 110.091 179.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 5.4 m -111.61 147.88 15.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.175 -0.466 . . . . 10.0 110.873 -179.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 19.1 m -150.65 155.93 40.35 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.215 -0.448 . . . . 10.0 110.133 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.472 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.4 t -112.17 115.75 50.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 109.126 -0.694 . . . . 10.0 109.126 179.629 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 14.5 m -136.55 117.92 14.67 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 116.342 -0.39 . . . . 10.0 111.146 -178.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 63.92 51.49 2.31 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.671 -0.695 . . . . 10.0 111.929 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 54.91 35.04 23.52 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.531 0.681 . . . . 10.0 110.813 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.608 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 75.6 tttt -140.54 133.37 29.05 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.485 -0.779 . . . . 10.0 109.827 -179.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.472 ' CD2' HG22 ' A' ' 121' ' ' VAL . 94.0 mt -88.65 121.5 31.09 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 109.039 -0.726 . . . . 10.0 109.039 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.535 HD22 ' HB2' ' A' ' 80' ' ' SER . 13.2 mt -112.86 125.96 54.93 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 121.199 0.523 . . . . 10.0 110.809 -178.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 2.6 t -108.3 118.73 56.54 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.972 0 N-CA-C 108.222 -1.029 . . . . 10.0 108.222 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -127.98 138.09 32.19 Favored Pre-proline 0 C--N 1.319 -0.742 0 CA-C-O 120.841 0.353 . . . . 10.0 111.365 -178.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -81.62 133.24 8.15 Favored 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.133 1.888 . . . . 10.0 110.898 177.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.4 HG23 ' HA2' ' A' ' 116' ' ' GLY . 1.6 m -99.05 143.93 27.28 Favored Pre-proline 0 C--N 1.317 -0.836 0 CA-C-N 116.305 -0.407 . . . . 10.0 110.691 -179.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -79.65 71.19 7.17 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.803 2.335 . . . . 10.0 112.419 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 31.5 m -120.79 166.62 15.06 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.9 -0.591 . . . . 10.0 110.902 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 1.5 m -87.77 78.42 8.41 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.278 0.561 . . . . 10.0 110.382 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 2.9 m -77.55 -29.14 52.08 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.891 -0.595 . . . . 10.0 111.076 -179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -154.39 -139.71 2.88 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.716 -0.674 . . . . 10.0 111.439 179.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -96.31 -30.92 13.16 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.948 0.404 . . . . 10.0 110.416 179.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 8.7 tptp -121.45 177.36 5.23 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.045 -0.525 . . . . 10.0 109.703 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.6 -0.715 . . . . 10.0 110.088 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.598 0 N-CA-C 111.87 -0.492 . . . . 10.0 111.87 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -69.47 107.24 3.27 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.022 0.439 . . . . 10.0 110.677 179.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 -89.93 102.4 15.11 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.254 -0.43 . . . . 10.0 110.932 -179.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 43.7 mtt -138.86 143.74 38.91 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.944 -0.571 . . . . 10.0 109.654 179.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -80.23 -26.16 39.24 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.392 -0.367 . . . . 10.0 111.106 -179.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp 56.63 77.26 0.43 Allowed Pre-proline 0 C--O 1.234 0.249 0 CA-C-N 115.767 -0.652 . . . . 10.0 110.73 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.43 160.18 42.16 Favored 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.451 2.101 . . . . 10.0 112.206 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -118.06 148.65 43.99 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 116.159 -0.473 . . . . 10.0 109.942 179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -64.08 139.26 66.11 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 122.482 2.121 . . . . 10.0 111.669 179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -86.93 163.91 16.85 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.029 -0.532 . . . . 10.0 110.721 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -155.85 112.64 3.18 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.426 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -156.89 -143.35 3.64 Favored Glycine 0 N--CA 1.446 -0.649 0 N-CA-C 111.724 -0.55 . . . . 10.0 111.724 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -78.95 65.65 3.51 Favored Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 121.037 -0.601 . . . . 10.0 112.804 179.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 28.8 ttt180 -88.2 -33.7 18.05 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.194 0.521 . . . . 10.0 110.176 179.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 48.2 m95 -92.06 -59.15 2.18 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.883 -0.598 . . . . 10.0 109.987 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 65.9 mttm 57.78 39.93 26.64 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.721 -0.672 . . . . 10.0 111.633 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 8.5 t60 -81.73 102.55 10.82 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.881 -0.414 . . . . 10.0 109.881 179.624 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -139.87 98.85 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 115.904 -0.589 . . . . 10.0 110.206 179.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -148.67 92.3 1.98 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.275 0.559 . . . . 10.0 110.515 -179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 17.7 m80 -101.86 131.74 48.04 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.574 -0.739 . . . . 10.0 110.124 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -88.78 -65.22 1.04 Allowed 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.368 -0.604 . . . . 10.0 109.368 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -155.65 164.86 38.06 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.347 -0.842 . . . . 10.0 109.237 178.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -127.76 72.13 1.39 Allowed 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.465 0.65 . . . . 10.0 110.93 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 44' ' ' PRO . . . -155.58 121.17 2.57 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.056 -0.975 . . . . 10.0 109.824 179.22 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 43' ' ' ALA . 38.1 Cg_exo -59.93 -66.23 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.847 2.365 . . . . 10.0 112.382 -179.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.6 m -142.31 97.67 3.17 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.206 -0.452 . . . . 10.0 110.333 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -132.65 80.77 1.91 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.226 0.536 . . . . 10.0 110.186 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 pt -120.45 107.81 38.47 Favored Pre-proline 0 C--N 1.32 -0.682 0 CA-C-N 115.851 -0.613 . . . . 10.0 110.524 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -75.39 58.15 5.04 Favored 'Trans proline' 0 N--CA 1.464 -0.243 0 C-N-CA 123.008 2.472 . . . . 10.0 111.969 179.299 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.5 tp -132.86 124.97 28.93 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 115.354 -0.839 . . . . 10.0 110.195 -179.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -104.41 150.07 24.85 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.928 -0.578 . . . . 10.0 109.624 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -57.58 109.15 0.65 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.837 0.351 . . . . 10.0 111.417 -179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 4.6 m -127.82 96.25 4.45 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.182 0.515 . . . . 10.0 110.145 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -66.91 127.1 31.23 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.633 -0.712 . . . . 10.0 111.129 -179.599 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.4 m -82.92 113.1 20.29 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.841 -0.618 . . . . 10.0 110.577 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.436 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 95.1 m-85 -83.29 107.54 15.89 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.777 -0.647 . . . . 10.0 109.525 179.535 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -147.6 174.07 12.11 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.859 -0.61 . . . . 10.0 109.818 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.52 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -100.91 127.55 47.33 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.358 -0.383 . . . . 10.0 111.381 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 43.6 p -109.71 153.9 42.74 Favored Pre-proline 0 C--N 1.323 -0.587 0 N-CA-C 109.872 -0.418 . . . . 10.0 109.872 179.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -66.85 -9.52 25.04 Favored 'Trans proline' 0 CA--C 1.529 0.264 0 C-N-CA 122.333 2.022 . . . . 10.0 111.626 179.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 61.8 mtm -84.6 -19.89 32.3 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.83 -0.623 . . . . 10.0 110.492 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -73.11 -57.9 3.7 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.151 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.407 ' O ' HD22 ' A' ' 89' ' ' LEU . . . 87.05 -57.82 4.59 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.838 -0.696 . . . . 10.0 113.167 179.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 65.5 p -119.24 164.54 15.47 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.485 0.55 . . . . 10.0 112.485 -178.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.416 HD13 ' CE2' ' A' ' 112' ' ' TYR . 27.3 tp -61.35 -45.14 95.63 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.282 -0.872 . . . . 10.0 111.386 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.1 ttpt -59.17 -50.34 74.42 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.284 -0.416 . . . . 10.0 110.828 -179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.594 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 51.8 m -60.74 -43.45 97.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.234 -0.439 . . . . 10.0 110.948 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.402 ' SD ' ' HB2' ' A' ' 57' ' ' ALA . 57.0 ttp -60.72 -50.82 71.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.612 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.441 ' HB3' HD13 ' A' ' 79' ' ' LEU . 83.2 mt -63.55 -35.23 79.81 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.875 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -60.87 -43.37 98.51 Favored 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.624 -0.51 . . . . 10.0 109.624 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.594 ' HG2' ' O ' ' A' ' 66' ' ' THR . 31.6 mmt180 -64.93 -46.06 83.2 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.643 -0.708 . . . . 10.0 109.643 178.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 38.9 m0 -55.23 -50.54 69.15 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.469 -0.787 . . . . 10.0 110.793 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.428 ' HA ' ' HB2' ' A' ' 77' ' ' MET . . . -66.0 -52.14 52.04 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.413 -0.812 . . . . 10.0 112.338 -179.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.93 -43.61 77.55 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.253 0.464 . . . . 10.0 112.253 -178.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -58.21 -35.83 72.22 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 10.0 111.909 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.1 m -105.38 18.75 21.75 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.24 0.459 . . . . 10.0 112.24 -178.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 65.4 t30 57.91 35.54 25.44 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.636 0.732 . . . . 10.0 111.209 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.428 ' HB2' ' HA ' ' A' ' 72' ' ' ALA . 72.6 mtp -103.19 173.88 6.11 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.839 -0.618 . . . . 10.0 110.035 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 70.7 mm-40 -114.02 157.91 21.88 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.448 -0.342 . . . . 10.0 110.819 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.441 HD13 ' HB3' ' A' ' 68' ' ' LEU . 43.6 tp -124.99 131.51 53.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.195 0.522 . . . . 10.0 110.958 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -115.59 96.37 5.6 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.562 -0.745 . . . . 10.0 109.251 178.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.548 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 6.6 t80 -91.45 98.57 11.77 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.098 -0.501 . . . . 10.0 110.097 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.458 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 42.2 m-80 -94.94 11.96 29.99 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.901 -179.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.507 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 45.2 mt -84.12 147.61 51.24 Favored Pre-proline 0 C--N 1.324 -0.523 0 N-CA-C 109.594 -0.521 . . . . 10.0 109.594 179.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -57.29 -41.86 68.63 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.662 2.241 . . . . 10.0 112.634 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 2.1 m -147.11 170.49 17.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.452 -0.34 . . . . 10.0 110.096 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.548 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 7.0 p-10 -80.82 148.06 30.16 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 110.039 -0.356 . . . . 10.0 110.039 179.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 82.3 m-85 -123.72 143.24 50.4 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.838 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -76.28 152.32 36.5 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.021 -0.536 . . . . 10.0 110.524 179.373 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.407 HD22 ' O ' ' A' ' 62' ' ' GLY . 0.1 OUTLIER -58.75 136.31 57.7 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.735 0.302 . . . . 10.0 110.245 178.986 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.5 pt -81.48 -27.62 10.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-N 116.384 -0.371 . . . . 10.0 111.534 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 138.37 -62.49 0.57 Allowed Glycine 0 CA--C 1.523 0.536 0 C-N-CA 120.217 -0.992 . . . . 10.0 113.282 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -58.61 -15.75 27.03 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 123.02 2.48 . . . . 10.0 113.098 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 1.5 t -61.81 -36.64 74.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.906 -0.588 . . . . 10.0 110.922 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.52 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.1 m -71.66 -14.71 62.13 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.87 -0.604 . . . . 10.0 111.723 -179.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -88.3 -1.31 57.95 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.052 0.453 . . . . 10.0 110.523 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.437 HD13 HD12 ' A' ' 108' ' ' LEU . 56.9 mt -101.65 111.77 32.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.771 -0.649 . . . . 10.0 109.371 179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.0 m -139.99 97.16 3.19 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.112 0.482 . . . . 10.0 110.564 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.1 t -130.76 157.67 42.2 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.073 -0.512 . . . . 10.0 110.692 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -87.42 -18.29 30.31 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.03 -0.532 . . . . 10.0 110.462 179.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.03 113.31 25.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.619 -0.718 . . . . 10.0 110.275 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.436 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 9.8 p -61.14 -31.68 50.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.565 0.221 . . . . 10.0 111.269 -179.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 90.5 mt-30 -65.93 -41.1 91.78 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.945 0.402 . . . . 10.0 110.028 179.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 54.8 tt0 -66.99 -41.96 85.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.911 -0.586 . . . . 10.0 109.923 179.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -57.05 -50.37 72.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.722 -0.672 . . . . 10.0 110.61 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.23 -36.44 79.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.582 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 63.0 m -64.18 -45.76 86.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.93 -0.577 . . . . 10.0 110.852 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -69.78 -39.19 76.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.324 -0.398 . . . . 10.0 110.862 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.437 HD12 HD13 ' A' ' 96' ' ' ILE . 1.7 mp -63.34 -50.29 70.57 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.106 -0.497 . . . . 10.0 110.839 179.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 11.2 p -62.73 -21.72 66.01 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 111.696 0.258 . . . . 10.0 111.696 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.51 -48.03 51.51 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.891 0.376 . . . . 10.0 110.893 179.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.61 HG13 ' HD1' ' A' ' 112' ' ' TYR . 4.8 p -82.55 -28.48 8.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-O 121.421 0.629 . . . . 10.0 111.186 -179.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.61 ' HD1' HG13 ' A' ' 111' ' ' VAL . 3.1 m-85 -81.28 -22.86 38.33 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.658 -0.701 . . . . 10.0 112.798 -178.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.65 -42.64 45.77 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 112.342 0.497 . . . . 10.0 112.342 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.96 -20.01 63.33 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 120.876 0.37 . . . . 10.0 111.377 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -87.81 -13.31 42.55 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.187 0.518 . . . . 10.0 109.955 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.406 ' O ' ' HA ' ' A' ' 130' ' ' PRO . . . 95.61 24.93 14.5 Favored Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 115.717 -0.674 . . . . 10.0 112.48 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.459 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 96.5 t -128.27 130.9 69.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.052 0.453 . . . . 10.0 111.378 -179.184 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 3.6 m -127.54 111.61 13.98 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.236 -0.438 . . . . 10.0 109.979 178.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.433 HG21 ' HB3' ' A' ' 108' ' ' LEU . 3.3 m -102.57 142.39 16.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-O 121.077 0.465 . . . . 10.0 111.088 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 15.3 m -150.38 165.53 32.82 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.003 -0.544 . . . . 10.0 109.813 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.532 HG22 HD23 ' A' ' 126' ' ' LEU . 3.4 t -119.64 117.31 53.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 109.602 -0.518 . . . . 10.0 109.602 179.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 13.8 m -134.6 118.71 17.53 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.639 -0.255 . . . . 10.0 110.659 -179.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 65.05 43.75 3.63 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 123.732 0.645 . . . . 10.0 111.147 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 4.6 t30 59.37 29.67 19.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.116 -0.947 . . . . 10.0 110.619 -179.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -129.77 133.78 47.2 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.29 -0.868 . . . . 10.0 109.056 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.532 HD23 HG22 ' A' ' 121' ' ' VAL . 96.0 mt -87.97 122.01 31.06 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.727 -0.842 . . . . 10.0 108.727 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -113.3 116.0 29.04 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-O 121.207 0.527 . . . . 10.0 111.322 -178.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.458 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 3.2 t -99.33 117.63 44.73 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.077 0 N-CA-C 107.869 -1.159 . . . . 10.0 107.869 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -128.28 131.56 23.85 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-O 120.983 0.42 . . . . 10.0 111.096 -178.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.406 ' HA ' ' O ' ' A' ' 116' ' ' GLY . 59.3 Cg_endo -73.77 136.97 24.0 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.365 2.043 . . . . 10.0 110.78 178.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -107.06 142.45 25.05 Favored Pre-proline 0 C--N 1.316 -0.879 0 C-N-CA 120.827 -0.349 . . . . 10.0 110.202 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -81.34 76.9 4.19 Favored 'Trans proline' 0 N--CA 1.453 -0.878 0 C-N-CA 122.66 2.24 . . . . 10.0 111.256 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 4.4 m -102.52 22.73 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.276 -0.875 . . . . 10.0 111.108 -178.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 19.3 m -116.85 105.74 12.69 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.744 -0.662 . . . . 10.0 110.241 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.4 m -79.76 72.0 6.44 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.748 -0.66 . . . . 10.0 111.061 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 133.97 -138.95 10.47 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.92 -0.657 . . . . 10.0 111.604 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -94.34 169.06 10.49 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.634 0.255 . . . . 10.0 110.425 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 48.0 pttt -75.8 157.75 33.03 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.28 -0.418 . . . . 10.0 110.553 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 38.2 tp . . . . . 0 C--O 1.25 1.1 0 CA-C-O 118.35 -0.833 . . . . 10.0 109.28 179.08 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.807 0 N-CA-C 112.04 -0.424 . . . . 10.0 112.04 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 6.9 m -84.21 111.98 19.86 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.999 0.428 . . . . 10.0 111.1 -179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 3.5 m170 -101.78 119.14 38.31 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.134 -0.484 . . . . 10.0 110.284 179.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -62.85 125.69 24.83 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.993 -0.549 . . . . 10.0 110.554 -179.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 10.2 t -85.13 134.33 34.18 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.121 0.486 . . . . 10.0 110.117 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -118.16 149.1 45.05 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 116.061 -0.518 . . . . 10.0 110.711 -179.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -75.74 61.93 6.34 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.735 2.29 . . . . 10.0 112.09 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.26 148.12 34.13 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.992 -0.549 . . . . 10.0 110.32 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.37 145.43 65.41 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.52 2.147 . . . . 10.0 111.615 179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.1 p-10 -87.7 59.09 5.24 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.085 0.469 . . . . 10.0 111.079 -179.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.401 ' HB3' ' HB2' ' A' ' 33' ' ' ARG . 51.6 m-85 61.12 49.37 5.64 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.462 -0.79 . . . . 10.0 111.429 179.346 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -65.51 114.77 6.96 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.848 -0.615 . . . . 10.0 113.023 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 90.98 9.19 64.11 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.962 -0.637 . . . . 10.0 112.494 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.401 ' HB2' ' HB3' ' A' ' 30' ' ' PHE . 50.8 mtp180 -106.56 -2.57 21.73 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 122.655 -0.32 . . . . 10.0 111.141 -179.564 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 59.6 m95 -106.33 11.51 30.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.251 0.548 . . . . 10.0 110.922 -179.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -97.79 25.18 6.11 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.747 -0.66 . . . . 10.0 110.289 179.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -78.25 87.87 4.32 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.636 -0.711 . . . . 10.0 110.608 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 7.0 m -138.27 144.25 30.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-N 115.695 -0.684 . . . . 10.0 109.487 179.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -146.56 135.01 21.97 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 110.169 -0.308 . . . . 10.0 110.169 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -127.09 28.09 5.82 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.971 0.415 . . . . 10.0 110.792 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -105.38 60.08 0.67 Allowed 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.006 0.431 . . . . 10.0 110.328 179.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -60.7 142.57 55.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.606 -0.724 . . . . 10.0 111.221 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -108.32 153.64 22.96 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.705 -0.68 . . . . 10.0 110.851 -179.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -95.8 138.78 21.7 Favored Pre-proline 0 C--N 1.317 -0.824 0 CA-C-N 115.728 -0.669 . . . . 10.0 109.598 179.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_exo -49.97 -52.66 8.46 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.689 2.259 . . . . 10.0 111.87 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.1 m -149.16 94.66 2.27 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.845 -0.616 . . . . 10.0 110.203 179.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -72.38 130.3 40.4 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.148 0.499 . . . . 10.0 110.625 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 11.5 pt -140.6 147.81 50.57 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 115.55 -0.75 . . . . 10.0 110.059 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -68.18 166.18 25.98 Favored 'Trans proline' 0 C--O 1.236 0.424 0 C-N-CA 122.313 2.009 . . . . 10.0 111.16 179.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 25.0 tp -87.74 65.03 8.26 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.375 0.607 . . . . 10.0 109.918 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -76.74 119.67 20.85 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.423 -0.808 . . . . 10.0 108.943 179.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.74 110.02 0.53 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.14 0.495 . . . . 10.0 111.58 -179.16 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.7 m -142.27 90.97 2.29 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.75 -0.659 . . . . 10.0 109.84 179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -64.6 126.4 27.76 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.142 0.496 . . . . 10.0 111.074 -179.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.2 m -86.96 122.87 31.41 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.78 -0.646 . . . . 10.0 110.395 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -89.5 119.84 30.29 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.468 ' HG3' ' OG ' ' A' ' 97' ' ' SER . 1.9 tt0 -152.58 144.56 23.74 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.237 -0.438 . . . . 10.0 110.671 -178.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.51 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -78.16 128.05 33.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.041 -0.527 . . . . 10.0 110.002 178.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.462 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 82.5 p -113.71 159.64 34.92 Favored Pre-proline 0 C--N 1.32 -0.707 0 CA-C-N 116.571 -0.286 . . . . 10.0 110.576 -179.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.462 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 47.1 Cg_endo -69.53 -3.31 11.61 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.459 2.106 . . . . 10.0 112.122 179.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 45.2 mtt -88.24 -25.14 23.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 10.0 110.362 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -72.22 -58.61 3.28 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.939 -0.573 . . . . 10.0 110.054 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 86.95 -57.21 4.63 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.77 -0.729 . . . . 10.0 112.895 179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.649 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 65.3 p -121.52 172.57 7.98 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.426 0.528 . . . . 10.0 112.426 -179.366 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 25.7 tp -64.19 -48.62 75.22 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.114 -0.948 . . . . 10.0 111.752 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -58.79 -43.99 90.62 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.012 0.434 . . . . 10.0 110.472 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.8 m -66.51 -39.78 88.84 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.018 -0.537 . . . . 10.0 111.485 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 54.7 ttp -66.87 -50.14 63.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.044 0.45 . . . . 10.0 111.055 -179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 75.1 mt -62.17 -37.71 86.29 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.938 -0.574 . . . . 10.0 111.276 -179.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -60.49 -41.34 94.07 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.341 -0.39 . . . . 10.0 110.284 179.07 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -65.78 -47.63 74.52 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.173 -0.467 . . . . 10.0 110.285 179.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 43.5 m0 -58.19 -51.94 67.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.753 -0.658 . . . . 10.0 110.574 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.69 -42.48 99.65 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.784 -0.643 . . . . 10.0 111.515 -179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.4 -44.77 95.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.727 0.298 . . . . 10.0 111.755 -179.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -62.15 -40.27 95.41 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.372 -0.376 . . . . 10.0 111.417 -179.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 14.9 m -94.0 6.96 46.83 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.22 -0.445 . . . . 10.0 111.897 -178.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 46.9 t30 55.85 49.25 16.43 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.239 0.542 . . . . 10.0 111.272 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.452 ' SD ' ' HA ' ' A' ' 124' ' ' ASN . 10.8 mtm -114.68 174.0 6.18 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.816 -0.629 . . . . 10.0 110.756 -179.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 26.6 mp0 -102.15 163.1 12.42 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.664 -0.698 . . . . 10.0 110.68 -179.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 45.9 tp -130.88 138.82 49.99 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.179 0.514 . . . . 10.0 111.134 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -124.54 96.23 4.82 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.432 -0.804 . . . . 10.0 109.142 178.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.496 ' CZ ' HD12 ' A' ' 83' ' ' LEU . 4.7 t80 -92.31 98.34 11.44 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.427 -0.583 . . . . 10.0 109.427 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 128' ' ' VAL . 15.0 m120 -96.89 24.03 6.57 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.122 0.487 . . . . 10.0 110.589 -179.316 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.496 HD12 ' CZ ' ' A' ' 81' ' ' TYR . 44.4 mt -93.51 142.48 25.24 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.219 -0.446 . . . . 10.0 110.425 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -64.84 -29.84 58.59 Favored 'Trans proline' 0 C--O 1.233 0.238 0 C-N-CA 122.898 2.399 . . . . 10.0 112.327 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.2 m -147.46 153.26 39.34 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.951 -0.568 . . . . 10.0 109.587 179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.495 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 34.3 t0 -80.68 125.12 29.64 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.929 -0.397 . . . . 10.0 109.929 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 68.9 m-85 -100.47 149.8 23.31 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.3 -0.409 . . . . 10.0 110.643 -179.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.649 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 2.0 t -92.84 151.95 19.7 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.7 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -50.59 121.67 6.11 Favored 'General case' 0 C--N 1.337 0.042 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.868 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 2.0 pt -67.01 -29.57 46.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.965 -0.562 . . . . 10.0 111.935 -179.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 141.72 -68.45 0.46 Allowed Glycine 0 CA--C 1.52 0.344 0 C-N-CA 120.375 -0.916 . . . . 10.0 113.2 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -58.17 -7.28 3.58 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.639 2.893 . . . . 10.0 113.868 -179.033 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.465 ' HA ' HD12 ' A' ' 96' ' ' ILE . 5.8 t -68.07 -32.79 57.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 121.239 0.542 . . . . 10.0 110.452 179.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.51 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.5 m -72.62 -13.73 61.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.938 -0.573 . . . . 10.0 111.436 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -89.5 -0.1 57.26 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.044 0.449 . . . . 10.0 110.562 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.526 HD13 HD12 ' A' ' 108' ' ' LEU . 51.6 mt -97.95 111.0 26.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.82 -0.627 . . . . 10.0 109.584 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.468 ' OG ' ' HG3' ' A' ' 56' ' ' GLN . 2.8 m -134.08 98.78 4.23 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.161 -0.472 . . . . 10.0 110.697 -179.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 12.8 t -129.76 155.69 45.52 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.895 -0.593 . . . . 10.0 110.442 -179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -90.24 -9.47 47.89 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.798 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.4 t -104.29 123.76 47.95 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.662 0.267 . . . . 10.0 110.908 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.407 HG13 HG11 ' A' ' 121' ' ' VAL . 13.1 p -65.99 -29.7 47.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.257 0 CA-C-O 121.123 0.487 . . . . 10.0 110.104 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -69.93 -41.45 74.58 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-N 115.853 -0.612 . . . . 10.0 109.733 179.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -68.7 -39.43 80.5 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 109.3 -0.63 . . . . 10.0 109.3 178.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -56.83 -48.8 77.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.701 -0.682 . . . . 10.0 110.658 179.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.46 -35.38 80.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.324 0.583 . . . . 10.0 110.473 179.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 92.8 m -67.34 -47.5 70.28 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.46 -0.791 . . . . 10.0 110.802 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -69.6 -40.89 76.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.014 -0.539 . . . . 10.0 110.881 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . 0.526 HD12 HD13 ' A' ' 96' ' ' ILE . 2.5 mp -59.04 -48.28 82.17 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.181 -0.463 . . . . 10.0 110.773 179.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 59.2 m -59.55 -31.91 69.86 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 111.86 0.318 . . . . 10.0 111.86 -179.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.4 -37.42 83.36 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.375 0.607 . . . . 10.0 110.833 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 2.7 t -87.47 -42.74 15.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 115.416 -0.811 . . . . 10.0 110.521 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.48 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 13.2 m-30 -64.83 -26.63 68.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.166 -0.925 . . . . 10.0 112.504 -178.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -55.37 -31.42 61.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.774 0.321 . . . . 10.0 111.389 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -76.74 -11.54 59.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.91 0.386 . . . . 10.0 111.198 -179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 -109.96 -0.28 18.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.178 -0.465 . . . . 10.0 110.566 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 82.36 28.13 41.26 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.95 -0.643 . . . . 10.0 112.855 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.48 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 74.1 t -127.54 143.86 39.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.952 0.406 . . . . 10.0 110.338 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 13.9 m -142.47 138.83 31.28 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 109.451 -0.574 . . . . 10.0 109.451 178.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 9.9 m -126.32 143.24 40.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.407 0.623 . . . . 10.0 111.782 -178.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 49.2 m -150.84 139.85 21.02 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.546 -0.752 . . . . 10.0 109.429 178.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.407 HG11 HG13 ' A' ' 101' ' ' VAL . 2.3 p -102.48 121.0 53.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 109.652 -0.499 . . . . 10.0 109.652 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 67.3 m -139.91 124.51 18.2 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.054 -0.521 . . . . 10.0 110.767 -179.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.4 48.62 7.63 Favored 'General case' 0 C--O 1.235 0.291 0 O-C-N 123.537 0.523 . . . . 10.0 111.476 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.452 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 23.6 m120 57.69 33.01 22.7 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.783 -0.644 . . . . 10.0 111.498 179.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -137.19 129.9 30.24 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.6 -0.519 . . . . 10.0 109.6 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 37.3 mt -87.54 120.73 29.14 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 107.8 -1.185 . . . . 10.0 107.8 178.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.71 118.97 37.93 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-O 121.103 0.478 . . . . 10.0 111.591 -178.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.405 ' O ' ' HB2' ' A' ' 82' ' ' ASN . 3.0 t -104.44 118.36 51.57 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.957 0 N-CA-C 108.187 -1.042 . . . . 10.0 108.187 178.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -131.01 131.25 23.09 Favored Pre-proline 0 C--N 1.317 -0.827 0 CA-C-O 120.741 0.305 . . . . 10.0 110.96 -178.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -72.14 134.38 23.03 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.467 2.111 . . . . 10.0 111.058 179.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.41 ' HA ' ' HD3' ' A' ' 132' ' ' PRO . 0.9 OUTLIER -97.71 144.7 28.45 Favored Pre-proline 0 C--N 1.315 -0.912 0 N-CA-C 109.892 -0.41 . . . . 10.0 109.892 179.368 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 131' ' ' VAL . 2.9 Cg_exo -73.1 85.75 1.18 Allowed 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.783 2.322 . . . . 10.0 111.651 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 16.5 m -128.26 125.81 64.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.912 -0.585 . . . . 10.0 110.82 -179.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 65.7 m -159.13 55.0 0.41 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.599 0.714 . . . . 10.0 109.41 179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.5 m -76.18 119.22 19.79 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.227 -0.897 . . . . 10.0 110.564 -179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -113.55 28.87 8.26 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.663 -0.78 . . . . 10.0 112.657 -179.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -86.31 -37.66 18.29 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.959 0.409 . . . . 10.0 110.531 179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -132.08 98.58 4.46 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.082 -0.508 . . . . 10.0 109.898 179.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 2.6 mm? . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.254 -0.879 . . . . 10.0 110.138 -179.763 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.632 0 N-CA-C 111.63 -0.588 . . . . 10.0 111.63 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 14.7 m -76.43 71.64 3.1 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.186 0.517 . . . . 10.0 110.525 179.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 25.2 p80 -65.23 133.46 51.53 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.804 -0.634 . . . . 10.0 110.352 179.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 64.5 mtt -120.36 142.71 48.91 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.931 -0.577 . . . . 10.0 110.052 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -63.17 105.77 0.76 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.909 0.385 . . . . 10.0 111.361 -179.487 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -121.29 141.16 32.56 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.191 -0.459 . . . . 10.0 110.244 179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -69.63 135.22 30.21 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.146 1.897 . . . . 10.0 111.416 179.414 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -71.35 154.62 93.53 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 116.289 -0.414 . . . . 10.0 110.63 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.72 149.72 57.73 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 122.55 2.167 . . . . 10.0 111.788 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.5 175.66 6.08 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.388 -0.369 . . . . 10.0 110.962 -179.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -164.08 150.06 11.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.137 -0.483 . . . . 10.0 110.006 -179.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 88.4 23.25 37.62 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.671 -0.776 . . . . 10.0 111.682 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -133.92 25.6 3.52 Favored Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 111.321 -0.712 . . . . 10.0 111.321 179.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 42.4 ttt180 -78.51 -33.15 48.24 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.938 0.399 . . . . 10.0 110.105 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 33.8 m95 -78.48 77.09 4.97 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.823 -0.626 . . . . 10.0 110.796 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -128.87 31.3 4.95 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.654 -0.703 . . . . 10.0 109.71 179.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -72.4 97.34 2.03 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.442 -0.799 . . . . 10.0 109.905 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 15.8 m -125.49 -5.65 5.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 116.368 -0.378 . . . . 10.0 111.479 -179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -127.1 114.66 18.03 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.998 0.428 . . . . 10.0 110.62 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -74.48 -70.06 0.42 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.885 -0.598 . . . . 10.0 110.113 179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -164.33 143.88 7.61 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.058 -0.519 . . . . 10.0 110.103 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -101.66 94.42 5.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.278 -0.419 . . . . 10.0 110.171 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -152.49 -171.21 3.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.231 -0.441 . . . . 10.0 110.326 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.87 149.7 42.4 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.407 -0.361 . . . . 10.0 110.588 179.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -57.12 -61.26 0.32 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.651 2.234 . . . . 10.0 111.879 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.7 m -150.9 79.66 1.32 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.13 0.491 . . . . 10.0 110.52 179.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -83.75 103.24 12.88 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.963 -0.562 . . . . 10.0 109.508 179.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 20.9 pt -133.73 139.58 34.0 Favored Pre-proline 0 C--N 1.32 -0.678 0 CA-C-N 115.813 -0.631 . . . . 10.0 110.434 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -66.77 136.92 43.71 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.508 2.139 . . . . 10.0 111.261 179.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -120.8 107.82 13.2 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.093 0.473 . . . . 10.0 109.896 -179.427 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -133.04 116.35 16.27 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.408 -0.815 . . . . 10.0 109.714 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.44 120.8 12.36 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.504 179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 13.5 m -144.53 88.78 1.95 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.134 0.492 . . . . 10.0 110.537 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -80.27 121.45 25.65 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.777 -0.647 . . . . 10.0 110.45 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.6 m -73.92 115.6 13.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.077 0.465 . . . . 10.0 110.358 179.181 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.411 ' CE2' ' HB ' ' A' ' 101' ' ' VAL . 91.4 m-85 -84.19 105.27 14.92 Favored 'General case' 0 C--N 1.313 -1.022 0 N-CA-C 109.166 -0.679 . . . . 10.0 109.166 179.296 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -141.05 147.27 38.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.314 -179.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.699 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -75.52 117.3 17.16 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.398 -0.593 . . . . 10.0 109.398 178.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 61.8 p -101.67 152.49 38.09 Favored Pre-proline 0 C--N 1.319 -0.755 0 CA-C-N 116.307 -0.406 . . . . 10.0 111.094 -178.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -64.98 -13.86 42.03 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.655 2.237 . . . . 10.0 112.416 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.5 ptp -86.78 -6.27 58.87 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.93 0.395 . . . . 10.0 110.447 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 74.3 m-20 -84.14 -58.49 2.74 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 179.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 86.19 -60.24 4.6 Favored Glycine 0 N--CA 1.445 -0.754 0 CA-C-N 115.649 -0.705 . . . . 10.0 113.319 178.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 88' ' ' THR . 31.9 p -116.48 166.5 12.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.551 0.691 . . . . 10.0 112.705 -178.329 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.93 -46.25 82.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.368 -1.287 . . . . 10.0 111.392 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 29.9 ttmt -58.27 -56.7 18.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.94 -0.573 . . . . 10.0 110.922 -179.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.1 m -56.49 -42.66 78.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.0 -0.546 . . . . 10.0 111.804 -179.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 50.2 ttp -59.77 -54.09 50.29 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.15 -0.477 . . . . 10.0 110.826 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 95.5 mt -64.81 -36.22 83.63 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.16 -0.473 . . . . 10.0 111.109 -179.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -60.18 -45.34 93.43 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.775 0.321 . . . . 10.0 110.323 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -66.3 -38.87 88.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.869 -0.605 . . . . 10.0 110.634 179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 39.2 m0 -62.57 -53.74 50.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.325 0.583 . . . . 10.0 109.938 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.439 ' HB2' HD23 ' A' ' 126' ' ' LEU . . . -61.36 -39.88 92.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.225 -0.898 . . . . 10.0 111.637 -179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.69 -39.86 81.94 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.295 0.48 . . . . 10.0 112.295 -179.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -66.11 -36.16 82.43 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.87 0.322 . . . . 10.0 111.87 -178.792 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.423 ' HB2' ' SD ' ' A' ' 77' ' ' MET . 19.7 m -103.01 13.48 34.2 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 111.807 0.299 . . . . 10.0 111.807 -179.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 86.6 m-20 54.67 43.33 30.33 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.414 0.626 . . . . 10.0 111.29 179.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.459 ' HE1' HD11 ' A' ' 126' ' ' LEU . 64.2 mtp -102.97 160.49 14.57 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.548 -0.751 . . . . 10.0 110.205 -179.647 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -97.41 154.29 17.56 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.791 -0.448 . . . . 10.0 109.791 179.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 36.7 tp -122.01 133.89 54.81 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.483 0.659 . . . . 10.0 111.438 -179.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.451 ' HB2' HD13 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -114.76 95.39 5.21 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.145 -0.934 . . . . 10.0 109.03 179.04 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.504 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 9.8 t80 -99.94 95.79 7.12 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.987 0.422 . . . . 10.0 109.993 -179.427 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 20.8 m-20 -98.83 10.7 40.73 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.016 -0.538 . . . . 10.0 110.752 -179.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.504 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 40.4 mt -71.0 142.55 87.81 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.017 -0.538 . . . . 10.0 110.13 179.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_endo -56.36 -39.23 92.63 Favored 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.842 2.361 . . . . 10.0 112.349 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 37.9 m -148.07 171.92 15.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.675 0.274 . . . . 10.0 110.585 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 78.4 m-20 -82.32 135.57 35.18 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 179.207 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 77.9 m-85 -113.17 128.62 56.53 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 120.999 -0.281 . . . . 10.0 110.279 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.44 ' HA ' ' HA ' ' A' ' 63' ' ' THR . 0.0 OUTLIER -70.51 148.26 48.44 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.287 -0.415 . . . . 10.0 110.243 179.614 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.36 109.18 0.72 Allowed 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 109.606 -0.516 . . . . 10.0 109.606 179.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.407 HG12 ' H ' ' A' ' 90' ' ' ILE . 8.4 pt -55.94 -37.05 46.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.417 -0.81 . . . . 10.0 112.503 -178.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 151.95 -70.62 0.3 Allowed Glycine 0 CA--C 1.519 0.321 0 C-N-CA 120.193 -1.003 . . . . 10.0 112.995 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -55.31 -16.88 14.36 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 123.544 2.829 . . . . 10.0 113.422 -179.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.488 HG12 ' HB2' ' A' ' 57' ' ' ALA . 21.4 t -59.94 -35.57 61.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.323 -0.399 . . . . 10.0 110.905 179.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.699 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.7 OUTLIER -71.4 -8.71 55.55 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.25 0.463 . . . . 10.0 112.25 -179.106 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -91.15 -1.98 57.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.885 0.374 . . . . 10.0 111.208 -179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 36.9 mt -93.78 107.05 18.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 N-CA-C 109.695 -0.483 . . . . 10.0 109.695 179.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -133.97 91.54 2.83 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.141 0.496 . . . . 10.0 111.792 -179.257 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.6 t -130.33 155.2 46.73 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.861 -0.609 . . . . 10.0 110.117 179.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 3.3 p -87.33 -18.26 30.52 Favored 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 121.003 0.43 . . . . 10.0 110.522 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 2.5 m -88.72 108.53 19.53 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.948 -0.569 . . . . 10.0 109.648 179.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.411 ' HB ' ' CE2' ' A' ' 55' ' ' TYR . 11.3 p -57.36 -33.52 43.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.187 -0.46 . . . . 10.0 111.632 -178.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -67.72 -39.7 84.31 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.953 -0.388 . . . . 10.0 109.953 179.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -66.61 -42.89 86.13 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.431 -0.581 . . . . 10.0 109.431 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -54.29 -50.6 66.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.344 -0.844 . . . . 10.0 110.338 178.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.45 -35.94 79.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.018 -0.537 . . . . 10.0 110.996 179.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 48.0 m -64.53 -45.11 88.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.944 -0.571 . . . . 10.0 110.578 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -72.07 -38.07 69.49 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.889 -0.596 . . . . 10.0 110.597 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 62.8 mt -60.14 -50.72 72.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 10.0 110.666 179.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 72.2 m -58.34 -28.87 65.49 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.305 -0.407 . . . . 10.0 112.054 -179.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.42 -37.24 82.73 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.19 0.519 . . . . 10.0 110.545 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 11.0 t -86.06 -41.01 14.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 121.424 0.63 . . . . 10.0 110.324 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.528 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 14.2 m-30 -66.56 -26.88 67.33 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.857 -1.065 . . . . 10.0 113.11 -178.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.91 -31.21 64.67 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.787 0.292 . . . . 10.0 111.787 -179.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.22 -14.5 60.94 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.853 0.359 . . . . 10.0 111.232 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -107.83 -10.65 15.52 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.242 -0.436 . . . . 10.0 111.088 -179.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 95.2 31.79 7.41 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.645 -0.788 . . . . 10.0 113.155 179.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.528 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 69.1 t -131.1 142.43 43.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 120.871 0.367 . . . . 10.0 110.993 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.409 ' HB2' HG13 ' A' ' 131' ' ' VAL . 0.5 OUTLIER -135.46 138.02 42.77 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.175 -0.676 . . . . 10.0 109.175 178.517 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' ' 127' ' ' LEU . 14.4 m -130.99 143.72 40.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.143 0.496 . . . . 10.0 111.157 -179.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 19.9 m -152.64 153.38 33.21 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.13 -0.486 . . . . 10.0 109.865 179.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.441 HG22 ' CD1' ' A' ' 126' ' ' LEU . 5.7 t -106.1 118.16 53.19 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.257 -0.646 . . . . 10.0 109.257 179.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 68.7 m -140.43 118.46 11.89 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.561 -0.291 . . . . 10.0 111.05 -179.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 60.88 51.06 4.86 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 115.607 -0.724 . . . . 10.0 112.021 179.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 18.7 t30 58.49 28.08 16.44 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.819 -0.628 . . . . 10.0 111.262 179.069 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -136.2 135.68 39.32 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.321 -0.4 . . . . 10.0 110.301 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.459 HD11 ' HE1' ' A' ' 77' ' ' MET . 2.5 mm? -88.84 121.71 31.48 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.916 -0.772 . . . . 10.0 108.916 178.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.451 HD13 ' HB2' ' A' ' 80' ' ' SER . 4.6 mm? -102.19 115.74 31.19 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 120.946 0.403 . . . . 10.0 110.412 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 2.7 t -112.02 118.38 57.53 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 N-CA-C 108.501 -0.926 . . . . 10.0 108.501 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -136.2 144.68 48.98 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-O 120.814 0.34 . . . . 10.0 111.114 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -75.8 141.63 24.63 Favored 'Trans proline' 0 N--CA 1.458 -0.573 0 C-N-CA 122.254 1.969 . . . . 10.0 111.213 178.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.409 HG13 ' HB2' ' A' ' 118' ' ' SER . 7.6 m -113.8 144.47 31.53 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.635 -0.257 . . . . 10.0 110.504 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.36 93.58 1.08 Allowed 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 122.83 2.353 . . . . 10.0 112.161 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 4.2 m -133.04 170.94 19.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.657 -0.701 . . . . 10.0 110.553 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 2.6 p -160.22 134.78 7.56 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.927 -0.579 . . . . 10.0 110.198 179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 4.3 m -115.15 21.14 14.45 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.3 0.572 . . . . 10.0 110.041 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 114.63 155.11 11.03 Favored Glycine 0 N--CA 1.445 -0.744 0 CA-C-N 115.493 -0.776 . . . . 10.0 111.415 -179.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -111.8 127.75 55.9 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.77 0.319 . . . . 10.0 110.455 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 31.2 mttp -87.25 71.31 10.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.062 0.458 . . . . 10.0 110.664 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 29.5 mt . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.511 -0.757 . . . . 10.0 110.254 -179.606 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.516 0 N-CA-C 111.684 -0.566 . . . . 10.0 111.684 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.62 -32.48 73.23 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.991 0.424 . . . . 10.0 110.824 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -160.12 96.95 1.23 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.13 -0.486 . . . . 10.0 110.226 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 59.9 mtt -126.92 72.5 1.36 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.25 0.548 . . . . 10.0 110.474 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.438 ' O ' ' HD3' ' A' ' 26' ' ' PRO . 0.7 OUTLIER -90.11 169.35 11.24 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.867 -0.606 . . . . 10.0 110.674 179.924 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 12.8 mptt -92.18 107.62 24.53 Favored Pre-proline 0 C--N 1.325 -0.496 0 N-CA-C 110.1 -0.333 . . . . 10.0 110.1 179.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.438 ' HD3' ' O ' ' A' ' 24' ' ' THR . 71.6 Cg_endo -83.59 80.91 2.37 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 122.671 2.248 . . . . 10.0 112.362 -179.551 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.431 ' HA ' ' HD3' ' A' ' 28' ' ' PRO . . . -101.47 133.27 20.96 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.893 179.774 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 28.7 Cg_exo -61.9 128.59 24.74 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.612 2.208 . . . . 10.0 111.341 179.146 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -70.11 156.92 38.51 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.135 0.493 . . . . 10.0 111.352 -179.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 34.1 m-85 -88.57 122.48 32.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.937 -0.574 . . . . 10.0 109.783 179.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 114.7 -1.61 23.23 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 111.46 -0.656 . . . . 10.0 111.46 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -79.79 100.02 1.81 Allowed Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 121.192 -0.528 . . . . 10.0 112.559 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 7.0 ttp180 -99.89 -167.51 1.47 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.232 -0.655 . . . . 10.0 109.232 179.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 56.2 m95 63.91 27.43 14.42 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.933 0.397 . . . . 10.0 110.952 179.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -81.89 -34.35 30.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.184 0.516 . . . . 10.0 109.989 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -90.73 91.64 8.47 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.053 -0.721 . . . . 10.0 109.053 178.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 1.6 m -136.19 108.74 8.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.184 0.516 . . . . 10.0 111.668 -179.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 54.5 t30 -152.35 98.82 2.44 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.804 -0.634 . . . . 10.0 110.134 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 5.8 t-160 -86.7 75.44 9.66 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.995 -0.548 . . . . 10.0 109.874 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 53.8 p90 -87.31 -27.61 22.76 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.92 -0.582 . . . . 10.0 110.589 -179.806 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -91.34 87.94 6.66 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.34 0.591 . . . . 10.0 110.376 -179.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -114.97 -62.54 1.59 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.761 -0.654 . . . . 10.0 109.843 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -158.43 144.29 12.4 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 115.786 -0.643 . . . . 10.0 110.193 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -61.76 -42.15 33.75 Favored 'Trans proline' 0 CA--C 1.53 0.306 0 C-N-CA 122.382 2.055 . . . . 10.0 112.46 -179.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.453 HG22 HG12 ' A' ' 47' ' ' ILE . 8.7 m -154.18 87.82 1.21 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.151 0.501 . . . . 10.0 110.982 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -102.58 73.06 1.28 Allowed 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.252 0.548 . . . . 10.0 110.712 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.453 HG12 HG22 ' A' ' 45' ' ' THR . 16.8 pt -140.6 147.02 47.31 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.872 -0.604 . . . . 10.0 109.848 179.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.34 84.43 1.37 Allowed 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.269 1.98 . . . . 10.0 111.758 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -101.65 100.1 10.45 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.489 -0.778 . . . . 10.0 109.876 -179.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -103.71 104.24 14.25 Favored 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.59 -0.732 . . . . 10.0 109.694 179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.19 110.96 2.37 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.92 -0.582 . . . . 10.0 111.108 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -125.76 99.16 5.85 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 116.161 -0.472 . . . . 10.0 109.899 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -69.24 132.02 45.81 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.703 -0.681 . . . . 10.0 111.038 -179.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.6 m -95.46 120.87 36.46 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.593 -0.731 . . . . 10.0 110.642 179.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.498 ' CE2' HG22 ' A' ' 101' ' ' VAL . 36.7 m-85 -82.11 112.29 19.02 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.314 -0.624 . . . . 10.0 109.314 179.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -153.05 160.33 42.95 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.612 -0.722 . . . . 10.0 110.188 -179.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.582 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -76.23 137.63 40.09 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.736 -0.468 . . . . 10.0 109.736 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.433 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 40.0 p -121.9 163.19 32.86 Favored Pre-proline 0 C--N 1.32 -0.71 0 CA-C-N 116.471 -0.331 . . . . 10.0 110.426 -178.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.433 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 71.7 Cg_endo -79.64 10.39 3.1 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 121.443 1.429 . . . . 10.0 112.15 179.013 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 22.1 mmt -112.62 -12.77 13.38 Favored 'General case' 0 C--N 1.333 -0.119 0 N-CA-C 113.518 0.933 . . . . 10.0 113.518 -178.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -71.47 -66.17 0.66 Allowed 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 120.336 -0.546 . . . . 10.0 110.54 -179.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 108.92 -63.73 0.27 Allowed Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 120.995 -0.621 . . . . 10.0 111.734 -179.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 82.1 p -128.93 175.63 8.5 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.729 0.299 . . . . 10.0 110.893 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 50.7 tp -57.95 -41.96 83.96 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.894 -0.594 . . . . 10.0 111.526 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -60.0 -51.11 71.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.365 -0.379 . . . . 10.0 110.775 -179.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -62.01 -41.34 97.96 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.377 -0.374 . . . . 10.0 111.308 -179.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 41.1 ttp -61.41 -50.87 71.1 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.156 -0.475 . . . . 10.0 110.761 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 93.6 mt -63.77 -41.34 97.99 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 10.0 110.784 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -60.06 -41.59 92.67 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.304 -0.407 . . . . 10.0 110.531 179.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 70' ' ' ARG . 11.6 ttm180 -65.67 -44.62 85.71 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.465 179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 44.9 m0 -58.69 -48.25 81.75 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.458 0.647 . . . . 10.0 110.093 179.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.93 -46.13 79.32 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.105 -0.952 . . . . 10.0 111.416 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -56.88 -45.32 82.63 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.359 0.503 . . . . 10.0 112.359 -178.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -64.08 -32.1 73.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.147 0.498 . . . . 10.0 110.811 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.9 m -98.41 12.0 36.35 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.932 -0.577 . . . . 10.0 111.925 -178.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 56.06 43.41 27.06 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.363 0.601 . . . . 10.0 111.204 179.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 72.2 mtp -117.05 173.85 6.43 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.449 -0.796 . . . . 10.0 110.721 -179.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -114.45 166.82 11.29 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.254 -0.43 . . . . 10.0 111.558 -179.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.1 tp -136.62 138.65 41.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.035 -0.529 . . . . 10.0 110.961 -179.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.492 ' OG ' ' HE2' ' A' ' 125' ' ' LYS . 35.5 m -121.4 96.93 5.28 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.378 -0.828 . . . . 10.0 110.475 179.471 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.49 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 8.0 t80 -89.67 108.17 19.52 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.684 -0.689 . . . . 10.0 110.033 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -103.84 12.84 33.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.971 0.415 . . . . 10.0 111.578 -179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.465 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 35.0 mt -87.09 144.97 37.15 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.796 -0.446 . . . . 10.0 109.796 179.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -57.69 -46.71 25.09 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.876 2.384 . . . . 10.0 112.845 -179.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 7.0 m -133.65 161.41 34.72 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.317 -0.401 . . . . 10.0 110.474 -179.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.49 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 2.3 p30 -78.08 147.83 34.53 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.152 -0.476 . . . . 10.0 109.924 179.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -120.02 139.38 52.59 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.142 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -78.57 153.58 31.08 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 110.009 -0.367 . . . . 10.0 110.009 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.542 HD22 ' H ' ' A' ' 89' ' ' LEU . 0.5 OUTLIER -60.33 122.38 14.38 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 108.834 -0.802 . . . . 10.0 108.834 179.239 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 1.7 pt -62.7 -29.8 47.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 113.086 0.773 . . . . 10.0 113.086 -178.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 144.85 -64.77 0.46 Allowed Glycine 0 CA--C 1.517 0.164 0 C-N-CA 120.054 -1.07 . . . . 10.0 112.749 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.419 ' HG2' HG11 ' A' ' 111' ' ' VAL . 33.8 Cg_endo -65.36 0.91 2.39 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.748 2.298 . . . . 10.0 112.847 179.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.8 t -67.8 -42.75 86.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.049 0.452 . . . . 10.0 110.365 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.582 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 0.7 OUTLIER -64.59 -15.08 60.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.988 -0.551 . . . . 10.0 111.321 179.096 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -80.31 -7.27 58.97 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.924 0.392 . . . . 10.0 110.573 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 29.8 mt -96.37 110.85 25.37 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 116.051 -0.522 . . . . 10.0 109.879 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.402 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 11.0 m -139.73 95.54 2.93 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.139 -0.482 . . . . 10.0 110.447 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 9.0 t -131.45 155.97 46.44 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.167 -0.47 . . . . 10.0 110.827 -179.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -88.9 -14.44 36.78 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.086 0.47 . . . . 10.0 110.965 179.309 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 3.3 m -92.84 124.74 37.05 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.099 -0.501 . . . . 10.0 110.513 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.498 HG22 ' CE2' ' A' ' 55' ' ' TYR . 1.2 t -62.22 -46.33 96.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.13 -0.486 . . . . 10.0 111.12 -179.227 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -60.86 -32.87 72.28 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.467 -0.788 . . . . 10.0 110.907 -179.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -71.97 -41.04 68.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.229 -0.441 . . . . 10.0 109.884 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.34 -50.17 75.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.698 -0.683 . . . . 10.0 110.664 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -62.77 -37.54 87.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.159 0.504 . . . . 10.0 110.694 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 37.4 m -63.76 -49.19 73.98 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.752 -0.658 . . . . 10.0 110.806 179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -65.34 -40.37 93.59 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.145 -0.48 . . . . 10.0 110.492 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 47.7 mt -60.57 -51.09 70.89 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-N 116.477 -0.329 . . . . 10.0 110.331 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.4 m -58.5 -33.25 69.62 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.338 -0.392 . . . . 10.0 111.354 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.32 -40.19 93.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.939 0.4 . . . . 10.0 111.048 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.419 HG11 ' HG2' ' A' ' 92' ' ' PRO . 3.9 t -87.78 -39.76 13.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.359 0.6 . . . . 10.0 111.105 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.51 ' HB3' ' HB ' ' A' ' 117' ' ' VAL . 12.7 m-30 -66.58 -24.64 66.37 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.36 -0.836 . . . . 10.0 112.711 -178.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.429 ' O ' HG21 ' A' ' 133' ' ' VAL . . . -51.43 -37.43 48.5 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 111.889 0.329 . . . . 10.0 111.889 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.66 -9.48 54.4 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.807 0.337 . . . . 10.0 111.592 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 22.8 mm-40 -112.35 2.33 16.44 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.864 0.364 . . . . 10.0 110.188 179.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 77.92 26.36 60.51 Favored Glycine 0 N--CA 1.45 -0.385 0 CA-C-N 115.841 -0.618 . . . . 10.0 113.049 179.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.51 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 96.3 t -121.85 140.46 45.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.607 0.242 . . . . 10.0 110.734 -179.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . 0.472 ' HB2' HG13 ' A' ' 131' ' ' VAL . 3.4 t -139.21 140.72 37.84 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.563 -0.532 . . . . 10.0 109.563 179.267 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.449 HG12 HG22 ' A' ' 128' ' ' VAL . 9.8 m -131.19 139.81 50.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.897 0.379 . . . . 10.0 110.657 -179.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 3.1 m -142.89 156.83 44.98 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.605 -0.27 . . . . 10.0 110.382 179.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.53 HG22 ' CD2' ' A' ' 126' ' ' LEU . 5.3 t -109.43 114.44 46.94 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 N-CA-C 108.65 -0.87 . . . . 10.0 108.65 179.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 15.8 m -132.83 118.2 18.68 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 116.371 -0.377 . . . . 10.0 110.668 -178.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 63.6 42.33 6.54 Favored 'General case' 0 C--O 1.235 0.292 0 O-C-N 123.674 0.609 . . . . 10.0 110.752 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 5.4 t30 61.04 27.81 17.64 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.185 -0.916 . . . . 10.0 110.784 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.492 ' HE2' ' OG ' ' A' ' 80' ' ' SER . 36.5 tttt -130.0 135.54 48.4 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 108.985 -0.746 . . . . 10.0 108.985 179.413 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.53 ' CD2' HG22 ' A' ' 121' ' ' VAL . 88.2 mt -88.55 122.63 32.22 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.704 0.288 . . . . 10.0 110.232 -179.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -108.2 125.83 52.09 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.699 -179.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.449 HG22 HG12 ' A' ' 119' ' ' VAL . 6.6 t -113.57 119.95 62.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 109.36 -0.607 . . . . 10.0 109.36 178.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -140.82 148.09 51.11 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.634 0.254 . . . . 10.0 110.51 -179.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -76.89 147.2 26.88 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.378 2.052 . . . . 10.0 111.913 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . 0.472 HG13 ' HB2' ' A' ' 118' ' ' SER . 2.8 m -114.99 149.46 42.54 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 116.384 -0.371 . . . . 10.0 110.922 179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -77.3 99.14 1.27 Allowed 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.737 2.291 . . . . 10.0 112.444 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . 0.429 HG21 ' O ' ' A' ' 113' ' ' ALA . 2.8 m -137.54 22.1 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.803 -0.635 . . . . 10.0 109.915 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.43 ' HB3' ' HG3' ' A' ' 138' ' ' LYS . 1.2 m -72.18 121.36 19.19 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.19 -0.914 . . . . 10.0 110.977 -179.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.6 m -119.38 86.08 2.49 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.907 -0.588 . . . . 10.0 109.468 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 140.92 -154.23 24.27 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.796 -0.638 . . . . 10.0 111.697 -179.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.04 133.74 35.31 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.742 0.306 . . . . 10.0 110.727 -179.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . 0.43 ' HG3' ' HB3' ' A' ' 134' ' ' SER . 27.4 mmmt -134.07 -164.46 1.5 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.346 -0.388 . . . . 10.0 110.187 -179.713 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 16.3 tp . . . . . 0 C--O 1.245 0.852 0 CA-C-O 118.718 -0.658 . . . . 10.0 109.819 179.422 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.686 0 N-CA-C 111.848 -0.501 . . . . 10.0 111.848 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 15.2 m -81.83 115.12 20.89 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.716 0.293 . . . . 10.0 110.219 179.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 15.2 t-80 -75.34 79.36 2.42 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.072 0.463 . . . . 10.0 110.461 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 57.8 mtt -91.72 -4.71 54.74 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.968 -0.56 . . . . 10.0 111.251 -179.144 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -79.17 87.0 4.92 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.083 0.468 . . . . 10.0 110.626 179.648 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.0 mttt -134.62 108.1 10.94 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.937 -0.574 . . . . 10.0 110.764 -179.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_exo -65.51 145.77 83.24 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.445 2.097 . . . . 10.0 110.966 178.679 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.91 147.24 90.14 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.372 -0.376 . . . . 10.0 110.875 -179.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -69.43 -175.71 1.16 Allowed 'Trans proline' 0 C--O 1.235 0.362 0 C-N-CA 122.559 2.173 . . . . 10.0 112.331 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -77.25 168.39 20.14 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.195 -0.457 . . . . 10.0 110.907 -179.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -159.6 106.98 1.71 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.982 -0.554 . . . . 10.0 109.907 -179.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.29 -160.76 10.96 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.99 -0.624 . . . . 10.0 111.678 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 75.83 76.54 0.78 Allowed Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.767 -0.73 . . . . 10.0 112.087 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 13.6 mtp180 -129.39 -174.73 3.36 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 110.38 -0.23 . . . . 10.0 110.38 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 41.7 m95 61.43 33.17 18.8 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 123.667 0.605 . . . . 10.0 110.912 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.2 mtpt -97.39 -176.29 3.46 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 116.169 -0.469 . . . . 10.0 110.944 -179.683 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 55.99 60.15 3.38 Favored 'General case' 0 C--O 1.231 0.102 0 CA-C-N 115.523 -0.762 . . . . 10.0 109.993 -179.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -142.82 28.26 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-N 115.463 -0.79 . . . . 10.0 110.827 -179.001 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -111.64 118.68 36.34 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.988 -0.551 . . . . 10.0 110.384 -179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 39.2 t-80 -65.75 -56.57 11.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.078 -0.51 . . . . 10.0 110.562 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -166.79 133.29 2.37 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.462 -0.336 . . . . 10.0 110.237 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -78.22 98.51 5.9 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.176 -0.466 . . . . 10.0 109.983 179.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -155.98 167.17 31.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.032 -0.531 . . . . 10.0 110.65 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -127.08 155.06 76.55 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.084 -0.507 . . . . 10.0 109.644 179.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -53.02 -47.49 27.28 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.799 2.332 . . . . 10.0 112.22 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 12.2 m -143.44 90.63 2.18 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.077 0.465 . . . . 10.0 110.389 179.149 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.41 91.39 4.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.913 -0.585 . . . . 10.0 110.402 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 16.6 pt -125.07 148.68 61.07 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 115.804 -0.635 . . . . 10.0 110.453 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_endo -68.96 85.91 0.49 Allowed 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.519 2.146 . . . . 10.0 111.932 179.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -128.05 118.91 24.33 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.53 -0.759 . . . . 10.0 110.51 -179.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -90.95 116.53 28.83 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.149 -0.478 . . . . 10.0 110.042 179.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.27 130.32 45.67 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.17 -0.468 . . . . 10.0 110.863 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.3 m -142.06 107.92 5.15 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.974 0.416 . . . . 10.0 110.927 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.423 ' CD2' ' HB3' ' A' ' 74' ' ' ASP . 13.6 t80 -82.04 131.62 35.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.695 -0.684 . . . . 10.0 110.364 179.232 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.1 m -79.14 118.49 21.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.284 0.564 . . . . 10.0 111.084 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -83.5 109.31 17.26 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.751 -0.658 . . . . 10.0 110.184 179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.42 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 12.0 pt20 -147.36 154.82 41.36 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.805 -0.634 . . . . 10.0 109.829 179.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.44 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -85.42 124.59 32.18 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.049 0.452 . . . . 10.0 110.0 179.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.432 ' HB ' ' HD2' ' A' ' 59' ' ' PRO . 73.0 p -117.01 158.91 42.94 Favored Pre-proline 0 C--N 1.317 -0.807 0 CA-C-N 115.828 -0.623 . . . . 10.0 110.225 -179.459 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.432 ' HD2' ' HB ' ' A' ' 58' ' ' THR . 45.2 Cg_endo -68.23 -7.98 21.55 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 121.997 1.798 . . . . 10.0 111.322 179.061 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 52.3 mtm -82.85 -20.33 35.81 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.456 -0.793 . . . . 10.0 109.82 179.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -75.64 -59.39 2.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.857 -0.61 . . . . 10.0 109.461 179.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 91.51 -61.98 2.77 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.799 -0.715 . . . . 10.0 112.938 179.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 49.5 p -124.45 166.29 16.27 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.939 0.399 . . . . 10.0 111.551 -179.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.461 HD13 ' HE2' ' A' ' 112' ' ' TYR . 45.2 tp -56.85 -44.73 82.43 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.492 -0.776 . . . . 10.0 111.217 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.452 ' O ' ' HG3' ' A' ' 69' ' ' GLU . 36.9 ttmt -59.87 -53.62 55.81 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.509 -0.314 . . . . 10.0 110.379 -179.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.559 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 2.3 m -57.49 -43.81 84.46 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 116.423 -0.353 . . . . 10.0 111.069 -179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 52.0 ttp -57.63 -51.52 69.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.121 0.486 . . . . 10.0 110.407 179.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 77.0 mt -64.95 -36.86 85.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.852 -0.613 . . . . 10.0 111.131 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.452 ' HG3' ' O ' ' A' ' 65' ' ' LYS . 22.3 mt-10 -63.86 -41.0 97.88 Favored 'General case' 0 C--N 1.332 -0.175 0 N-CA-C 110.261 -0.274 . . . . 10.0 110.261 179.002 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.559 ' HG2' ' O ' ' A' ' 66' ' ' THR . 32.0 mmt180 -69.32 -39.26 78.33 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.628 -0.508 . . . . 10.0 109.628 179.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 37.6 m0 -61.93 -54.77 37.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.097 -0.502 . . . . 10.0 110.734 179.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.591 ' HB2' HD12 ' A' ' 126' ' ' LEU . . . -59.89 -44.11 94.4 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.643 -0.708 . . . . 10.0 111.531 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.95 -36.25 83.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.734 0.302 . . . . 10.0 111.541 -179.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 70' ' ' ARG . 0.5 OUTLIER -73.28 -12.89 61.01 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.887 0.375 . . . . 10.0 111.424 -179.304 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.5 m -120.58 12.28 11.48 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.437 -0.347 . . . . 10.0 111.312 -179.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 62.2 t30 56.05 51.68 11.6 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.358 0.599 . . . . 10.0 110.619 179.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.422 ' HG2' ' OD1' ' A' ' 124' ' ' ASN . 71.1 mtp -124.27 171.17 10.08 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.984 -0.553 . . . . 10.0 111.029 -179.093 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.411 ' HB2' ' HG3' ' A' ' 125' ' ' LYS . 37.6 mm-40 -101.68 164.87 11.52 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.783 -0.644 . . . . 10.0 110.063 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.7 tp -141.52 142.48 33.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.344 0.593 . . . . 10.0 111.473 -179.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.449 ' HB2' ' HG ' ' A' ' 127' ' ' LEU . 12.9 m -131.12 97.38 4.28 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.13 -0.941 . . . . 10.0 110.525 179.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.644 ' CE2' ' HB2' ' A' ' 83' ' ' LEU . 15.7 t80 -91.01 103.48 16.19 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.81 -0.632 . . . . 10.0 109.298 179.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -93.41 0.99 57.03 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.766 0.317 . . . . 10.0 111.65 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.644 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 2.1 mm? -74.33 137.13 75.01 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-N 116.395 -0.366 . . . . 10.0 110.316 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.56 -26.66 54.12 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.969 2.446 . . . . 10.0 112.577 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 57.2 m -141.19 161.92 36.71 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.946 0.403 . . . . 10.0 111.033 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.402 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 6.6 p-10 -85.91 143.67 28.07 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.815 -0.63 . . . . 10.0 109.974 179.262 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -121.37 134.91 55.13 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.056 -0.52 . . . . 10.0 110.223 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -75.07 161.37 29.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.57 -0.286 . . . . 10.0 110.371 179.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.98 107.96 3.33 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 109.129 -0.693 . . . . 10.0 109.129 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.0 pt -47.99 -46.13 12.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.621 -0.718 . . . . 10.0 112.533 -178.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 165.38 -69.33 0.19 Allowed Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.044 -1.074 . . . . 10.0 112.881 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_endo -56.41 -13.4 10.16 Favored 'Trans proline' 0 N--CA 1.478 0.583 0 C-N-CA 123.661 2.907 . . . . 10.0 113.39 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.421 ' H ' HG23 ' A' ' 93' ' ' VAL . 2.1 t -60.47 -36.31 68.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.246 0.546 . . . . 10.0 110.346 179.692 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.44 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.8 m -69.34 -12.0 61.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.605 -0.725 . . . . 10.0 111.51 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.48 -1.19 53.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.936 0.398 . . . . 10.0 110.921 -179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.42 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 53.6 mt -98.36 113.72 33.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 109.801 -0.444 . . . . 10.0 109.801 179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.1 m -142.29 95.39 2.79 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.273 -0.421 . . . . 10.0 110.979 -179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 10.0 t -131.02 153.58 49.1 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.349 -0.387 . . . . 10.0 110.549 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.09 -8.71 58.54 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.903 0.382 . . . . 10.0 111.315 179.498 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 4.8 t -100.02 119.18 37.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.126 -0.488 . . . . 10.0 110.578 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 12.8 p -65.78 -30.85 51.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-O 121.024 0.44 . . . . 10.0 110.255 179.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -69.07 -41.94 76.88 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 109.417 -0.586 . . . . 10.0 109.417 178.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 52.9 tp60 -66.43 -40.9 89.79 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 115.9 -0.591 . . . . 10.0 109.597 178.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.61 -49.09 78.77 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.595 -0.73 . . . . 10.0 110.331 179.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -61.82 -35.96 79.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.169 0.509 . . . . 10.0 110.221 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 95.0 m -66.14 -49.29 67.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.694 -0.684 . . . . 10.0 110.965 179.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -65.8 -44.73 84.81 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.04 -0.527 . . . . 10.0 111.028 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 64.1 mt -59.85 -49.24 78.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.455 -0.339 . . . . 10.0 110.676 179.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 49.4 m -62.38 -23.45 66.82 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.551 0.204 . . . . 10.0 111.551 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.79 -41.43 78.74 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.837 0.351 . . . . 10.0 110.656 179.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.426 HG13 ' HD1' ' A' ' 112' ' ' TYR . 3.4 p -89.03 -32.63 5.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.408 0.623 . . . . 10.0 111.326 179.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.461 ' HE2' HD13 ' A' ' 64' ' ' LEU . 3.5 m-30 -77.67 -23.42 49.6 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.254 0.835 . . . . 10.0 113.254 -178.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.08 -49.32 42.28 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 111.78 0.289 . . . . 10.0 111.78 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -64.85 -22.86 67.07 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.112 0.482 . . . . 10.0 111.441 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -84.89 -15.02 45.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.264 0.554 . . . . 10.0 110.306 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 94.68 25.99 14.16 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.747 -0.739 . . . . 10.0 112.275 -179.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . 0.424 ' HB ' ' HB3' ' A' ' 112' ' ' TYR . 95.4 t -129.54 138.39 54.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-O 120.929 0.395 . . . . 10.0 110.877 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 4.1 m -138.34 120.98 16.27 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.058 0.456 . . . . 10.0 110.314 178.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.512 HG12 HG13 ' A' ' 128' ' ' VAL . 3.9 m -104.78 137.46 33.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.662 -0.699 . . . . 10.0 110.171 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -148.96 140.47 23.38 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.393 -0.367 . . . . 10.0 110.191 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . . . . . . . . . 1.7 p -107.96 123.2 63.28 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 CA-C-O 121.186 0.517 . . . . 10.0 109.685 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 56.4 m -143.72 132.99 23.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.91 -0.586 . . . . 10.0 110.578 -179.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 59.1 39.86 22.65 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.114 -0.494 . . . . 10.0 111.317 179.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.422 ' OD1' ' HG2' ' A' ' 77' ' ' MET . 18.8 t30 63.81 24.18 13.68 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.488 -0.778 . . . . 10.0 111.048 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.411 ' HG3' ' HB2' ' A' ' 78' ' ' GLN . 41.5 tttt -128.03 133.13 49.08 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.579 -0.737 . . . . 10.0 110.251 -179.605 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.591 HD12 ' HB2' ' A' ' 72' ' ' ALA . 17.2 mt -89.04 121.44 31.38 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.595 -0.891 . . . . 10.0 108.595 178.425 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.449 ' HG ' ' HB2' ' A' ' 80' ' ' SER . 0.3 OUTLIER -117.34 122.95 45.31 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 121.174 0.511 . . . . 10.0 110.876 -179.358 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.531 ' CG1' HD21 ' A' ' 83' ' ' LEU . 1.8 t -111.26 121.03 63.13 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.632 179.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -134.94 146.05 57.09 Favored Pre-proline 0 C--N 1.317 -0.821 0 CA-C-N 116.236 -0.438 . . . . 10.0 110.076 -179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -76.54 150.77 32.09 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 122.316 2.011 . . . . 10.0 111.676 179.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -119.96 147.12 43.66 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-N 116.476 -0.329 . . . . 10.0 110.659 179.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 65.3 Cg_endo -78.48 98.1 1.18 Allowed 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.76 2.307 . . . . 10.0 112.497 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 1.6 m -127.69 19.0 3.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.367 0.604 . . . . 10.0 110.761 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -87.13 101.11 13.17 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.367 -0.833 . . . . 10.0 109.66 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 1.9 m -70.64 131.63 44.21 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.067 -0.515 . . . . 10.0 110.5 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 94.26 -95.97 1.99 Allowed Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 120.719 -0.753 . . . . 10.0 112.183 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -87.62 117.27 26.32 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.731 0.3 . . . . 10.0 111.415 -179.577 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . 0.43 ' C ' ' HD3' ' A' ' 138' ' ' LYS . 7.5 tmtt? -159.87 124.05 3.78 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.133 -0.485 . . . . 10.0 110.312 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 66.7 mt . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.775 -0.631 . . . . 10.0 109.967 179.361 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.711 0 N-CA-C 111.76 -0.536 . . . . 10.0 111.76 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 m -100.26 140.18 34.88 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.278 -0.268 . . . . 10.0 110.278 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -127.57 33.31 4.85 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.381 0.61 . . . . 10.0 110.275 179.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.97 159.98 14.69 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.86 -0.609 . . . . 10.0 109.627 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.6 t -148.96 145.31 27.29 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.85 0.357 . . . . 10.0 110.293 179.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 66.8 mmtt -132.7 71.88 78.1 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 116.281 -0.418 . . . . 10.0 110.813 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -83.64 154.12 13.61 Favored 'Trans proline' 0 N--CA 1.458 -0.56 0 C-N-CA 123.028 2.485 . . . . 10.0 111.823 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -153.78 136.89 10.06 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 116.334 -0.394 . . . . 10.0 110.514 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_exo -57.44 141.02 94.88 Favored 'Trans proline' 0 C--N 1.347 0.451 0 C-N-CA 122.596 2.198 . . . . 10.0 111.495 179.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.94 166.92 12.58 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.245 -0.434 . . . . 10.0 110.553 -179.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -165.89 106.44 0.72 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.091 -0.504 . . . . 10.0 110.009 -179.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 175.78 137.24 2.51 Favored Glycine 0 N--CA 1.444 -0.778 0 C-N-CA 120.896 -0.669 . . . . 10.0 111.965 179.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 131.27 -3.74 5.54 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.58 -0.819 . . . . 10.0 112.56 179.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.2 mtp180 -73.65 -33.03 64.32 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 120.771 0.319 . . . . 10.0 110.768 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 78.4 m95 -82.74 -11.09 58.57 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.053 0.454 . . . . 10.0 110.545 -179.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 50.7 mtmt -94.6 91.82 6.76 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.649 -0.705 . . . . 10.0 109.909 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -146.45 89.85 1.89 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.107 -0.497 . . . . 10.0 110.233 -179.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 12.1 m -137.83 168.29 20.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 116.071 -0.513 . . . . 10.0 110.464 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -120.61 105.25 10.62 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.09 0.471 . . . . 10.0 110.039 179.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 16.5 m170 -82.91 8.41 12.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.109 -0.496 . . . . 10.0 111.043 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -85.56 -1.41 57.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.343 -0.389 . . . . 10.0 110.582 179.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -67.95 130.23 42.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.342 -0.39 . . . . 10.0 110.081 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.18 -64.37 1.16 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.192 -0.458 . . . . 10.0 110.507 -179.469 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -121.85 144.63 41.4 Favored Pre-proline 0 C--N 1.322 -0.624 0 CA-C-N 116.243 -0.435 . . . . 10.0 110.309 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_endo -62.26 -50.25 5.0 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 122.044 1.83 . . . . 10.0 111.523 -179.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.8 m -142.35 107.69 5.02 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.924 -0.58 . . . . 10.0 109.851 179.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -82.88 106.13 14.45 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.916 0.389 . . . . 10.0 110.353 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -129.56 101.72 18.66 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 116.088 -0.505 . . . . 10.0 110.792 -179.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_exo -68.61 99.66 0.64 Allowed 'Trans proline' 0 C--O 1.234 0.306 0 C-N-CA 122.807 2.338 . . . . 10.0 111.419 179.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.1 tp -151.95 119.53 6.06 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.329 -0.396 . . . . 10.0 110.413 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 30.0 t80 -75.09 123.08 24.57 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.48 -0.563 . . . . 10.0 109.48 179.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -58.21 111.95 1.38 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.829 0.347 . . . . 10.0 110.237 179.573 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.6 m -143.02 99.23 3.42 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-O 120.994 0.426 . . . . 10.0 111.107 -179.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 20.8 t80 -68.9 120.18 14.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.527 -0.76 . . . . 10.0 109.931 179.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.8 m -76.95 122.81 25.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.158 -0.474 . . . . 10.0 110.728 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' TYR . . . . . 0.465 ' O ' ' HA ' ' A' ' 97' ' ' SER . 95.2 m-85 -89.96 121.99 32.56 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.562 -0.744 . . . . 10.0 109.979 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.415 ' HA ' ' O ' ' A' ' 96' ' ' ILE . 19.8 pt20 -152.21 153.06 33.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.154 -0.476 . . . . 10.0 110.688 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ALA . . . . . 0.446 ' HB3' ' HA ' ' A' ' 94' ' ' SER . . . -86.17 121.26 28.52 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.66 -0.496 . . . . 10.0 109.66 178.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 52.2 p -111.54 154.41 43.86 Favored Pre-proline 0 C--N 1.322 -0.588 0 CA-C-O 120.69 0.281 . . . . 10.0 111.322 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.92 -10.54 27.26 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.726 2.284 . . . . 10.0 111.83 179.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 21.4 mmt -82.4 -18.54 41.61 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.189 179.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -79.35 -52.78 7.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.694 -0.685 . . . . 10.0 109.575 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 92.82 -67.35 1.85 Allowed Glycine 0 N--CA 1.446 -0.667 0 CA-C-N 115.464 -0.789 . . . . 10.0 112.855 179.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.498 HG21 ' OD2' ' A' ' 86' ' ' ASP . 28.4 p -118.58 169.39 9.83 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.79 0.329 . . . . 10.0 111.512 -179.19 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.525 HD13 ' CE2' ' A' ' 112' ' ' TYR . 41.2 tp -59.35 -36.43 75.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.611 -0.722 . . . . 10.0 110.679 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -61.16 -58.3 8.92 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.764 -0.653 . . . . 10.0 110.527 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.39 -33.31 75.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.239 -0.437 . . . . 10.0 111.161 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.448 ' HB2' ' O ' ' A' ' 63' ' ' THR . 4.4 tmm? -63.03 -54.8 32.53 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.733 -0.667 . . . . 10.0 111.166 -179.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 8.0 mp -68.42 -31.52 70.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.317 -0.401 . . . . 10.0 111.263 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -57.84 -43.5 85.88 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.706 -0.479 . . . . 10.0 109.706 178.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 70' ' ' ARG . 0.0 OUTLIER -68.47 -42.35 78.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.688 -0.687 . . . . 10.0 110.119 179.483 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . . . . . . . . . 25.4 m0 -55.85 -55.42 32.67 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.624 -0.717 . . . . 10.0 110.683 179.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.82 -45.54 85.79 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.072 -0.967 . . . . 10.0 111.702 -178.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.95 -40.76 90.07 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.929 0.344 . . . . 10.0 111.929 -179.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -66.24 -27.83 68.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.012 0.434 . . . . 10.0 111.51 -178.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.405 ' HB2' ' SD ' ' A' ' 77' ' ' MET . 4.0 m -108.76 11.65 26.18 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 112.1 0.407 . . . . 10.0 112.1 -178.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 55.55 48.42 18.76 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.589 0.709 . . . . 10.0 110.67 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.405 ' SD ' ' HB2' ' A' ' 75' ' ' SER . 59.1 mtp -114.65 168.09 10.18 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.554 -0.748 . . . . 10.0 110.164 -179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.424 ' HB3' ' HG3' ' A' ' 125' ' ' LYS . 2.0 mm-40 -99.88 158.99 15.42 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.88 -0.6 . . . . 10.0 110.655 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 26.8 tp -132.83 128.26 36.31 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.571 0.7 . . . . 10.0 110.935 -179.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.418 ' HB2' HD13 ' A' ' 127' ' ' LEU . 69.4 m -114.96 94.75 4.89 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 114.972 -1.013 . . . . 10.0 109.427 178.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.5 ' OH ' ' HA ' ' A' ' 86' ' ' ASP . 12.5 t80 -94.45 101.46 13.38 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.702 -0.681 . . . . 10.0 109.808 -179.164 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -105.23 28.37 7.36 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.99 0.424 . . . . 10.0 111.473 -179.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.49 ' HB2' ' CE2' ' A' ' 81' ' ' TYR . 34.2 mt -96.01 145.85 30.27 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 116.271 -0.422 . . . . 10.0 110.052 179.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.4 -38.43 89.33 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 123.183 2.589 . . . . 10.0 112.547 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.4 m -150.73 171.09 17.71 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.992 0.425 . . . . 10.0 110.888 179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.5 ' HA ' ' OH ' ' A' ' 81' ' ' TYR . 8.9 p-10 -83.1 131.56 35.14 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.718 -0.674 . . . . 10.0 109.839 179.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -103.79 131.74 50.7 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.221 -0.445 . . . . 10.0 110.747 -179.29 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.65 150.8 48.53 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.915 -0.584 . . . . 10.0 111.441 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.449 HD12 ' HA ' ' A' ' 89' ' ' LEU . 0.0 OUTLIER -58.28 108.86 0.67 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 120.977 0.418 . . . . 10.0 110.09 178.481 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.2 pt -52.57 -37.93 25.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.071 -0.968 . . . . 10.0 112.91 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 141.17 -72.38 0.4 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.291 -0.957 . . . . 10.0 112.071 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -57.07 -17.05 23.3 Favored 'Trans proline' 0 C--N 1.35 0.628 0 C-N-CA 123.039 2.493 . . . . 10.0 112.367 179.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 10.2 p -63.8 -32.0 55.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.512 0.672 . . . . 10.0 110.267 178.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.446 ' HA ' ' HB3' ' A' ' 57' ' ' ALA . 1.4 m -72.53 -7.42 49.93 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.153 -0.931 . . . . 10.0 111.08 179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -94.2 -4.72 48.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.315 0.578 . . . . 10.0 110.237 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.415 ' O ' ' HA ' ' A' ' 56' ' ' GLN . 65.1 mt -92.2 112.51 25.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.674 0 CA-C-N 115.422 -0.808 . . . . 10.0 109.82 -179.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.465 ' HA ' ' O ' ' A' ' 55' ' ' TYR . 1.7 m -142.61 97.9 3.2 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.605 -0.725 . . . . 10.0 109.821 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 14.1 t -131.38 157.16 44.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.747 0.308 . . . . 10.0 110.888 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -81.03 -21.79 39.88 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.181 -0.463 . . . . 10.0 111.786 179.884 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 13.2 t -90.16 119.03 30.14 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.771 0.32 . . . . 10.0 110.491 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 8.0 p -65.04 -31.69 55.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 120.85 0.357 . . . . 10.0 110.556 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -68.9 -41.24 78.51 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 109.546 -0.539 . . . . 10.0 109.546 179.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -66.75 -41.43 87.82 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.554 -0.748 . . . . 10.0 109.845 179.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -55.57 -47.09 76.98 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.012 -0.54 . . . . 10.0 110.158 178.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.11 -35.21 80.39 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.916 -0.584 . . . . 10.0 110.295 178.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 86.0 m -65.58 -48.42 72.42 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.859 -0.61 . . . . 10.0 110.228 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -65.17 -37.56 87.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.089 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 1.8 mp -63.91 -52.78 58.29 Favored 'General case' 0 C--O 1.219 -0.508 0 CA-C-N 116.293 -0.412 . . . . 10.0 110.22 178.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 25.6 m -57.91 -29.61 65.24 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 111.967 0.358 . . . . 10.0 111.967 -179.307 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.2 -45.78 91.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.255 0.55 . . . . 10.0 110.51 179.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.718 HG13 ' HD1' ' A' ' 112' ' ' TYR . 11.9 p -89.55 -22.65 6.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-N 115.858 -0.61 . . . . 10.0 111.756 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' TYR . . . . . 0.718 ' HD1' HG13 ' A' ' 111' ' ' VAL . 3.7 m-85 -83.13 -24.08 32.74 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.143 0.794 . . . . 10.0 113.143 -178.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -49.63 -40.11 38.23 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.077 0.399 . . . . 10.0 112.077 -179.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.47 -19.49 63.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.103 0.478 . . . . 10.0 111.402 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -93.72 -2.57 53.63 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.398 0.618 . . . . 10.0 109.632 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.22 23.33 52.01 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 115.466 -0.788 . . . . 10.0 112.625 179.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 60.8 t -124.55 140.25 48.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-O 121.026 0.441 . . . . 10.0 111.546 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 6.6 m -139.94 122.6 16.34 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.359 -0.608 . . . . 10.0 109.359 178.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . . . . . . . . . 10.8 m -114.65 149.35 16.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.143 0.497 . . . . 10.0 111.358 -178.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' SER . . . . . . . . . . . . . 4.0 p -152.13 170.47 19.89 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.088 -0.506 . . . . 10.0 109.872 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' VAL . . . . . 0.503 HG22 ' CD2' ' A' ' 126' ' ' LEU . 3.5 t -125.7 119.07 53.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.173 -0.677 . . . . 10.0 109.173 179.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' SER . . . . . . . . . . . . . 15.3 m -128.73 109.62 11.47 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 116.225 -0.443 . . . . 10.0 111.028 -179.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . 58.99 57.69 3.46 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.63 -0.714 . . . . 10.0 112.06 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 19.9 t30 61.13 21.6 12.0 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 115.569 -0.742 . . . . 10.0 111.782 178.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.424 ' HG3' ' HB3' ' A' ' 78' ' ' GLN . 47.8 tttt -125.54 133.12 52.45 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.984 -0.376 . . . . 10.0 109.984 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.503 ' CD2' HG22 ' A' ' 121' ' ' VAL . 69.6 mt -87.95 122.23 31.31 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.511 -0.551 . . . . 10.0 109.511 179.307 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.418 HD13 ' HB2' ' A' ' 80' ' ' SER . 3.9 mm? -107.93 117.24 33.6 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.917 -0.583 . . . . 10.0 110.533 -179.027 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 11.5 t -109.05 118.06 55.73 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 108.515 -0.92 . . . . 10.0 108.515 178.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -134.19 141.66 40.24 Favored Pre-proline 0 C--N 1.324 -0.519 0 CA-C-O 120.766 0.317 . . . . 10.0 110.569 -179.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_endo -81.31 145.21 14.97 Favored 'Trans proline' 0 N--CA 1.455 -0.75 0 C-N-CA 122.313 2.009 . . . . 10.0 111.365 179.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' VAL . . . . . . . . . . . . . 1.7 m -110.82 145.81 33.13 Favored Pre-proline 0 C--N 1.323 -0.579 0 C-N-CA 120.942 -0.303 . . . . 10.0 110.617 179.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -79.07 88.6 1.44 Allowed 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 122.699 2.266 . . . . 10.0 111.846 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' VAL . . . . . . . . . . . . . 13.1 m -130.93 -175.42 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.627 -0.715 . . . . 10.0 110.109 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 1.1 m -73.89 145.73 44.58 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.95 0.405 . . . . 10.0 110.761 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' SER . . . . . . . . . . . . . 2.6 m -70.07 -38.35 75.72 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.151 0.5 . . . . 10.0 110.031 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -106.15 57.41 0.47 Allowed Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 115.797 -0.638 . . . . 10.0 111.703 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -73.48 98.64 2.81 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.036 0.446 . . . . 10.0 110.626 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -162.04 175.89 11.31 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.779 -0.646 . . . . 10.0 109.617 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.512 -0.756 . . . . 10.0 110.141 179.86 . . . . . . . . 1 1 . 1 stop_ save_